smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
OCC1(CNCc2ccccc2O)CC1	118906811	QKYBREDRXUMMCL-UHFFFAOYSA-N	207.273	1.254	10	20	BDCD	
C[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@@H]1O	230209998	ZISBYCKXKBSNHG-GWCFXTLKSA-N	248.326	1.041	10	20	BDCD	
C[C@H](O)CN(C)Cc1ccc(N(C)C)cc1	130820276	JCJRTEGZBHURBL-NSHDSACASA-N	222.332	1.565	10	20	BDCD	
CNC(=O)CCCN(C)Cc1ccccc1O	179581246	TUYRYOQJROKBQA-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
CN(C)c1ccc(CN2CC(C(=O)O)C2)cc1	86810604	OIPJJWPXICUSRT-UHFFFAOYSA-N	234.299	1.269	10	20	BDCD	
Oc1ccc(F)cc1CNC1CCOCC1	226585435	SFDZOACWMGJKIR-UHFFFAOYSA-N	225.263	1.800	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H](C)CCO)c1	132435488	KVZYOEUWXVLTME-NXEZZACHSA-N	239.315	1.822	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@H]2C[C@@H](O)C2)c1	296026753	SMCBTWJNNKXQTI-MXWKQRLJSA-N	221.300	1.875	10	20	BDCD	
OCC[C@@]1(NCc2ccccc2O)CCOC1	278502761	ODLAHFIZERTMJR-CYBMUJFWSA-N	237.299	1.023	10	20	BDCD	
CC(=O)C(=O)COc1nnc(-c2ccccc2)o1	808023703	UJNIPABXCDBLST-UHFFFAOYSA-N	246.222	1.274	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)c1ccnn1C	817956821	DNEULFXMYJIDND-NSHDSACASA-N	244.342	1.896	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCCCON)c1	902425323	LZKWNYNZSYNYBI-SECBINFHSA-N	240.303	1.332	10	20	BDCD	
C[C@](CO)(NC(=O)c1cc(O)cs1)C1CC1	830385236	IBJWDMKMFIHZIQ-LLVKDONJSA-N	241.312	1.345	10	20	BDCD	
CN[C@@H](C)Cc1noc(Cc2ccc(N)cc2)n1	842621743	DBADWBBFVQFGAL-VIFPVBQESA-N	246.314	1.393	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)CC(N)=O	749128614	JPOBPUJIKUPGNV-NSHDSACASA-N	249.358	1.415	10	20	BDCD	
NC[C@@H]1CCCN(Cc2cccc(F)c2O)C1	843046925	FMUKHBMASMQTNV-JTQLQIEISA-N	238.306	1.702	10	20	BDCD	
CO[C@H](C)CNC(=O)NCc1ccccc1O	852536327	RWPOOZYBQQIEAI-SECBINFHSA-N	238.287	1.226	10	20	BDCD	
CC[S@@](C)(=O)=NC(=O)c1cc(O)cs1	925818251	BKTVMGSTQMHYFW-CQSZACIVSA-N	233.314	1.712	10	20	BDCD	
Cc1cc(O)c(CN(C)C[C@@H](C)N)cc1C	863652441	SYBRAKCPAHUUCB-LLVKDONJSA-N	222.332	1.788	10	20	BDCD	
COc1ccc(CN2C[C@H]3C[C@@H]3C2)c(O)c1OC	895558957	MOASIBAAAWOHQR-GHMZBOCLSA-N	249.310	1.861	10	20	BDCD	
C[C@@H](O)CNCc1ccc2c(c1)CCCO2	82538504	VLVKVLIACPGYNN-SNVBAGLBSA-N	221.300	1.482	10	20	BDCD	
C[C@H](NC[C@H]1CCN1C)c1ccc(F)cc1O	712594663	NPGBUMQSPHPECH-GXSJLCMTSA-N	238.306	1.886	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](C)C(=O)O)c(Cl)c1	1610475943	PZRUQOXEMLDUBZ-ZETCQYMHSA-N	243.690	1.917	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H](N)C1CCC1	399006214	YLGOELQCMSIITL-ZDUSSCGKSA-N	248.326	1.478	10	20	BDCD	
[N-]=[N+]=NCCN1CCc2ccc(CO)cc21	409428920	GZLZURZONVCGQG-UHFFFAOYSA-N	218.260	1.852	10	20	BDCD	
CCC[C@H](N)C(=O)NCc1ccc(N(C)C)cc1	40825885	ADPIDCGBVSPNNC-ZDUSSCGKSA-N	249.358	1.496	10	20	BDCD	
C[C@H](NCC(C)(C)N)c1cc(F)ccc1O	817960660	PDLSIPLKROHPFS-QMMMGPOBSA-N	226.295	1.919	10	20	BDCD	
CC(C)[C@H](C(=O)Nc1ccc(N)cc1)[C@@H](C)N	818556219	BLRQSZJEEZVFFG-SKDRFNHKSA-N	235.331	1.827	10	20	BDCD	
CO[C@H](C)[C@@H](C)NCCc1ccc(N)cc1	817956320	WJAPVKXGDPGUNU-GHMZBOCLSA-N	222.332	1.824	10	20	BDCD	
CCOCCCNC(=O)c1cc(O)cs1	731865110	KHTAWOCAUNOLFQ-UHFFFAOYSA-N	229.301	1.610	10	20	BDCD	
CCOC(=O)[C@@H](C)NC(=O)c1cc(O)cs1	731870650	SMBJDTMMNHVGNH-ZCFIWIBFSA-N	243.284	1.135	10	20	BDCD	
CC(=O)C(=O)CSc1ncc(C(C)C)[nH]1	863363103	ILHWIYJCXLPBRB-UHFFFAOYSA-N	226.301	1.783	10	20	BDCD	
Cc1cccc(O)c1CN(CCO)CC1CC1	876639271	NLIRFMQPFRVNCG-UHFFFAOYSA-N	235.327	1.905	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@@H](N)C1)c1cc(F)ccc1O	873252803	VSDALQXVAIZWDZ-KKZNHRDASA-N	238.306	1.919	10	20	BDCD	
O=C(NOC[C@@H]1CCOC1)c1cc(O)cs1	788592095	OFOCRZNHQPKFRB-SSDOTTSWSA-N	243.284	1.152	10	20	BDCD	
C[C@@H](C[S@@](C)=O)N(C)Cc1ccccc1O	185225776	ZTYJFTVAIDKKCO-MGPLVRAMSA-N	241.356	1.591	10	20	BDCD	
C[C@@H](NC(=O)C[C@H](N)C1CC1)c1ccccc1O	870988544	SCYPGYZZEJNXNI-SKDRFNHKSA-N	248.326	1.697	10	20	BDCD	
NC[C@H]1CCN(Cc2ccc(N)cc2)C1	1336287253	ZLXCWXROESTOCC-LLVKDONJSA-N	205.305	1.049	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC(O)(C2CC2)C1	1350948522	VAWDDGPUXRYHAR-UHFFFAOYSA-N	239.296	1.051	10	20	BDCD	
Oc1ccccc1CNCCN1CC=CCC1	279776656	KXESFHSHMNMETO-UHFFFAOYSA-N	232.327	1.744	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CCN1	84942846	OYQWNBZSFZTHQY-GFCCVEGCSA-N	233.359	1.546	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)[C@H]1CCCO1	817957874	QIRNHEGRXCKETH-BXUZGUMPSA-N	234.343	1.968	10	20	BDCD	
Cc1nnc(COC(=O)c2cc(O)cs2)o1	731912664	XJIUDDZUMITWME-UHFFFAOYSA-N	240.240	1.502	10	20	BDCD	
NCC[C@H](NCc1ccccc1O)C(F)(F)F	841091295	XHQDPJKJBBTBLW-JTQLQIEISA-N	248.248	1.762	10	20	BDCD	
O=C(N[C@H]1CCSC1)c1cc(O)cs1	743734038	ZSXMOEVVDOZLBA-LURJTMIESA-N	229.326	1.689	10	20	BDCD	
CCC(CC)(CN)C(=O)Nc1ccc(N)cc1	843292232	KFFYCJXWMROLNO-UHFFFAOYSA-N	235.331	1.972	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)CC(N)=O	877094857	UWNYBMFZFJVICU-VIFPVBQESA-N	222.288	1.054	10	20	BDCD	
CCCNC(=O)CCNCc1ccccc1O	45071723	XKWYQBGOKYDXLS-UHFFFAOYSA-N	236.315	1.398	10	20	BDCD	
Nc1ccc(CNC(=O)N2CC[C@H](F)C2)cc1	1338793513	RAPQAFVWACZJAE-JTQLQIEISA-N	237.278	1.522	10	20	BDCD	
CC[C@H](C(=O)NCc1ccc(N)cc1)N(C)C	1343474855	ZQZLUPXDFXEWCB-GFCCVEGCSA-N	235.331	1.225	10	20	BDCD	
CC1(C)[C@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@H]21	262606230	BPCHCWGHZNWWOC-BETUJISGSA-N	244.338	1.926	10	20	BDCD	
Cc1ccc(C(=O)NCC(F)(F)F)c(O)c1O	177668999	NETJJNFCYLYGIT-UHFFFAOYSA-N	249.188	1.698	10	20	BDCD	
Cn1cc(CCCNCc2ccccc2O)cn1	237778246	SPHNROWKDMJCBO-UHFFFAOYSA-N	245.326	1.848	10	20	BDCD	
C/C=C\C(=O)NCCc1ccc(O)c(O)c1	223443981	COLGNFDNONZNIV-IHWYPQMZSA-N	221.256	1.333	10	20	BDCD	
Cc1nc(C)c(C(=O)N2CC(N=[N+]=[N-])C2)s1	409423374	NVQOLGBKIWXURS-UHFFFAOYSA-N	237.288	1.895	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@H](C)CC(N)=O)c1	168827853	VBNSXNZJWLOXGX-NXEZZACHSA-N	236.315	1.615	10	20	BDCD	
CN(CC[C@@H]1CCNC1=O)Cc1ccccc1O	821390931	FYUMQBVBOPXJAQ-NSHDSACASA-N	248.326	1.350	10	20	BDCD	
COCC1(NCc2ccccc2O)CC1	308864786	AAXLAEZFTPQDSG-UHFFFAOYSA-N	207.273	1.661	10	20	BDCD	
CCN1C[C@H](NCc2cccc(C)c2O)CC1=O	391598508	IQJJZXCBPKBRLQ-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
OC[C@H]1C[C@H](NCc2ccccc2O)C1	923008615	UBVWPXVROHIHLD-HOMQSWHASA-N	207.273	1.253	10	20	BDCD	
CCN1CCC(NCc2ccccc2O)CC1	38097903	PJBMMFXMSINBFE-UHFFFAOYSA-N	234.343	1.966	10	20	BDCD	
C[C@@H]1CN(C(=O)c2cccc(O)c2O)C[C@H]1C	126472212	URBKVWXSEISMQM-RKDXNWHRSA-N	235.283	1.826	10	20	BDCD	
C[C@@H](CC[S@@](C)=O)NCc1ccccc1O	131297885	RIHUFTMVZIWJMN-QFYYESIMSA-N	241.356	1.639	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](C)CO)c1	83215475	LAIUGMKDMMIOLV-VIFPVBQESA-N	225.288	1.119	10	20	BDCD	
C[C@]1(NC(=O)Nc2ccc(N)cc2)CCCOC1	235710396	OFCBOGXPSWZKSM-ZDUSSCGKSA-N	249.314	1.959	10	20	BDCD	
CCOC(=O)C(=O)c1ccccc1C=S	211314979	ZRGPRYCJOYCNTC-UHFFFAOYSA-N	222.265	1.780	10	20	BDCD	
COC[C@H](O)CNCc1cc(C)c(C)cc1O	282607926	IJZAXUUIVKMGOY-GFCCVEGCSA-N	239.315	1.106	10	20	BDCD	
Cc1ccc(C(=O)OCc2cn[nH]c2)c(O)c1O	803328538	QODGXNAERNILDR-UHFFFAOYSA-N	248.238	1.486	10	20	BDCD	
C[C@H](NCC(F)(F)CN)c1cc(F)ccc1O	817966656	SOHAVPVWDXVRPK-ZETCQYMHSA-N	248.248	1.776	10	20	BDCD	
C[C@@H]1CCNCC[C@H]1NCCc1ccc(N)cc1	817958212	SZESUKHNLPPXMO-IUODEOHRSA-N	247.386	1.789	10	20	BDCD	
CCCN(C)CC(=O)NCc1ccccc1O	730281208	GEZUQSJVSYEMDE-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
CC(C)ONC(=O)Nc1ccc(N)cc1	841300568	WGXJLDVHNCVXPG-UHFFFAOYSA-N	209.249	1.730	10	20	BDCD	
Cc1cccc(CN(C)[C@H](C)CCO)c1O	846112716	WXJIXOCLGKJAJL-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
C[C@H]1OCCN(C(=O)c2cc(O)cs2)[C@@H]1C	768258301	OAUGQKPDNDRFKY-HTQZYQBOSA-N	241.312	1.703	10	20	BDCD	
CCN1CCC[C@H](NCc2ccccc2O)C1=O	722341524	IUZIPLIBJRKZFH-LBPRGKRZSA-N	248.326	1.493	10	20	BDCD	
Cc1cccc(CNC[C@@H](C)C(=O)O)c1O	848637569	JHZXXGBCRKRMIS-SECBINFHSA-N	223.272	1.511	10	20	BDCD	
C[C@@H](CCCO)NCc1cc(F)cc(F)c1O	708485644	MHKRWOVZCVSBPI-QMMMGPOBSA-N	245.269	1.921	10	20	BDCD	
CC(C)(N)CC(=O)Nc1ccc(N)cc1	381577145	YUKXPCRKGINRHZ-UHFFFAOYSA-N	207.277	1.335	10	20	BDCD	
Cc1nc([C@H](C)NCc2ccccc2O)n[nH]1	392461322	LHVOWMZMUHWMSE-QMMMGPOBSA-N	232.287	1.670	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)[C@H](C(=O)O)C1	1604754409	VZBPKHHLDCEGMG-GWCFXTLKSA-N	248.326	1.954	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOC[C@@H]2CCCC[C@@H]21	409435103	SIQVMTCUWUSCED-UWVGGRQHSA-N	238.291	1.714	10	20	BDCD	
C[C@@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1	37801157	QJTLUEHRABXUQI-SNVBAGLBSA-N	235.331	1.058	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@](C)(O)C2)cc1C	180189401	CODGJUKULRVKEF-AWEZNQCLSA-N	235.327	1.966	10	20	BDCD	
CC(C)NCC(=O)NCc1ccc(N(C)C)cc1	40419250	RBUNIQBQCZUBHJ-UHFFFAOYSA-N	249.358	1.367	10	20	BDCD	
C[C@H](N)CN(C)Cc1cc(Cl)ccc1O	379793514	JUOFWLXZINKTNQ-QMMMGPOBSA-N	228.723	1.825	10	20	BDCD	
Cc1cccc(CN[C@@H]2C(=O)NCC[C@@H]2C)c1O	195006952	CNFIXMGENJSMPG-CABZTGNLSA-N	248.326	1.315	10	20	BDCD	
C[C@H](C[S@](C)=O)NCc1cc(F)ccc1O	230392610	ZPIWGRUCNZTYCG-BCTVWOGZSA-N	245.319	1.388	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cnns1	48698473	CQJQONLCWVWTRI-UHFFFAOYSA-N	249.295	1.516	10	20	BDCD	
COc1ccc2c(c1)CCCCN2CC(N)=O	270865718	KXNJLXBBNOSCBV-UHFFFAOYSA-N	234.299	1.323	10	20	BDCD	
COC(=O)c1cnc(S[C@H](C)C(C)=O)s1	295336000	PILSCLJAIULQIV-ZCFIWIBFSA-N	245.325	1.999	10	20	BDCD	
CNCCCN[C@H]1CCc2cccc(O)c21	817943759	SBBGFHPGUTXSLZ-NSHDSACASA-N	220.316	1.579	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCO[C@H]2C[C@H]21	832634316	NHVJPIWNNXPASS-SFYZADRCSA-N	225.269	1.067	10	20	BDCD	
CCc1cccc(CN(CCO)C2CC2)c1O	848882046	WGOJGTMKQBCLDJ-UHFFFAOYSA-N	235.327	1.911	10	20	BDCD	
CCCNCCNCc1cccc(C)c1O	841046350	AWKMWVYHRDIOQT-UHFFFAOYSA-N	222.332	1.790	10	20	BDCD	
CC[C@H](NC(=O)c1cc(O)cs1)C(=O)OC	752824456	QGJSYIJPWUBALR-ZETCQYMHSA-N	243.284	1.135	10	20	BDCD	
CNC[C@@H](C)C(=O)N(C)c1ccc(N)cc1	877079318	XNUKTTXWEIFNPB-SECBINFHSA-N	221.304	1.087	10	20	BDCD	
c1csc(Sc2nnnn2C2CC2)n1	799581450	GJMHTFKKKJZGGK-UHFFFAOYSA-N	225.302	1.616	10	20	BDCD	
CO[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)C1	706539467	VISHEDMAZOGAOL-JOCQHMNTSA-N	233.311	1.889	10	20	BDCD	
Cc1cccc(CN(C)C[C@H](C)C(=O)O)c1O	1600531308	MOPYHCMIIOSMTG-JTQLQIEISA-N	237.299	1.853	10	20	BDCD	
CC[C@H](O)CCNCc1cccc(C)c1O	162707492	OGZPYHXVMOFFQT-LBPRGKRZSA-N	223.316	1.951	10	20	BDCD	
CC[C@@H]1C(=O)NCCN1Cc1ccccc1O	179569573	GGLCHVFBJMYZOX-LLVKDONJSA-N	234.299	1.103	10	20	BDCD	
C[C@H](NC[C@@H](C)O)c1ccc(F)cc1O	62745809	XANCXORUHDNVIG-SFYZADRCSA-N	213.252	1.563	10	20	BDCD	
O=C(NC[C@@H]1CCCO1)c1cccc(O)c1O	126232775	YVWDDPBRRYQZGI-QMMMGPOBSA-N	237.255	1.007	10	20	BDCD	
Cc1ccc(O)c(CN[C@]2(C)CCOC2)c1	120219939	LVDQYCYSVHYLAD-CYBMUJFWSA-N	221.300	1.969	10	20	BDCD	
CC[C@@H](COC)NCc1cc(OC)ccc1O	79732922	PFPUQDSLZDIWCX-NSHDSACASA-N	239.315	1.915	10	20	BDCD	
N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3O)C[C@H]21	228534721	QWWVLFDTKNSXHH-MRVWCRGKSA-N	246.354	1.951	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)CC[C@@H]1N	86884217	PNNFQMRBBZTXKA-JQWIXIFHSA-N	220.316	1.561	10	20	BDCD	
O=C(CSC(F)F)NCc1ccccc1O	295268853	OHXWDINYSVJGGF-UHFFFAOYSA-N	247.266	1.964	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@H](O)C2)cc1Cl	824567401	SJZRSAKIEJIOKM-JTQLQIEISA-N	241.718	1.921	10	20	BDCD	
Cc1cccc(O)c1CN1CCC(CO)CC1	876565343	UONBVIDFVNFOSO-UHFFFAOYSA-N	235.327	1.905	10	20	BDCD	
CC1(C)[C@@H](O)C[C@@H]1NC(=O)c1cc(O)cs1	779454374	OFXYHRFAMFZCKW-IUCAKERBSA-N	241.312	1.343	10	20	BDCD	
Cn1cccc1CNC(=S)NC1(C)CC1	789252459	ARJVTNAVTBXCPL-UHFFFAOYSA-N	223.345	1.542	10	20	BDCD	
COc1ccc(O)c(CN(C)Cc2ncc[nH]2)c1	894586701	SDCYMBJQGWSMSA-UHFFFAOYSA-N	247.298	1.756	10	20	BDCD	
CCC[C@@H]1CN(C(=O)CN=[N+]=[N-])CC[C@@H]1O	409434358	OUMXGGWRZNIASL-BDAKNGLRSA-N	226.280	1.306	10	20	BDCD	
Nc1ccc(CNCCC[C@@H]2CCCN2)cc1	1334774492	JZLQYSTWUJVOHP-CQSZACIVSA-N	233.359	1.891	10	20	BDCD	
Oc1ccccc1CNc1nccn2cnnc12	163146105	KETVMIPZESSKMW-UHFFFAOYSA-N	241.254	1.442	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@H]1CCOC1	708442596	NPJWPQHEVJSVSL-MRVPVSSYSA-N	243.253	1.797	10	20	BDCD	
Cc1ccc(CNC[C@H]2CCCO2)c(O)c1	83351376	VWPMPZYUZZIETO-GFCCVEGCSA-N	221.300	1.969	10	20	BDCD	
C[C@@H](CC(=O)O)C(=O)NCc1ccccc1O	827296640	VQGQKJXZWCAZMF-QMMMGPOBSA-N	237.255	1.119	10	20	BDCD	
N[C@H]1C[C@H](NCc2c(O)cccc2Cl)C1	906508055	JJWYSOKWIOPIDV-ZKCHVHJHSA-N	226.707	1.625	10	20	BDCD	
CN(Cc1c(O)ccc(Cl)c1F)C1CNC1	843125941	DBSIYOQWPIIESH-UHFFFAOYSA-N	244.697	1.588	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@@H]2C[C@H]2C1	862558308	LPQORGGHVMINQT-BQBZGAKWSA-N	209.270	1.546	10	20	BDCD	
Oc1ccc(F)cc1CNCCOCC(F)F	189001989	TYISXAPPLMAESM-UHFFFAOYSA-N	249.232	1.903	10	20	BDCD	
CCN(C[C@H](C)O)c1ccc(OC)c(OC)c1	799129861	XQXHFAWLWXSWPE-JTQLQIEISA-N	239.315	1.911	10	20	BDCD	
CCS(=O)(=O)NCc1cc(C)ccc1O	1331575496	WGPVCIUJPDMGGK-UHFFFAOYSA-N	229.301	1.140	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@@H](C)c1ccc(N(C)C)cc1	161364297	PUUJPRYFYWJEQB-QWRGUYRKSA-N	249.358	1.667	10	20	BDCD	
Cc1ccc(CNCC2(N(C)C)CC2)c(O)c1	877592756	JOMFVVJDDUNLTE-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
Nc1ccc(CN2CCC[C@@H]2CCO)cc1	304518113	GSXHOCYOBCPKRU-CYBMUJFWSA-N	220.316	1.616	10	20	BDCD	
COCCCC(=O)NCc1ccccc1O	136334151	JUCSKOCWJPEYAU-UHFFFAOYSA-N	223.272	1.435	10	20	BDCD	
COCCCCNCc1cccc(OC)c1O	44655544	KTBZANAOSQMAHK-UHFFFAOYSA-N	239.315	1.917	10	20	BDCD	
C[C@@H]1CN(Cc2cc(Cl)ccc2O)CCN1	83368862	NMMDMEAHCWQPCY-SECBINFHSA-N	240.734	1.839	10	20	BDCD	
CC(C)[C@@H](O)C(=O)NCc1ccccc1O	286850710	WYWJICIYQGQFFQ-LLVKDONJSA-N	223.272	1.025	10	20	BDCD	
CC[C@@H](C)C[C@@H](N)C(=O)N(C)c1ccc(N)cc1	1122172278	BLIHYHPTGDYKMA-ZWNOBZJWSA-N	249.358	1.995	10	20	BDCD	
Cc1cc(O)c(CN2C[C@@H](O)C[C@H]2C)cc1C	788271151	ZFINUBFKVCKIBR-YPMHNXCESA-N	235.327	1.964	10	20	BDCD	
Nc1ccc(CC(=O)N2CC[C@H](CF)C2)cc1	711436038	WQMXARZMADWBFQ-LLVKDONJSA-N	236.290	1.629	10	20	BDCD	
COc1cccc(CNC(=O)[C@@H]2C[C@@H]2F)c1O	1521265819	ISVLACGKSOTNQH-BDAKNGLRSA-N	239.246	1.375	10	20	BDCD	
COC[C@@H](CO)N[C@H](C)c1ccc(F)cc1O	234899882	BTGOLSAUKLMKSA-PSASIEDQSA-N	243.278	1.189	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)CC(C)(C)O	269460121	HQLDPDIZYGXIJU-UHFFFAOYSA-N	236.359	1.955	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCc2nnn(C)n2)c1	398085990	PWCOULVFQNYCQJ-VIFPVBQESA-N	247.302	1.075	10	20	BDCD	
COc1ccc(C(=O)N2CC(N=[N+]=[N-])C2)cn1	409424584	WOMKXOZNQGWHPM-UHFFFAOYSA-N	233.231	1.225	10	20	BDCD	
CON(C)C(=O)NCc1ccc(N(C)C)cc1	180861151	NUTLNKKXPOWGAB-UHFFFAOYSA-N	237.303	1.455	10	20	BDCD	
Oc1ccc(F)cc1CN1CCCNCC1	219395258	XQKYBEAAJDLBQD-UHFFFAOYSA-N	224.279	1.327	10	20	BDCD	
COCCN[C@@H]1CCc2cccc(O)c21	379915205	BKZDMIBKDLLAMJ-SNVBAGLBSA-N	207.273	1.616	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2CC(=O)N(C)C2)cc1C	266204937	MHNXCSVKFLGXDH-LBPRGKRZSA-N	248.326	1.329	10	20	BDCD	
C[C@H](CO)N(C)Cc1cc(Cl)cc(F)c1O	809745046	CNZDUMXQJULCOH-SSDOTTSWSA-N	247.697	1.997	10	20	BDCD	
Cc1ccc(O)c(CN2CC(=O)N[C@@H](C)C2)c1	295121622	XKYGWRHTVCFKBH-JTQLQIEISA-N	234.299	1.021	10	20	BDCD	
C[C@H](NCC1CNC1)c1cc(Cl)ccc1O	817966053	ZVIGAVMDUOPHNA-QMMMGPOBSA-N	240.734	1.916	10	20	BDCD	
Oc1c(F)cc(Cl)cc1CN[C@H]1C[C@H](O)C1	827827377	TVHSQSPMIVDEGL-KYZUINATSA-N	245.681	1.798	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@@H](O)[C@H]2C)c1	825104360	VAHWINBGHXMZJQ-BXKDBHETSA-N	237.299	1.356	10	20	BDCD	
CCc1cccc(CN2CCC(O)CC2)c1O	848879805	CXDRNVJOSUAJFZ-UHFFFAOYSA-N	235.327	1.911	10	20	BDCD	
CCN(CCO)Cc1ccc(N(C)C)cc1C	840908261	RDGDSXBYXVVFHC-UHFFFAOYSA-N	236.359	1.875	10	20	BDCD	
CNC[C@@H](C)NCc1cccc(F)c1O	853248811	KJLGMMHKAVTBTG-MRVPVSSYSA-N	212.268	1.229	10	20	BDCD	
C[C@H](NCc1cc(Cl)ccc1O)C(=O)O	49354031	ZLYASCUGZWQAMC-LURJTMIESA-N	229.663	1.608	10	20	BDCD	
CC1(C)[C@H](O)C[C@H]1NC(=O)c1cc(O)cs1	779454376	OFXYHRFAMFZCKW-RKDXNWHRSA-N	241.312	1.343	10	20	BDCD	
Cc1ccc(C(=O)N(C)CC(F)F)c(O)c1O	770483559	QYQYSMBWBLQECX-UHFFFAOYSA-N	245.225	1.743	10	20	BDCD	
CC[C@@H]1C[C@H]1NC(=O)NCc1ccc(N)cc1	1120535249	GKFLAQPGXUDDEV-ZYHUDNBSSA-N	233.315	1.867	10	20	BDCD	
CN(C)c1ccc(CN)cc1Br	169171508	ACFNFJWCIIRIKU-UHFFFAOYSA-N	229.121	1.974	10	20	BDCD	
CCC[C@](C)(N)C(=O)NCc1ccccc1O	166202120	OASVFSFRYKMVLU-ZDUSSCGKSA-N	236.315	1.526	10	20	BDCD	
COC(=O)CN[C@H](C)c1ccccc1O	19885372	AHEHBHRFEXHPMT-MRVPVSSYSA-N	209.245	1.216	10	20	BDCD	
Cc1ccc(CN[C@H]2CO[C@H](C)C2)c(O)c1	877608212	RMPDYCVKXDRFNL-ZYHUDNBSSA-N	221.300	1.968	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@H](OC)C1	1341568513	YYGNHYLFMHKRPH-JTQLQIEISA-N	237.299	1.622	10	20	BDCD	
CN(CC1CC1)C(=O)Cc1ccc(N)cc1	37895357	OOROGFNPVGTMQT-UHFFFAOYSA-N	218.300	1.680	10	20	BDCD	
COCC[C@@H](C)NC(=O)c1cccc(O)c1O	126446037	HLYGXWSMCWEILE-MRVPVSSYSA-N	239.271	1.253	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cccc(OC)c1O	42304334	HAAPXFRDLPBRIG-MRVPVSSYSA-N	239.271	1.052	10	20	BDCD	
COC(=O)CN(C)c1ccc(OC)cc1	49970435	XUIKDJJTYJYVES-UHFFFAOYSA-N	209.245	1.304	10	20	BDCD	
C[C@H](CN)CNCc1ccc(N(C)C)cc1	381507810	FLZSRPBQLLLFPO-LLVKDONJSA-N	221.348	1.437	10	20	BDCD	
Cc1ccc(O)c(CN(C)CCC(N)=O)c1	289199580	BINAOBYEHDDAMC-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
COC(=O)[C@@H](C)CN(C)Cc1ccccc1O	179561075	HUTHAPJQIZLUPV-JTQLQIEISA-N	237.299	1.633	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCc2c[nH]nc2C1	363940274	XOOYODZUZZPZDV-GFCCVEGCSA-N	243.310	1.762	10	20	BDCD	
CC(C)(O)C(C)(C)NC(=O)c1cc(O)cs1	831586948	FXIGEXURFCYZHD-UHFFFAOYSA-N	243.328	1.733	10	20	BDCD	
CC(C)[C@H](C)NC(=O)CN(C)c1ccc(N)cc1	49308661	OIQCJFJARQWGQA-NSHDSACASA-N	249.358	1.866	10	20	BDCD	
COC[C@H](C)NCc1cc([N+](=O)[O-])ccc1O	83367817	YMLVWYFKTIYGOM-QMMMGPOBSA-N	240.259	1.425	10	20	BDCD	
Cc1ccc(O)c(CN(C)CCN(C)C)c1	90502368	GARQVGVPSKWBPU-UHFFFAOYSA-N	222.332	1.694	10	20	BDCD	
CC(C)NCCC(=O)NCc1ccc(N)cc1	1342019362	CVWWQPXJSVAAQQ-UHFFFAOYSA-N	235.331	1.273	10	20	BDCD	
CS[C@@H](C)C(=O)NCc1ccc(O)c(O)c1	159052225	BPRFPKOTKDJGFB-ZETCQYMHSA-N	241.312	1.466	10	20	BDCD	
OCC1(CCNCc2cc(F)ccc2O)CC1	395859300	LVZMPOPLADPGRU-UHFFFAOYSA-N	239.290	1.784	10	20	BDCD	
Nc1ccc(CNC(=O)N2CCC2)cc1	1357791156	JVYRIUYPKZLETK-UHFFFAOYSA-N	205.261	1.184	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@H]1C[C@H]1C(=O)O	1593303165	DGQRJLQGOSIMFY-JMJZKYOTSA-N	235.283	1.591	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1CCCNC1	226436619	KYIFDPHWLQVXLE-LBPRGKRZSA-N	234.343	1.824	10	20	BDCD	
N[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1O	818431366	JVQQCIAEKOXKQR-VXGBXAGGSA-N	238.306	1.891	10	20	BDCD	
C[C@@H](NCC(C)(C)N)c1cc(F)ccc1O	817960658	PDLSIPLKROHPFS-MRVPVSSYSA-N	226.295	1.919	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC/C=C\CO	826940269	BCNRSOCYNMVCFS-PLNGDYQASA-N	234.343	1.699	10	20	BDCD	
COC(=O)[C@H](C)OC(=O)c1cc(O)cs1	732354656	PNAVVPSWPNKGDM-YFKPBYRVSA-N	230.241	1.172	10	20	BDCD	
COc1cccc([C@@H](C)NCCCCO)c1O	846163985	CVMARBGNKMFGQA-SNVBAGLBSA-N	239.315	1.824	10	20	BDCD	
CCNCCNCc1cccc(OC)c1O	841036324	LFPRANYAVYHXEP-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
CC[C@@H]1NCC[C@@H]1C(=O)N(C)c1ccc(N)cc1	877076930	XHOHEXKVNJZYNP-STQMWFEESA-N	247.342	1.620	10	20	BDCD	
Cc1nc(C(=O)N[C@H](C)c2ccccc2O)no1	866161282	MEORVYJIIMVXLW-SSDOTTSWSA-N	247.254	1.575	10	20	BDCD	
C[C@H](NCCOCCO)c1ccccc1O	20198667	PBTPIRZNGQDKSH-JTQLQIEISA-N	225.288	1.052	10	20	BDCD	
C[C@@H](N)CN(C)Cc1c(O)cccc1Cl	309052957	QWNWNEWMQKKWDT-MRVPVSSYSA-N	228.723	1.825	10	20	BDCD	
COc1cccc(O)c1CNC[C@H](C)N(C)C	824988529	LYFVAXFUMCOLOO-JTQLQIEISA-N	238.331	1.441	10	20	BDCD	
CO[C@@H]1COC[C@H]1NCc1ccc(C)cc1O	877606392	ZQTFFZOGPHGKHF-DGCLKSJQSA-N	237.299	1.204	10	20	BDCD	
Cc1cc(O)c(CN2CCNC(=O)[C@H]2C)cc1C	123439899	MZOLEOIKMNEBCH-LLVKDONJSA-N	248.326	1.329	10	20	BDCD	
O=C(O)[C@H]1CCN(Cc2ccccc2O)C1	83413616	BBSGSCVFNYIJCI-JTQLQIEISA-N	221.256	1.299	10	20	BDCD	
CC[C@](C)(CO)NCc1cc(OC)ccc1O	80886384	TWPRLAVIYIFZAK-CYBMUJFWSA-N	239.315	1.651	10	20	BDCD	
Oc1ccccc1CNCC[C@@H]1CCOC1	230162478	DAHAPXXJMSHNIM-LLVKDONJSA-N	221.300	1.908	10	20	BDCD	
C[C@@H](N)C[C@@H](C)NCCc1ccc(N)cc1	817957702	OJXZJKQEDWOGGP-GHMZBOCLSA-N	221.348	1.527	10	20	BDCD	
C[C@H](N[C@H](C)CN)c1cc(F)ccc1O	817966283	KHDXHVNKKFDADO-SFYZADRCSA-N	212.268	1.529	10	20	BDCD	
COCCN(C)C(=O)c1cc(O)cs1	732275022	QEBZYTXSXGATOA-UHFFFAOYSA-N	215.274	1.172	10	20	BDCD	
C[C@H](CN)NCc1ccc(N(C)C)c(F)c1	841060208	UJBGNCBHADCKJF-SECBINFHSA-N	225.311	1.329	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](O)C1)c1cc(F)cc(F)c1O	850578467	LJEXDUAEJVWNTA-XVYDVKMFSA-N	243.253	1.844	10	20	BDCD	
Cc1ccc(CN[C@@H](C)c2ncnn2C)c(O)c1	877469783	YZGJLWRXBPDSFG-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
CC(C)[C@@H](N)C(=O)N(C)c1ccc(N)cc1	877077744	SNVFNVQGZNGTDN-LLVKDONJSA-N	221.304	1.215	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@@H](CO)C2(CCCC2)C1	409428937	HATBMZIFAIKERV-VIFPVBQESA-N	238.291	1.308	10	20	BDCD	
C[C@@H](CN)CNCc1ccc(N2CCCC2)cc1	1325321309	ULLQYCQEJCOJCD-ZDUSSCGKSA-N	247.386	1.971	10	20	BDCD	
C[C@@H](CCNC(=O)Cc1ccc(N)cc1)N(C)C	697921093	TUFNPGDXMCDHJK-NSHDSACASA-N	249.358	1.268	10	20	BDCD	
CC(C)[C@@H](CNCc1cc(F)ccc1O)ON	1575433237	MJFRTALIISZTKW-GFCCVEGCSA-N	242.294	1.536	10	20	BDCD	
C[C@@H](NC[C@H]1CCCN1)c1ccccc1O	817953305	ZTIDAOBFFIIORT-GHMZBOCLSA-N	220.316	1.795	10	20	BDCD	
CN(C)c1ccc(CNCC(C)(C)N)cc1	309326482	IACLULAJMUFWAT-UHFFFAOYSA-N	221.348	1.580	10	20	BDCD	
COc1ccc(CN[C@H](C)CCO)cc1C	96811713	JZWQQYLOIBFNIM-LLVKDONJSA-N	223.316	1.864	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](C)NC[C@H]2C)c1	251169881	PRPHOYXHQQRYFY-VXGBXAGGSA-N	234.343	1.883	10	20	BDCD	
CC1=NO[C@@H](C(=O)NCCc2ccc(N)cc2)C1	911782218	FDPFUEXTXMMHEW-GFCCVEGCSA-N	247.298	1.092	10	20	BDCD	
COc1cccc(CN[C@@H](C)CCCN)c1O	841081724	XNQRCOKPFGPEIV-JTQLQIEISA-N	238.331	1.618	10	20	BDCD	
COC(C)(C)c1cn(-c2ccc(N)cc2)nn1	849134536	GXKNDCGHFNODKT-UHFFFAOYSA-N	232.287	1.731	10	20	BDCD	
OC/C=C\CNCc1ccc2c(c1)CCCO2	922240085	MWUMQXOCOCAZMR-UPHRSURJSA-N	233.311	1.650	10	20	BDCD	
CC(=O)CN(C(=O)c1cc(O)cs1)C(C)C	868597691	SJCVTQIVAWCKJS-UHFFFAOYSA-N	241.312	1.893	10	20	BDCD	
CN(C(=O)[C@@]1(C)CCNC1)c1ccc(N)cc1	877079016	NVEXKBOHNDVLBS-ZDUSSCGKSA-N	233.315	1.231	10	20	BDCD	
Nc1ccc(CN2CC[C@H](n3cncn3)C2)cc1	1120268175	BDDUVSMCFJYLSM-ZDUSSCGKSA-N	243.314	1.307	10	20	BDCD	
CC[C@H]1CC[C@@H](C(=O)NCc2ccccc2O)O1	268268061	SCKRTXXBQFWARL-AAEUAGOBSA-N	249.310	1.966	10	20	BDCD	
C[C@H]1C[C@H](C(=O)NCc2ccccc2O)CCO1	271910521	ZBWBPGVRAFXHSS-WDEREUQCSA-N	249.310	1.824	10	20	BDCD	
CC(C)(O)CCNCc1cc(F)cc(F)c1O	708484427	JIGCYQJPLKHEEF-UHFFFAOYSA-N	245.269	1.921	10	20	BDCD	
CC[C@@H](NCc1cc(F)cc(F)c1O)C(=O)O	1331981050	ANBZVYGKDDBTPF-SECBINFHSA-N	245.225	1.623	10	20	BDCD	
CNC[C@@H]1C[C@H](F)CN1Cc1ccc(N)cc1	1335289235	LGODUJVVDMIHHA-AAEUAGOBSA-N	237.322	1.401	10	20	BDCD	
C[C@H](CC(=O)O)N[C@H]1CCc2cccc(O)c21	1609888473	MKXGPOVVPDNROH-SCZZXKLOSA-N	235.283	1.832	10	20	BDCD	
CCOc1cccc(CNCCOC)c1O	19881388	WPCPVEWNKRKHFY-UHFFFAOYSA-N	225.288	1.527	10	20	BDCD	
Cn1nncc1NCc1ccc(N)cc1	300987462	SXMDBVNYWOMKAK-UHFFFAOYSA-N	203.249	1.009	10	20	BDCD	
CC(C)N1CCN(Cc2ccccc2O)CC1	132262164	BPYQIJRBMRYZIE-UHFFFAOYSA-N	234.343	1.918	10	20	BDCD	
Cc1cccc(CN[C@@H]2C(=O)NCC[C@H]2C)c1O	195006923	CNFIXMGENJSMPG-SKDRFNHKSA-N	248.326	1.315	10	20	BDCD	
CC[C@H]1CC[C@H](C(=O)NCc2ccccc2O)O1	268268065	SCKRTXXBQFWARL-WCQYABFASA-N	249.310	1.966	10	20	BDCD	
CNCCN[C@H](C)c1ccc(C)c(C)c1O	817951066	AWLZTZIGBHAJHS-LLVKDONJSA-N	222.332	1.879	10	20	BDCD	
N[C@@H](CNCc1ccc2c(c1)CCCO2)C1CC1	904355461	NYYSKDABVXZCNC-AWEZNQCLSA-N	246.354	1.839	10	20	BDCD	
CCN(CC)CCNC(=O)c1cc(O)cs1	731867083	DSAWENSFKSHEIH-UHFFFAOYSA-N	242.344	1.525	10	20	BDCD	
COc1ccc(N(CCN)CC2CC2)cc1	866672577	OKUHZXNKYAAVKY-UHFFFAOYSA-N	220.316	1.870	10	20	BDCD	
CC[C@H](CO)N[C@H](C)c1cccc(OC)c1O	846135201	CBSCDJISGIIBOI-NXEZZACHSA-N	239.315	1.822	10	20	BDCD	
Cc1nc[nH]c1CNC(=O)c1cc(O)cs1	748405857	NKZNTKNNDQSCTO-UHFFFAOYSA-N	237.284	1.415	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCNC2)c1	841045294	RWMBHNISLYVOCP-NSHDSACASA-N	206.289	1.152	10	20	BDCD	
C[C@@H](N[C@H](CO)CCF)c1ccc(F)cc1O	846209239	PSFJOTYKKADFFM-SCZZXKLOSA-N	245.269	1.902	10	20	BDCD	
COc1cc(Cl)cc(CN[C@H](C)CN)c1O	841061123	VQHPHRTXVBTDJF-SSDOTTSWSA-N	244.722	1.491	10	20	BDCD	
CC[C@@H](C)[C@H](O)CNC(=O)c1cc(O)cs1	771063150	DWGIYFSCZSKYSC-VXNVDRBHSA-N	243.328	1.591	10	20	BDCD	
Nc1ccc(N2CC(F)(F)C[C@@H]2CO)cc1	409425175	AAGZARSDXOYBBB-SNVBAGLBSA-N	228.242	1.475	10	20	BDCD	
CCC[C@@H]1CN(CCN=[N+]=[N-])CC[C@H]1O	409436166	YLGIUOBHGZQVTH-NXEZZACHSA-N	212.297	1.780	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@@](CO)(C(F)(F)F)C1	409435885	XBRDAPSANVZJFR-SSDOTTSWSA-N	238.213	1.543	10	20	BDCD	
CNC[C@@H](C)NCc1ccc(N2CCCC2)cc1	1328508082	VNHGWXULYLLCMK-CYBMUJFWSA-N	247.386	1.984	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1C[C@@H](N)C1	693621490	UGLHCOKVNGVNAC-PHIMTYICSA-N	234.299	1.088	10	20	BDCD	
COc1ccc(CNC[C@H]2C[C@@H](O)C2)cc1C	720993358	DLBMJNPUUCTAPF-BETUJISGSA-N	235.327	1.864	10	20	BDCD	
CNC(=O)CCNCc1cccc(Cl)c1O	162832742	CUJIUPRDKVVFPO-UHFFFAOYSA-N	242.706	1.271	10	20	BDCD	
C[C@@H](N)[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1	156759449	XSTOFIDUSPSWHN-GHMZBOCLSA-N	249.358	1.352	10	20	BDCD	
C[C@H](NC1CCNCC1)c1ccccc1O	817936703	QCWHHMJSBHJMIP-JTQLQIEISA-N	220.316	1.795	10	20	BDCD	
CN(CCCN)Cc1cc(Cl)ccc1O	227742660	YCRPECFCLXYNHK-UHFFFAOYSA-N	228.723	1.826	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccccc2O)CCNC1	228420648	LWUNGFLQLDLZNZ-CYBMUJFWSA-N	234.299	1.008	10	20	BDCD	
CN(C)c1ccc(CN(C)C2[C@H]3CNC[C@H]23)cc1	1578425590	HAMGXSMPIYAUFH-KBPBESRZSA-N	245.370	1.402	10	20	BDCD	
CCOC(=O)CN(C)Cc1cc(C)ccc1O	128594123	SVYDGWBJUATSQD-UHFFFAOYSA-N	237.299	1.696	10	20	BDCD	
C[C@]1(O)CCN(Cc2cc(F)ccc2O)C1	180244709	YXVWMSDCOKTGFJ-LBPRGKRZSA-N	225.263	1.488	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCCOC1	134306110	VYDNFLRSNAUMNB-NSHDSACASA-N	235.283	1.435	10	20	BDCD	
Cc1cc(O)c(CN2CC(=O)N[C@@H](C)C2)cc1C	295127930	YDFVELAZHNWKQZ-NSHDSACASA-N	248.326	1.329	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC(=O)N1	294926020	FXYMIVCJIJGTAI-LLVKDONJSA-N	247.342	1.073	10	20	BDCD	
C[C@@H]1O[C@H](C)C[C@@H]1NCCc1ccc(N)cc1	817956796	DBVJPFMIXBEELH-SUNKGSAMSA-N	234.343	1.967	10	20	BDCD	
C[C@H](N)CCN[C@H](C)c1ccc(F)cc1O	817951243	CGLPMKZKSXVONN-DTWKUNHWSA-N	226.295	1.919	10	20	BDCD	
O=C(NC1=NCCS1)c1cc(O)cs1	731868453	ZSXOUWPBKSPXCZ-UHFFFAOYSA-N	228.298	1.286	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)N1CC(F)C1	753072030	FQJYZSPTTKHXGP-RQOWECAXSA-N	237.230	1.291	10	20	BDCD	
CS[C@@H](C)CNC(=O)c1cc(O)cs1	752632556	VRCLVLOPJSTQRV-LURJTMIESA-N	231.342	1.935	10	20	BDCD	
CCCN(C)Cc1cc2c(cc1O)OC[C@H]2O	768441259	YAHCFTOKPNERCU-GFCCVEGCSA-N	237.299	1.660	10	20	BDCD	
CCN(C)c1ccc(CN2CCN(C)CC2)cc1	773733717	ZIDBEJZZFKQLBZ-UHFFFAOYSA-N	247.386	1.890	10	20	BDCD	
C[C@@H](C[S@](C)=O)N(C)Cc1ccccc1O	185225744	ZTYJFTVAIDKKCO-QFYYESIMSA-N	241.356	1.591	10	20	BDCD	
C[C@@H]1OCC[C@H]1C(=O)N(C)Cc1ccccc1O	92500823	PVVWFDUAWMGQHE-CMPLNLGQSA-N	249.310	1.776	10	20	BDCD	
CN(C)c1ccc(CNC2(CC(=O)O)CC2)cc1	901481051	RLKZJBZJCUHFCD-UHFFFAOYSA-N	248.326	1.850	10	20	BDCD	
C[C@@H](CC(=O)O)N[C@H]1CCc2cccc(O)c21	1609888475	MKXGPOVVPDNROH-WPRPVWTQSA-N	235.283	1.832	10	20	BDCD	
CC(C)(CO)CSc1ncc(C(=O)O)s1	1590782622	YCYSHZXQQTWNJP-UHFFFAOYSA-N	247.341	1.952	10	20	BDCD	
CS[C@H](C)C(=O)NCc1ccc(O)c(O)c1	159052361	BPRFPKOTKDJGFB-SSDOTTSWSA-N	241.312	1.466	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1CCCNC1)CCO2	258987921	LNNPDHRPPNAGCV-ZDUSSCGKSA-N	246.354	1.711	10	20	BDCD	
Cc1ccc(CNCCC2(CO)CC2)c(O)c1	877571415	YHKNGXBTAKWSGH-UHFFFAOYSA-N	235.327	1.953	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@]1(O)CCOC1)CC2	297091996	XHHOBYKQPULUJF-BXUZGUMPSA-N	249.310	1.121	10	20	BDCD	
CN(CCc1cnccn1)Cc1ccc(N)cc1	402651956	JYKRUNCYZOABKB-UHFFFAOYSA-N	242.326	1.733	10	20	BDCD	
C[S@@](=O)C1(CNCc2ccccc2O)CC1	309882318	WEXNUAAALPCRNL-MRXNPFEDSA-N	239.340	1.393	10	20	BDCD	
Nc1ccc(CN2CCC(N)CC2)cc1	34434130	XFFXNAXDYMLMKK-UHFFFAOYSA-N	205.305	1.192	10	20	BDCD	
Cc1ccc([C@H](C)N[C@@H](C)CO)c(O)c1	35602320	VXJYERNHSDQEKW-UWVGGRQHSA-N	209.289	1.732	10	20	BDCD	
Cc1cccc(CN[C@H]2C(=O)NCC[C@H]2C)c1O	195006909	CNFIXMGENJSMPG-BXKDBHETSA-N	248.326	1.315	10	20	BDCD	
CN(C)c1ccc(Cn2ccnc2[N+](=O)[O-])cc1	918387252	NDONBGALWDOAOM-UHFFFAOYSA-N	246.270	1.906	10	20	BDCD	
NC1(CNCc2cccc(F)c2O)CCCC1	849349835	KNXDWFDOIOOWQP-UHFFFAOYSA-N	238.306	1.892	10	20	BDCD	
Cc1ccc(C(=O)N=S(C)(C)=O)c(O)c1O	913642341	GIACHDOOARYMMO-UHFFFAOYSA-N	243.284	1.274	10	20	BDCD	
C[C@@H]1COC[C@@H]1NC(=O)c1cc(O)cs1	928909405	DWTDRCJRHHMDAL-SVRRBLITSA-N	227.285	1.218	10	20	BDCD	
CN(CC[C@@H]1CCNC1)c1ccc(N)cc1	863558595	ONOPUSVSLMACIZ-NSHDSACASA-N	219.332	1.705	10	20	BDCD	
Cc1cccc(O)c1CN(C)[C@@H](C)CCO	877614611	FRRYHKXSPRQMCP-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
OC[C@H]1CSCCN1Cc1ccccc1O	877780339	NCOULJUJZNYDAR-NSHDSACASA-N	239.340	1.302	10	20	BDCD	
C[C@@H](CO)NCc1ccc(N2CCCC2)cc1	37258392	JHGMVXKGYLCIMH-LBPRGKRZSA-N	234.343	1.757	10	20	BDCD	
C[C@@H](O)[C@H](N)c1cccc(Br)c1O	95682425	AAFUDAAVJMVDRI-XRGYYRRGSA-N	246.104	1.535	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC(F)(F)CC1	409422971	KGPWWLAPRXTIQH-UHFFFAOYSA-N	204.180	1.554	10	20	BDCD	
COc1ccc(O)c(CN(C)CC(C)(C)N)c1	709340458	CWDRURDNHYSXKS-UHFFFAOYSA-N	238.331	1.570	10	20	BDCD	
CCc1cccc(CNCCn2ccnc2)c1O	709447587	VREJCJPFDOHWBD-UHFFFAOYSA-N	245.326	1.941	10	20	BDCD	
CCc1cccc(CN[C@@H]2CCOC2)c1O	691467822	RPONXRZMCMNORY-GFCCVEGCSA-N	221.300	1.833	10	20	BDCD	
C[C@H](NCc1ccc(N)cc1)[C@@H]1CCCNC1	1336285371	LHVQVLZPAQVWKW-WCQYABFASA-N	233.359	1.747	10	20	BDCD	
Oc1cccc(Cl)c1CNC1CNC1	1574439989	KGCVLNFKZKRHTL-UHFFFAOYSA-N	212.680	1.107	10	20	BDCD	
O=C(Nc1cc[nH]n1)c1cccc(O)c1O	163284214	WMONKHZYUYHAPA-UHFFFAOYSA-N	219.200	1.073	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(N)cc2)C[C@@H]1O	399920641	PNCBVAKSVJQEBQ-AAEUAGOBSA-N	220.316	1.472	10	20	BDCD	
C[C@H](NC[C@@]1(O)CCOC1)c1ccccc1O	183629672	JOQGPRGPCPOCSW-GWCFXTLKSA-N	237.299	1.194	10	20	BDCD	
CN(CCC(=O)O)Cc1c(O)cccc1Cl	128820559	KOOSQGJOHDZNRV-UHFFFAOYSA-N	243.690	1.952	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCSC1	76642625	BRWWFGWLMVPDPZ-JTQLQIEISA-N	209.314	1.987	10	20	BDCD	
O=C(O)c1occc1CNCc1ccccc1O	236476040	IBOOUPGQWRJXSL-UHFFFAOYSA-N	247.250	1.973	10	20	BDCD	
CC(C)(O)CN[C@@H]1CCc2cccc(O)c21	297880742	VBZHQOMRGPWBKQ-SNVBAGLBSA-N	221.300	1.740	10	20	BDCD	
COC(=O)[C@@H](C)N(C)Cc1cccc(C)c1O	280895400	PGXTZDQAQQVUDM-SNVBAGLBSA-N	237.299	1.694	10	20	BDCD	
C[C@@H](NC/C=C/CO)c1ccc(F)cc1O	717573922	ARGBCTVUMZFPOI-GKQMSVHHSA-N	225.263	1.730	10	20	BDCD	
CCOc1ccc(CNC[C@H](N)CC)c(O)c1	841070583	REIMDTZNUAEDFC-LLVKDONJSA-N	238.331	1.618	10	20	BDCD	
COCCNCCNCc1cc(C)ccc1O	841048031	KCCGELJIWHWMCE-UHFFFAOYSA-N	238.331	1.026	10	20	BDCD	
CCc1cccc(CN(C)CCCO)c1O	848909627	YGEPYFPFKVCSNN-UHFFFAOYSA-N	223.316	1.769	10	20	BDCD	
COc1cccc(O)c1CN1C[C@H]2C[C@@H]2C1	862440128	DRMMRAQJFIGLOK-NXEZZACHSA-N	219.284	1.853	10	20	BDCD	
Nc1ccc(NC(=O)N[C@H]2CCCC[C@@H]2O)cc1	52010806	FFNRIXXLWKAFDI-RYUDHWBXSA-N	249.314	1.694	10	20	BDCD	
CN(C)CC1(C(=O)Nc2ccc(N)cc2)CC1	876504419	NDIRAGDBMMQFTQ-UHFFFAOYSA-N	233.315	1.549	10	20	BDCD	
C[C@H](N)[C@H](C)C(=O)N(C)c1ccc(N)cc1	877077533	LYEBGIHDDOVAMO-IUCAKERBSA-N	221.304	1.215	10	20	BDCD	
Cn1ccc(C(=O)NCc2ccc(O)c(O)c2)c1	778916732	PIZNNMPMSPKTBX-UHFFFAOYSA-N	246.266	1.366	10	20	BDCD	
CC1=NO[C@@H](CNCc2ccccc2O)C1	895312073	TXQYPIBOMMLBSY-LLVKDONJSA-N	220.272	1.647	10	20	BDCD	
CCOC(=O)[C@@H](C)NCc1cc(C)ccc1O	71408430	ILTPBAIHXUKZTH-SNVBAGLBSA-N	237.299	1.742	10	20	BDCD	
CNC[C@H](C)CN[C@H](C)c1ccccc1O	1326036702	UDWHVIOLMQNYLF-WDEREUQCSA-N	222.332	1.898	10	20	BDCD	
O=C(N[C@H]1C[C@@H](C(=O)O)C1)c1cc(O)cs1	1594794408	AFEZFYUEDDDKGK-OLQVQODUSA-N	241.268	1.047	10	20	BDCD	
CC1CC(NC(=O)c2cccc(O)c2O)C1	163278097	JOSUVSHKMZXGSC-UHFFFAOYSA-N	221.256	1.626	10	20	BDCD	
Cc1cc(C(=O)N(C)Cc2ccccc2O)no1	77613210	RWZPDDGRVWGOML-UHFFFAOYSA-N	246.266	1.961	10	20	BDCD	
CC[C@@H](O)CN[C@@H]1CCc2cccc(O)c21	309511666	PQBATQJHLFZQES-GHMZBOCLSA-N	221.300	1.740	10	20	BDCD	
Cn1nccc1C(=O)NCc1ccccc1O	133832419	IANINJDDQVWSJQ-UHFFFAOYSA-N	231.255	1.056	10	20	BDCD	
CCOc1cccc(CNCc2cc[nH]n2)c1O	41014157	VRJWEWMVJYYAPB-UHFFFAOYSA-N	247.298	1.804	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)CCO1	132475224	BYDJSZQDXJOBQO-JTQLQIEISA-N	207.273	1.613	10	20	BDCD	
CC[C@H](N[C@@H](C)CN)c1ccc(F)cc1O	817970190	NSIQBHHHRDHMIB-KWQFWETISA-N	226.295	1.919	10	20	BDCD	
C[C@H]1CC[C@@H](CNC(=O)c2cc(O)cs2)O1	839791596	DEHAPOMTVKVZJX-CBAPKCEASA-N	241.312	1.751	10	20	BDCD	
C[C@@H]1C[C@@H]1CNC[C@H](N)c1ccc(N(C)C)cc1	841040915	COBYQWHBZIHSHT-KYOSRNDESA-N	247.386	1.998	10	20	BDCD	
C[C@H](O)C1(NC(=O)c2cc(O)cs2)CC1	856129500	YWRFOCLGXXHHNH-LURJTMIESA-N	227.285	1.097	10	20	BDCD	
C[C@@H](NCC[N+](=O)[O-])c1ccccc1O	931554441	PVONLZNBGQUDHS-MRVPVSSYSA-N	210.233	1.320	10	20	BDCD	
CNC(=O)CCCNCc1ccc(C)cc1O	876982535	BMXOZKOHUQFTQO-UHFFFAOYSA-N	236.315	1.316	10	20	BDCD	
CN(C(=O)CN=[N+]=[N-])[C@@H]1CCSC1	409433630	MZWGIQZUONWQJC-ZCFIWIBFSA-N	200.267	1.261	10	20	BDCD	
CN1C[C@@H](CSc2nccs2)OC1=O	1330310876	QCRDBFQJFPJXDO-LURJTMIESA-N	230.314	1.686	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1C[C@@H]1F)c1ccccc1O	1347190431	PXIDPBKMOMPXDH-JEZHCXPESA-N	223.247	1.927	10	20	BDCD	
CCC[C@@H]1C(=O)NCCN1Cc1ccc(N)cc1	1262488022	NHJHSUKEKXTZIF-CYBMUJFWSA-N	247.342	1.369	10	20	BDCD	
COc1ccc(N2CCN(C[C@@H](C)N)CC2)cc1	19275600	YGDCCZHHAZMAMZ-GFCCVEGCSA-N	249.358	1.164	10	20	BDCD	
C[C@H]1NCCC[C@H]1NCc1ccc2c(c1)CCO2	841064775	JLAWDFRSBBKWGC-BXUZGUMPSA-N	246.354	1.852	10	20	BDCD	
COc1cccc(CN[C@H]2C[C@H](O)C2)c1O	850418025	VSFHEAIPPJRHOG-MGCOHNPYSA-N	223.272	1.014	10	20	BDCD	
CN1CCC[C@@H]1CNCc1cc(F)ccc1O	226587847	QRXSGDDHOYMHBM-GFCCVEGCSA-N	238.306	1.715	10	20	BDCD	
CN(C)c1ccc(CN[C@H](CO)C2CC2)cc1	734161569	VSNZFTDNTAXVME-CQSZACIVSA-N	234.343	1.613	10	20	BDCD	
[N-]=[N+]=NCCN1CCN(C2CCC2)CC1	328366230	CMWHYORXNOKNMR-UHFFFAOYSA-N	209.297	1.467	10	20	BDCD	
C[C@H](NCCn1cccn1)c1ccccc1O	42538723	FHBIMASKKRAEEM-NSHDSACASA-N	231.299	1.940	10	20	BDCD	
C[C@H]1NCC[C@H]1C(=O)NCc1ccccc1O	228421997	SNSDKJUIOKJBOE-MWLCHTKSSA-N	234.299	1.006	10	20	BDCD	
OC[C@]1(F)CCCN(Cc2ccccc2O)C1	289701962	GBVGPCAJCKXSLW-ZDUSSCGKSA-N	239.290	1.689	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)OCCF	803400955	MAHAWIJYZJVCMQ-DUXPYHPUSA-N	226.203	1.624	10	20	BDCD	
CC(=O)C(=O)Cn1cnc(-c2ccccc2)n1	808022852	RZDWKTPXUZYVKP-UHFFFAOYSA-N	229.239	1.103	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1cc2c(cc1O)CCC2	817779290	IWKIGKDKNIYBBK-SECBINFHSA-N	249.310	1.786	10	20	BDCD	
C[C@@H]1C[C@@H](NCCc2ccc(N)cc2)CCN1C	817956272	VNRNFJXPDVJFOF-DOMZBBRYSA-N	247.386	1.884	10	20	BDCD	
c1csc(SCCc2cnn[nH]2)n1	821078072	HFJNQXAFLHLFNI-UHFFFAOYSA-N	212.303	1.596	10	20	BDCD	
O=C(NCc1cnc[nH]1)c1cc(O)cs1	748321071	CSSTXPDDYNGBLQ-UHFFFAOYSA-N	223.257	1.107	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H]3C[C@]3(CO)C2)c1	783734569	MQUWQRGQFOJVPM-SMDDNHRTSA-N	249.310	1.215	10	20	BDCD	
CCN(CCO)Cc1cc(F)cc(F)c1O	893871177	HKMLNTLAJOOMTM-UHFFFAOYSA-N	231.242	1.485	10	20	BDCD	
OC[C@H]1C[C@@H](NCc2cccc(Cl)c2O)C1	707594341	LBBSFZWOKANWNP-WAAGHKOSSA-N	241.718	1.906	10	20	BDCD	
COCCC(=O)NCc1ccccc1O	66081232	YYFXNVLTUGLWGX-UHFFFAOYSA-N	209.245	1.045	10	20	BDCD	
COc1ccc(N2CCN(CCF)CC2)cc1	759328542	KMNBPZLEFCKJNX-UHFFFAOYSA-N	238.306	1.787	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@@H]1C[C@@H]1F	1352304144	ZZRYTVXGKHZTAL-BDAKNGLRSA-N	225.219	1.072	10	20	BDCD	
C[C@@H](CCN(C)C)NCc1cc(F)ccc1O	226588591	PNRNHKHQDXNWTK-JTQLQIEISA-N	240.322	1.961	10	20	BDCD	
CCO[C@@H](C)C(=O)Nc1ccc(N)cc1	22165674	DXSFFLYTQTUAMM-QMMMGPOBSA-N	208.261	1.632	10	20	BDCD	
Cc1cccc(CNCCC[S@](C)=O)c1O	162663226	PMNJWRTZAFMWDM-MRXNPFEDSA-N	241.356	1.559	10	20	BDCD	
CN(C)C(=O)[C@H]1CCCN1Cc1ccccc1O	179554753	WGESFGIBZGPZGY-GFCCVEGCSA-N	248.326	1.445	10	20	BDCD	
C[C@@H](O)[C@@H]1CCCN(Cc2ccc(N)cc2)C1	688874706	GFDFBBNTYGUYBJ-DGCLKSJQSA-N	234.343	1.862	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCCN1)c1ccccc1O	870987735	CAATWVJZYIMGHD-KOLCDFICSA-N	234.299	1.321	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@@]2(CCCCO2)C1	409428695	MVJLYDHEWCDXIO-JTQLQIEISA-N	210.281	1.942	10	20	BDCD	
CNC(=O)NCc1ccc2c(c1)CCCN2C	58483281	VJWFXTYLANVABC-UHFFFAOYSA-N	233.315	1.498	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)cc1	250230420	ACLAIEMJNLMQJY-JHJVBQTASA-N	246.310	1.247	10	20	BDCD	
CC(=O)Nc1cccc(NC(=O)CN=[N+]=[N-])c1	229005155	KAUQNHZJYVXSSK-UHFFFAOYSA-N	233.231	1.894	10	20	BDCD	
CC1(C)CNCCN1Cc1cc(F)ccc1O	220294871	LQLDSLHAXCNNTK-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
CC[C@@H](NC[C@@H](C)O)c1ccc(F)cc1O	285842148	XKYSEVOQHSJKLN-LDYMZIIASA-N	227.279	1.953	10	20	BDCD	
CC(=O)C(=O)COc1ccc2c(c1)CCC2=O	289663105	OOWRKXFZKVUNCS-UHFFFAOYSA-N	232.235	1.352	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cccnc1Cl	808488709	ZEGSDVYOGPGAKH-UHFFFAOYSA-N	241.630	1.050	10	20	BDCD	
Cc1ccc(C(=O)OCC(F)F)c(O)c1O	733477502	ZOUBLBUGIVHVHY-UHFFFAOYSA-N	232.182	1.828	10	20	BDCD	
Oc1c(F)cc(Cl)cc1CN1CC[C@@H](O)C1	775647847	DEQHFAWYFZPYLU-SECBINFHSA-N	245.681	1.751	10	20	BDCD	
CC(C)[C@@H](C(=O)N(C)c1ccc(N)cc1)[C@@H](C)N	877076072	LUVAQDZZBUPXEE-ZWNOBZJWSA-N	249.358	1.851	10	20	BDCD	
Cc1ccc(CN[C@H]2C[C@@H](O)C2)c(O)c1	877574759	UNTZDYDLEIHMLN-PHIMTYICSA-N	207.273	1.314	10	20	BDCD	
COc1cccc(CN2C[C@H](O)C[C@H]2C)c1O	788269451	NRVMJFHJCGSIIE-MWLCHTKSSA-N	237.299	1.356	10	20	BDCD	
COc1cc(C)cc(CNCC[C@H](C)O)c1O	894562140	ATQOHEDIGKWCCS-JTQLQIEISA-N	239.315	1.570	10	20	BDCD	
COc1ccc2c(c1)CCCN2CC(=O)N(C)C	797720870	QCXZVPPKQJJVHO-UHFFFAOYSA-N	248.326	1.536	10	20	BDCD	
CNC[C@H](C)CN[C@@H](C)c1ccccc1O	1326036701	UDWHVIOLMQNYLF-QWRGUYRKSA-N	222.332	1.898	10	20	BDCD	
CC(C)(C)[C@H](CN)NCc1ccc(N)cc1	1356082693	CHAACYZJRZJSAF-LBPRGKRZSA-N	221.348	1.732	10	20	BDCD	
CC1(NCc2ccc3c(c2)CCCO3)CNC1	1576545312	JBPRMOQEGJURKK-UHFFFAOYSA-N	232.327	1.463	10	20	BDCD	
COc1cccc([C@@H](C)NCCC(=O)O)c1O	1594123584	QJKKYPBTACZDSN-MRVPVSSYSA-N	239.271	1.526	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)C[C@H](C)O)c1	164504283	CPTHIUNDRQPSNZ-MNOVXSKESA-N	223.316	1.950	10	20	BDCD	
COC(OC)C(=O)N[C@H](C)c1ccccc1O	827952319	NPCSANSNNQDJSL-MRVPVSSYSA-N	239.271	1.188	10	20	BDCD	
COCC[C@](C)(O)CNCc1ccccc1O	172071662	XIOIXXWZDCFNRQ-ZDUSSCGKSA-N	239.315	1.269	10	20	BDCD	
CN(Cc1ccccc1O)[C@@H]1CCOC1	132771909	DDXWSEYTYWAFIY-LLVKDONJSA-N	207.273	1.613	10	20	BDCD	
CC1(CN[C@@H]2CCc3cccc(O)c32)OCCO1	296660742	FDQVOYXBEWMOHE-LLVKDONJSA-N	249.310	1.732	10	20	BDCD	
O=C(NCCn1cccn1)c1cc(O)cs1	732276159	URYFGIRIFOOGJE-UHFFFAOYSA-N	237.284	1.080	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCC(C)=O)c1	878361029	VULOWFKIWQVAGT-SECBINFHSA-N	223.272	1.640	10	20	BDCD	
C[C@@H](N[C@@H]1CCN(C)C1)c1c(O)cccc1F	886522912	SYBPNBJNWVTUBA-NXEZZACHSA-N	238.306	1.886	10	20	BDCD	
CC[C@H](CO)N[C@H](C)c1c(O)cccc1F	886489736	POEJCEFRAIURLA-RKDXNWHRSA-N	227.279	1.953	10	20	BDCD	
COc1cccc(CN2CC[C@@H](F)C2)c1O	689863350	PNBQRBREEBNTFF-SNVBAGLBSA-N	225.263	1.945	10	20	BDCD	
Cc1cnn(C)c1CNCc1ccccc1O	285406286	IQGLOFQSBJGFIU-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
C[C@H]1COCCN(C(=O)Cc2ccc(N)cc2)C1	399095383	BWRFOFLOYWEKBT-LLVKDONJSA-N	248.326	1.306	10	20	BDCD	
CC[C@@H](CO)N[C@@H](C)c1ccc(F)cc1O	62745356	MEXJYXHXBGGISL-WPRPVWTQSA-N	227.279	1.953	10	20	BDCD	
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1(C)CC1	186419941	SUTWRCRFYYXKAM-VIFPVBQESA-N	249.310	1.945	10	20	BDCD	
COCCCC(=O)NCc1ccc(O)c(O)c1	272262421	BXUJDFZYJLTTPW-UHFFFAOYSA-N	239.271	1.141	10	20	BDCD	
CCOc1ccc(CN(C)CC(=O)O)c(O)c1	820387538	SHJRCVJUXDHDFU-UHFFFAOYSA-N	239.271	1.307	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CNC[C@H]2C)c1	903964115	MEJSVHRXKVPNJL-BXKDBHETSA-N	236.315	1.098	10	20	BDCD	
NC[C@H]1CC[C@H](NCc2cc(F)ccc2O)C1	841085153	VQOPANUXHMOCCO-CABZTGNLSA-N	238.306	1.748	10	20	BDCD	
C[C@@](O)(CNC(=O)c1cc(O)cs1)C1CC1	743716528	YAOULMAFXRBRHN-LLVKDONJSA-N	241.312	1.345	10	20	BDCD	
CC[C@@H](NCc1cccc(C)c1O)C(=O)NC	697915087	GJZZCMKIMGAHAZ-LLVKDONJSA-N	236.315	1.315	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@H]2COC[C@H]2C1	872265248	GEQKXLILUNODFG-TXEJJXNPSA-N	233.311	1.779	10	20	BDCD	
Cc1cccc(O)c1CNCCc1cnn(C)c1	876954259	JIRAXKUEKUOCNE-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
Cc1ccc(CN2C[C@@H](O)C(C)(C)C2)c(O)c1	877486864	SJFSGBFRSLZZJH-CYBMUJFWSA-N	235.327	1.903	10	20	BDCD	
CC(C)[C@@H](CN)CNc1ccc(N)cc1	873210571	KGPWTIFSUFGIND-JTQLQIEISA-N	207.321	1.912	10	20	BDCD	
Nc1ccc(CN2C[C@@H]3CCC[C@@]3(N)C2)cc1	1334754803	RSCDCFAMMBWOFY-GXTWGEPZSA-N	231.343	1.582	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@H](CO)C2)cc1	66057168	MGMJUDQGJJPKPT-AWEZNQCLSA-N	248.370	1.957	10	20	BDCD	
c1c[nH]c(CNCc2ccc3c(c2)CCO3)n1	70939334	HYLFQHTUYPIAPH-UHFFFAOYSA-N	229.283	1.634	10	20	BDCD	
COC(=O)c1cnc(SCCO)s1	295336271	PLRPBUIWWPPUIJ-UHFFFAOYSA-N	219.287	1.014	10	20	BDCD	
CC[C@@H](COC)NC(=O)c1cc(O)cs1	738550280	ZPJBFYTWAWLJTL-ZETCQYMHSA-N	229.301	1.609	10	20	BDCD	
CCONC(=O)NCc1cc(C)ccc1O	858099335	XKIOEMAVEKUCHD-UHFFFAOYSA-N	224.260	1.451	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1=COCCC1	1123978634	WKOJQRKKRKAIBW-UHFFFAOYSA-N	249.266	1.408	10	20	BDCD	
O=[N+]([O-])CCOc1ccc(N2CCCC2)cc1	899230680	JGFLRTOPCQYMCT-UHFFFAOYSA-N	236.271	1.942	10	20	BDCD	
C[C@H]1C[C@H](O)CN1Cc1ccc(N(C)C)cc1	788268490	DLEGAVLLHHKIBJ-FZMZJTMJSA-N	234.343	1.708	10	20	BDCD	
CO[C@H]1CN(CCN=[N+]=[N-])C[C@H]1n1cccn1	409432640	LMIXWTZHWZQMRA-ZJUUUORDSA-N	236.279	1.065	10	20	BDCD	
O[C@@H]1CC[C@@H](CNCc2ccc3c(c2)CCO3)C1	188849976	TWVHGIWHVVOUHV-TZMCWYRMSA-N	247.338	1.872	10	20	BDCD	
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(N)cc1	708857199	RMVSAGPWMYWVRB-LLVKDONJSA-N	235.287	1.122	10	20	BDCD	
CCn1ncnc1N(C)Cc1ccccc1O	1120828534	RMFPXIGPQTYWOG-UHFFFAOYSA-N	232.287	1.640	10	20	BDCD	
O=C(O)Cc1cc(O)c(O)c(Cl)c1	142788982	DVZOIKNVMLZNTF-UHFFFAOYSA-N	202.593	1.378	10	20	BDCD	
CC[C@@H](C)C(=O)NCCc1ccc(O)c(O)c1	156609076	OZSHGWNUHUNMFA-SECBINFHSA-N	237.299	1.803	10	20	BDCD	
CCC[C@H](O)CNCc1cc(F)cc(F)c1O	708483694	FURQSTVMRKVDTE-JTQLQIEISA-N	245.269	1.921	10	20	BDCD	
Nc1ccc(CN2CCC[C@@H]3COC[C@@H]32)cc1	690354779	YUNMALRTDDYPRC-OCCSQVGLSA-N	232.327	1.880	10	20	BDCD	
C[C@H]1CC[C@H](CNC(=O)Nc2ccc(N)cc2)O1	397943348	IMWHEBRMZNPMBS-JOYOIKCWSA-N	249.314	1.958	10	20	BDCD	
C[C@H](NCCN(C)C)c1ccc(F)cc1O	62744660	BDVDLAPZIADKLY-VIFPVBQESA-N	226.295	1.744	10	20	BDCD	
COc1ccc(CNCCC(=O)O)cc1C	37252562	XXXFOHMDNFFVGN-UHFFFAOYSA-N	223.272	1.568	10	20	BDCD	
Cc1cccc(CN[C@]2(C)CCOC2=O)c1O	290956148	RBUPQXKINQUVLI-CYBMUJFWSA-N	235.283	1.496	10	20	BDCD	
COc1ccc(N2CC[C@H](CNC(N)=O)C2)cc1	818048167	MYMWDLJFHVKTTI-SNVBAGLBSA-N	249.314	1.190	10	20	BDCD	
O=C(N[C@@H]1CCC[C@H]1O)c1cc(O)cs1	839791548	CNMUXIAJAORZAT-HTQZYQBOSA-N	227.285	1.097	10	20	BDCD	
CC[C@H](C)C[C@@H](N)C(=O)Nc1ccc(N)cc1	911660889	NWISYQBOKOCACX-JOYOIKCWSA-N	235.331	1.971	10	20	BDCD	
CN(C)c1ccc(CNC(=N)NC2CCC2)cc1	848982384	OJFBVGRNSQNZJS-UHFFFAOYSA-N	246.358	1.919	10	20	BDCD	
Cc1cccc(CN2CCn3ncnc3C2)c1O	770664495	RDMVYOVMFVMBFA-UHFFFAOYSA-N	244.298	1.308	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H]([C@@H](C)O)C1	877184001	JYSGMWKGCRDJID-NEPJUHHUSA-N	235.327	1.903	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2COCO2)cc1	894868903	NOLBDLRGXJUIJH-ZDUSSCGKSA-N	236.315	1.215	10	20	BDCD	
O=C1CCC[C@H](C(=O)C(F)(F)F)C1=O	122645917	CLOLCNMFFLMEGX-BYPYZUCNSA-N	208.135	1.056	10	20	BDCD	
CCN(CC(=O)O)Cc1ccc(F)c(F)c1O	1596226286	MUHLTSMHNVSFPA-UHFFFAOYSA-N	245.225	1.577	10	20	BDCD	
Cc1cc(O)c(CN(C)CCO)cc1C	127914702	SNLZKXFHVLLEAR-UHFFFAOYSA-N	209.289	1.433	10	20	BDCD	
Cc1ccc(CN2CC[C@H](C(N)=O)C2)c(O)c1	876522913	GGZBIDMQKNNZDW-NSHDSACASA-N	234.299	1.008	10	20	BDCD	
CSC[C@@H](O)CN[C@H](C)c1ccccc1O	309911885	NDGZLHOAFJPIJB-ZJUUUORDSA-N	241.356	1.767	10	20	BDCD	
CO[C@@H]1COC[C@H]1NCc1cc(F)ccc1O	843427561	GMONDXUOBZMMFA-ZYHUDNBSSA-N	241.262	1.035	10	20	BDCD	
COC(=O)c1cc(F)c(O)c(O)c1C	2332241301	QSSQPVOLTGAACH-UHFFFAOYSA-N	200.165	1.332	10	20	BDCD	
COC[C@H](O)CCN[C@H](C)c1ccccc1O	183634054	KRTACYMXVCXYSE-GHMZBOCLSA-N	239.315	1.440	10	20	BDCD	
O=C(O)[C@H]1CCN(Cc2cc(F)ccc2O)C1	236438708	DJBWHEYXYXCGFM-QMMMGPOBSA-N	239.246	1.438	10	20	BDCD	
NC[C@@H]1CCCC[C@@H]1NCCc1ccc(N)cc1	817958167	SQJQIEPUJHZVRD-ZFWWWQNUSA-N	247.386	1.918	10	20	BDCD	
Cc1cc(O)c(CN(C)CCO)cc1Cl	824484472	JEBWSSSSJKKSLR-UHFFFAOYSA-N	229.707	1.778	10	20	BDCD	
C[C@@H](CCN)NCc1cccc(F)c1O	841052275	SQRXWZDGQZUXDI-QMMMGPOBSA-N	212.268	1.358	10	20	BDCD	
Cc1cc(CN2C[C@@H](N)C[C@@H]2C)ccc1N(C)C	923412916	KYJIUBWCPIEFQH-JSGCOSHPSA-N	247.386	1.983	10	20	BDCD	
Oc1ccc(F)cc1CN1C[C@@H]2C[C@H]2C1	862444136	YIYXIXXHYZJRPP-IUCAKERBSA-N	207.248	1.983	10	20	BDCD	
O=C(N[C@H](CCO)C1CC1)c1cc(O)cs1	764707524	WVIGQBUYDSSXIX-SECBINFHSA-N	241.312	1.345	10	20	BDCD	
CC[C@]1(O)CCN(C(=O)c2cc(O)cs2)C1	779506955	ZPUZLJKIOATLRR-NSHDSACASA-N	241.312	1.441	10	20	BDCD	
CN(Cc1ccccc1O)Cc1ccnn1C	91974539	IBZHODYFWNFSFW-UHFFFAOYSA-N	231.299	1.758	10	20	BDCD	
CC1(C)CN(c2ccc(N)cc2)C[C@H]1CO	409432765	LUXUPSAYTKZSMS-JTQLQIEISA-N	220.316	1.724	10	20	BDCD	
C[C@H](O)CN[C@H](C)c1ccc(F)c(F)c1O	187813592	ONJAIXBLYYSIQM-NKWVEPMBSA-N	231.242	1.702	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](N)C2)c1	70955782	BYUBOSAJIOSZQM-LLVKDONJSA-N	206.289	1.234	10	20	BDCD	
NC[C@@H]1CC[C@@H](NCc2ccc(N)cc2)C1	1335288129	DNZDXVMAVLVUEB-DGCLKSJQSA-N	219.332	1.486	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1CCCN1)CCCO2	258919088	OGDWVXKKFOTRQL-CQSZACIVSA-N	246.354	1.853	10	20	BDCD	
CC(C)OCC(=O)Nc1ccc(N)cc1	19262579	JNIASTZEPALTPN-UHFFFAOYSA-N	208.261	1.632	10	20	BDCD	
C[C@H]1COCCN1Cc1cc(F)cc(F)c1O	708415587	ZJTUHHFGVQCOSX-QMMMGPOBSA-N	243.253	1.891	10	20	BDCD	
CC[C@H](O)CNCCCSc1nccs1	819062477	DJMBZSAUDNNXEH-VIFPVBQESA-N	246.401	1.986	10	20	BDCD	
COc1cccc(O)c1CN1C[C@H]2C[C@H]2C1	862440127	DRMMRAQJFIGLOK-AOOOYVTPSA-N	219.284	1.853	10	20	BDCD	
CCOc1cccc(CN2CC(C)(O)C2)c1O	877581287	VAXZMIOSBALMFW-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
CC[C@@H]1C[C@H]1NC(=O)c1cc(O)cs1	798123217	XWULALPKIRXYTA-HTRCEHHLSA-N	211.286	1.982	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@]1(C)CCOC1	687411359	BWMPPLRJMUEPQZ-CQSZACIVSA-N	249.310	1.777	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cncnc1	383641119	NFMYLBNHFNZFIY-UHFFFAOYSA-N	243.266	1.454	10	20	BDCD	
OC[C@H]1C[C@H](NCc2cc(F)ccc2O)C1	897357980	RKAJZQSHDUDTFW-JLIMDTESSA-N	225.263	1.392	10	20	BDCD	
CO[C@@H](C)CNC(=O)c1ccc(C)c(O)c1O	189627370	GWTBAPXSSPDDQQ-QMMMGPOBSA-N	239.271	1.171	10	20	BDCD	
C[C@]1(NCc2cc(F)ccc2O)CCOC1	226617983	AYWIXZYERFAXMN-LBPRGKRZSA-N	225.263	1.800	10	20	BDCD	
COc1cccc(CN[C@@H]2CCSC2)c1O	230705116	DNFGJJUHIMLMBY-SNVBAGLBSA-N	239.340	1.996	10	20	BDCD	
CCOc1ccc(CN[C@H]2C[C@H](N)C2)c(O)c1	906507818	DMZXLCPSEYSNEM-XYPYZODXSA-N	236.315	1.370	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](C)CCN)cc1C	841052640	VGZFMXPNGOMTCN-NSHDSACASA-N	222.332	1.836	10	20	BDCD	
CCOc1ccc(CN(C)CCCN)c(O)c1	843050252	DCVYYOHWVAUAEQ-UHFFFAOYSA-N	238.331	1.572	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)C[C@H](C)N)c1	843129852	SDSCVKFENJCSOT-VHSXEESVSA-N	238.331	1.616	10	20	BDCD	
C[C@]1(O)CCCN(C(=O)c2cc(O)cs2)C1	767157623	UALDLWFUSALPMP-NSHDSACASA-N	241.312	1.441	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC=CCC1	779314261	YBMDVGYUVRKQFC-UHFFFAOYSA-N	209.270	1.856	10	20	BDCD	
CCN[C@@H](C)C(=O)Nc1ccc(N)cc1	876504810	XNIXBRUUESVWGB-QMMMGPOBSA-N	207.277	1.205	10	20	BDCD	
O=C(NCC[C@H](O)C1CC1)c1cc(O)cs1	890717850	MIBMSCGKSPOSCD-VIFPVBQESA-N	241.312	1.345	10	20	BDCD	
Cc1ccc(O)c(CNCCOCCF)c1	705745774	KALKINSYKXZHRJ-UHFFFAOYSA-N	227.279	1.776	10	20	BDCD	
COCCNCc1c(O)ccc(Cl)c1F	190673844	LVGIONRGYWRZPQ-UHFFFAOYSA-N	233.670	1.921	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@@H](F)C2)c1	689856383	AEYFNEPMXMHSET-SNVBAGLBSA-N	225.263	1.945	10	20	BDCD	
Nc1ccc(CC(=O)N2C[C@H]3CC[C@H]2C3)cc1	103383044	MDWFRYDIJQLMEF-AAEUAGOBSA-N	230.311	1.822	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2C[C@H]2C(=O)O)c1	1600465434	ZBRKCKFKFQAAKG-VHSXEESVSA-N	249.266	1.038	10	20	BDCD	
C[C@H]1C[C@@H]1C(=O)N(C)c1ccc(N)cc1	34939054	DJUZRUTYVGXMKQ-KWQFWETISA-N	204.273	1.888	10	20	BDCD	
C=CC(=O)N1CCN(c2ccc(OC)cc2)CC1	36334158	NSYVRTBZEJSPAX-UHFFFAOYSA-N	246.310	1.530	10	20	BDCD	
OC[C@H](NCc1cccc(Cl)c1O)C1CC1	309528733	CTCSXASJUHAYCC-NSHDSACASA-N	241.718	1.906	10	20	BDCD	
Oc1ccccc1CNC[C@H]1C[C@H](O)C1	720951094	IZZMTCXTFOXUJU-HOMQSWHASA-N	207.273	1.253	10	20	BDCD	
Nc1ccc(CNC[C@@H]2C[C@@H]3COC[C@@H]3O2)cc1	724551456	DMJLKEBZFTZNMW-XBFCOCLRSA-N	248.326	1.162	10	20	BDCD	
CN(C)c1ccc2c(c1)OCCN2C(=O)C1CC1	173200676	XCELKWANCAADDY-UHFFFAOYSA-N	246.310	1.888	10	20	BDCD	
COCCNCc1cc([N+](=O)[O-])ccc1O	60942015	FOAQAUMQEPPXKS-UHFFFAOYSA-N	226.232	1.036	10	20	BDCD	
OC[C@@H]1CCN(Cc2c(O)cccc2Cl)C1	127231702	MKLXNWCWQYGZLM-SECBINFHSA-N	241.718	1.860	10	20	BDCD	
C[C@@H](N)[C@H]1CCN(Cc2cc(F)ccc2O)C1	220341196	VTFCCNWUMBNNPC-ZJUUUORDSA-N	238.306	1.700	10	20	BDCD	
C[C@H](O)C(=O)NCc1ccc2c(c1)CCCN2C	270807562	OTSJVMHJYVYYDO-JTQLQIEISA-N	248.326	1.066	10	20	BDCD	
COC(=O)c1cnc(S[C@@H](C)C(C)=O)s1	295335997	PILSCLJAIULQIV-LURJTMIESA-N	245.325	1.999	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1CC(F)(F)C1	828068396	VCADUEZTWOYEOE-UHFFFAOYSA-N	247.172	1.328	10	20	BDCD	
CC[C@H](NC(=O)c1cc(O)cs1)[C@@H](C)O	839783352	XDWINTFTYXVJGV-SVRRBLITSA-N	229.301	1.343	10	20	BDCD	
CC[C@H](CO)NCc1ccc(N(C)C)cc1C	840928580	ZMVSDWVWILLNMX-CYBMUJFWSA-N	236.359	1.922	10	20	BDCD	
COc1cccc(CN[C@@H](CN)C2CC2)c1O	841028681	QNWADTKVLICLIG-NSHDSACASA-N	236.315	1.228	10	20	BDCD	
CC[C@@H](O)CN[C@H](C)c1cccc(OC)c1O	850529784	SZFVJTDKMJNOGK-NXEZZACHSA-N	239.315	1.822	10	20	BDCD	
CN(CC1CC1)c1ccc(OCC(=O)O)cc1	846280026	SJOWRKCIIRLQFX-UHFFFAOYSA-N	235.283	1.996	10	20	BDCD	
Cc1cc(C)c(O)c(CN(C)[C@@H]2CCNC2=O)c1	758396016	BBEVLLRTULHRRP-GFCCVEGCSA-N	248.326	1.329	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C(=O)O)C2CC2)c1	86758697	BZYISWCWYKAYAD-GFCCVEGCSA-N	235.283	1.653	10	20	BDCD	
CCc1cccc(CN2C[C@H](C)[C@@H](O)C2)c1O	897680527	SGAMOMRIGLTCBV-GWCFXTLKSA-N	235.327	1.767	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@@H](C)C(=O)O	162956528	ORLUZOBJTMFWEP-BDAKNGLRSA-N	223.272	1.591	10	20	BDCD	
CN(CC(F)F)C(=O)Cc1ccc(N)cc1	158020160	DKHFOCZKCTYVQL-UHFFFAOYSA-N	228.242	1.535	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@@H](O)C(F)(F)F	865711766	QIGBYQYMOODXPY-OIBJUYFYSA-N	249.232	1.794	10	20	BDCD	
C[C@@H](CN[C@H](C)c1ccccc1O)N(C)C	38088822	MDKUBGOFDWNOJN-WDEREUQCSA-N	222.332	1.993	10	20	BDCD	
CCN(CCO)Cc1cccc(Cl)c1O	132478849	IQTBTNGUIVFBDN-UHFFFAOYSA-N	229.707	1.860	10	20	BDCD	
CCO[C@H]1CN(CCN=[N+]=[N-])C[C@@H]1OCC	409430452	IOUKTVSZWMZCFZ-UWVGGRQHSA-N	228.296	1.423	10	20	BDCD	
Cn1nnnc1Sc1ncc(Cl)s1	60220113	OYCSRLZXBZUGMU-UHFFFAOYSA-N	233.709	1.471	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCOC2)cc1	70964846	SYBZZUMJRBHEKN-LBPRGKRZSA-N	220.316	1.631	10	20	BDCD	
C[C@H](N[C@@H]1CCN(C)C1)c1ccccc1O	42544117	APWITNXQFKBVDN-WDEREUQCSA-N	220.316	1.747	10	20	BDCD	
Cc1ccc(O)c(CN2CCC(C(=O)O)CC2)c1	86727632	GXXQMBKFMPDVCE-UHFFFAOYSA-N	249.310	1.997	10	20	BDCD	
CC[C@@H](NCCN)c1ccc(N(C)C)cc1	817934248	DWIHTKAOLIIZTG-CYBMUJFWSA-N	221.348	1.752	10	20	BDCD	
NOCCCNCc1cc(Cl)ccc1O	904457746	UOWYTCWOTGJJFV-UHFFFAOYSA-N	230.695	1.416	10	20	BDCD	
CNC[C@@H]1CCN(Cc2cccc(C)c2O)C1	843053507	ZKXWJCAHBPXWNJ-LBPRGKRZSA-N	234.343	1.742	10	20	BDCD	
COc1cccc(O)c1CNC[C@H](N)C(C)C	841028903	KQWJTUHUWBQFQU-NSHDSACASA-N	238.331	1.474	10	20	BDCD	
CCNC(=O)N[C@H](C)c1ccccc1O	864423803	HNLCXBQBDHTJMH-MRVPVSSYSA-N	208.261	1.772	10	20	BDCD	
NCCCCCC(=O)NCc1ccc(N)cc1	83362628	VUAUNXLDUHDHIU-UHFFFAOYSA-N	235.331	1.404	10	20	BDCD	
C[C@H](CCCN)NCc1ccc(N)cc1	1334753500	GDIAXSZMPGUDOX-SNVBAGLBSA-N	207.321	1.486	10	20	BDCD	
CNC(=O)C[C@@H](C)NCc1ccc(C)cc1O	877573636	SWNYFNRLBRKRSB-SNVBAGLBSA-N	236.315	1.315	10	20	BDCD	
Cc1ncc(NC(=O)c2cccc(O)c2O)cn1	395273064	URGMFFAQKYMBQI-UHFFFAOYSA-N	245.238	1.449	10	20	BDCD	
C[C@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccccc1O	834907311	NOPLOJVVWPJVHD-GARJFASQSA-N	248.326	1.697	10	20	BDCD	
Cn1ccc([C@@H]2CCCN(CCN=[N+]=[N-])C2)n1	409433042	XAXTVTGPJZGDHG-SNVBAGLBSA-N	234.307	1.910	10	20	BDCD	
CCN(Cc1cc(C)ccc1O)[C@H]1CCNC1=O	281894270	YOBBMOJXIACCRI-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
Oc1ccccc1CNCCn1cccn1	42538651	NQGRKRKPHRFAIC-UHFFFAOYSA-N	217.272	1.379	10	20	BDCD	
CC(=O)C(=O)COc1ccc([N+](=O)[O-])cc1C	289687132	PZFVNCSXVMKWHX-UHFFFAOYSA-N	237.211	1.440	10	20	BDCD	
C[C@@H]1NCC[C@H]1C(=O)Nc1ccc(N)cc1	832244143	LWHABRWHCIXCKS-GZMMTYOYSA-N	219.288	1.205	10	20	BDCD	
C[C@H]1OCC[C@H]1NCCc1ccc(N)cc1	841033807	BJOZTJLHIXCFEN-ZWNOBZJWSA-N	220.316	1.578	10	20	BDCD	
O=C(NCc1ccc[nH]1)c1cc(O)cs1	747516390	LKAKHQGIMWOFEK-UHFFFAOYSA-N	222.269	1.712	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2CCCN2)c1	841035730	LAUAGPSVQBMVAZ-LBPRGKRZSA-N	220.316	1.542	10	20	BDCD	
Nc1ccc(-n2cc([C@@H](O)C3CC3)nn2)cc1	849134580	HNVPWRKMESMLGU-LBPRGKRZSA-N	230.271	1.293	10	20	BDCD	
Cc1cccc(O)c1CNCc1nonc1C	877526082	FUUOYRCVBBTWIF-UHFFFAOYSA-N	233.271	1.682	10	20	BDCD	
Cc1ccc(CN2CC(=O)NCC2(C)C)c(O)c1	877501398	OIQYTSDBOLSSOU-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
CC[C@H](C)[C@@H](O)CNC(=O)c1cc(O)cs1	771063147	DWGIYFSCZSKYSC-CBAPKCEASA-N	243.328	1.591	10	20	BDCD	
COc1ccc(CNC(=N)NCC2CC2)c(O)c1	887357769	DOGMIBWVIOZBEE-UHFFFAOYSA-N	249.314	1.425	10	20	BDCD	
C[C@@H]1NCCC[C@@H]1NCc1ccccc1O	396609274	AVVDSZOTLKLNFT-JQWIXIFHSA-N	220.316	1.622	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CC[C@H](CN)C2)cc1	724060885	XVHKWDSERYZAKT-KBPBESRZSA-N	247.386	1.970	10	20	BDCD	
CC[C@H](O)CCNCc1cc(OC)ccc1O	164767486	DOGUANWAVADDLT-NSHDSACASA-N	239.315	1.651	10	20	BDCD	
C[C@@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCN1	400714363	FHLTUKRMAUATTN-DOMZBBRYSA-N	247.386	1.983	10	20	BDCD	
CCOC(=O)CN(Cc1ccccc1O)C1CC1	179559598	HKGLUCQYKJDRGO-UHFFFAOYSA-N	249.310	1.920	10	20	BDCD	
CC(C)(C)[C@@H](N)CC(=O)NCc1ccc(N)cc1	1343495072	LTEDAHCNOUMHFK-LBPRGKRZSA-N	249.358	1.649	10	20	BDCD	
C[C@@H](CO)NCc1cc(Cl)ccc1O	35602967	MJGUYZISENODNV-ZETCQYMHSA-N	215.680	1.516	10	20	BDCD	
CNCCCN(C)Cc1ccc(N(C)C)cc1	124738886	YZKREQRQNJVQKB-UHFFFAOYSA-N	235.375	1.794	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCCCO1	126612274	CQPDFGSQSCCLPT-UHFFFAOYSA-N	223.228	1.265	10	20	BDCD	
COC1(CC(=O)NCc2ccc(N)cc2)CCC1	234604061	GNWOLNSOXRNICX-UHFFFAOYSA-N	248.326	1.844	10	20	BDCD	
Cn1cc(CCC(=O)Nc2ccc(N)cc2)cn1	237772553	SRUNELYMZNFUJG-UHFFFAOYSA-N	244.298	1.574	10	20	BDCD	
CCN(CC)c1ccc(CN(C)CC(N)=O)cc1	265961475	QLPYOCUPZYHKTD-UHFFFAOYSA-N	249.358	1.450	10	20	BDCD	
CO[C@](C)(C(=O)NCc1ccccc1O)C1CC1	292238352	GEIRLDFQQSMZAO-AWEZNQCLSA-N	249.310	1.824	10	20	BDCD	
O=C(CSC1CC1)NCc1ccccc1O	295310055	RSTUMXKPVFTRHC-UHFFFAOYSA-N	237.324	1.904	10	20	BDCD	
C[C@](O)(C(=O)NCc1ccccc1O)C1CCC1	813489445	ZOTATXBQWDLSEA-CQSZACIVSA-N	249.310	1.560	10	20	BDCD	
C[C@@H](O)CN(C)Cc1cc(Cl)c(F)cc1O	816569107	ZRBJKPAZEQMINR-SSDOTTSWSA-N	247.697	1.997	10	20	BDCD	
C[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccccc1O	817977878	QZJXHFUCAAMQAY-GOONRYMUSA-N	218.300	1.261	10	20	BDCD	
CC[C@@H](NCc1cc(F)ccc1O)C(=O)O	820418715	AQZCHJXIVXAWLG-SECBINFHSA-N	227.235	1.484	10	20	BDCD	
C[C@]1(O)CCN(C(=O)c2cc(O)cs2)C1	748508025	KOPIZSFUANSILU-JTQLQIEISA-N	227.285	1.051	10	20	BDCD	
NC[C@@H](NCc1ccccc1O)C1CCCC1	841088255	UHMMPZIRZCSWMY-CYBMUJFWSA-N	234.343	1.999	10	20	BDCD	
C[C@@H]1COC[C@H]1NC(=O)c1cc(O)cs1	928909397	DWTDRCJRHHMDAL-HTRCEHHLSA-N	227.285	1.218	10	20	BDCD	
CNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C	840255343	DCJNQEVEOPDVFF-NSHDSACASA-N	249.358	1.921	10	20	BDCD	
CCC(CC)(CN)C(=O)N(C)c1ccc(N)cc1	877077638	POWLKSAQHZDXAY-UHFFFAOYSA-N	249.358	1.997	10	20	BDCD	
Oc1ccc(F)cc1CN1CCn2ncnc2C1	770664035	JSNNSQRUYVEVNY-UHFFFAOYSA-N	248.261	1.139	10	20	BDCD	
CCN(C)c1ccc(CN2CC[C@H](CO)C2)cc1	773752087	HVLWIQKJBMJONB-AWEZNQCLSA-N	248.370	1.957	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCc2c[nH]cn2)c1	88750719	ZNLVMEQMXSTJDY-VIFPVBQESA-N	247.298	1.975	10	20	BDCD	
Cc1cc(O)c(CNCCCCN)cc1C	1325624933	HLNYLUAWQZJLED-UHFFFAOYSA-N	222.332	1.838	10	20	BDCD	
C[C@@H](O)CNCc1cc(F)c(N(C)C)cc1F	1329120881	BISORBNUTDYVLO-MRVPVSSYSA-N	244.285	1.501	10	20	BDCD	
CO[C@@H]1CCC[C@@H]1C(=O)NCc1ccccc1O	1353617678	IZHPWCHNKGOHAV-WCQYABFASA-N	249.310	1.824	10	20	BDCD	
CC[C@@H](C)C[C@@H](N)C(=O)NCc1ccc(N)cc1	1356237805	AXPQFUIMNSBWCN-ZWNOBZJWSA-N	249.358	1.649	10	20	BDCD	
C[S@](=O)CCNCc1c(O)cccc1Cl	124176648	JIANMAWXBVUSJN-OAHLLOKOSA-N	247.747	1.514	10	20	BDCD	
CCc1cccc(CNC2(C)COC2)c1O	864049931	OSTGGNGXSLCJAU-UHFFFAOYSA-N	221.300	1.833	10	20	BDCD	
Cc1cccc(O)c1CNCC1(N(C)C)CC1	877594811	ZWIHCIIKMIGHEU-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
COc1cccc(CNCC2=CCCOC2)c1O	288499101	RPUDZADEZYDQJP-UHFFFAOYSA-N	249.310	1.837	10	20	BDCD	
CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1	68535556	JDGHGGRIYSLDNK-UHFFFAOYSA-N	248.326	1.502	10	20	BDCD	
COC(=O)CN(C)Cc1cc(F)ccc1O	179935289	QEVSVBWJYCFDKL-UHFFFAOYSA-N	227.235	1.136	10	20	BDCD	
COc1cccc(CN[C@@H]2CCOC2)c1O	87784615	YZAXLUWBVRWCBL-SNVBAGLBSA-N	223.272	1.279	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](O)C1)c1ccc(F)c(F)c1O	295987797	PHEVGJFSEAUYGX-BIIVOSGPSA-N	243.253	1.844	10	20	BDCD	
CN(Cc1ccccc1O)[C@@H]1CC(C)(C)OC1=O	814178827	DZFHZEWMFRWAEJ-LLVKDONJSA-N	249.310	1.918	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](CCN)C(F)F)c1	841074328	NUSNUHZRUUMQQD-SNVBAGLBSA-N	244.285	1.773	10	20	BDCD	
C[C@H](CNCc1cccc(Cl)c1O)C(=O)O	848638193	QFSBHJIXZGQMFS-SSDOTTSWSA-N	243.690	1.856	10	20	BDCD	
Oc1c(F)cccc1CNC[C@H]1CCCNC1	841032543	GOAIQEOKYUERPJ-JTQLQIEISA-N	238.306	1.621	10	20	BDCD	
C[C@H]1CN(Cc2cccc(F)c2O)CC[C@H]1N	843051423	HFVBPQZNKFFJFL-JOYOIKCWSA-N	238.306	1.700	10	20	BDCD	
CN[C@H](C)CCN[C@@H]1CCc2cccc(O)c21	1118057219	BVRFYQBVIYTMPC-ZYHUDNBSSA-N	234.343	1.967	10	20	BDCD	
COCCCSc1ncc(C(=O)O)s1	389295444	JYHGWQXSAYDOHX-UHFFFAOYSA-N	233.314	1.970	10	20	BDCD	
CN(C)c1ccc(CNc2nnco2)cc1	276519899	USDNIIIHBHPNBG-UHFFFAOYSA-N	218.260	1.748	10	20	BDCD	
CNc1ncccc1C(=O)Oc1ccc(N)cc1	1578764567	YUVOLCGYHHIKCP-UHFFFAOYSA-N	243.266	1.925	10	20	BDCD	
C[C@H]1C[C@H](N)CCN1Cc1ccccc1O	168844905	LCYJMLUNZJSYGT-CMPLNLGQSA-N	220.316	1.704	10	20	BDCD	
Nc1ccc(CCNC(=O)COCC2CC2)cc1	152583532	RNYSSUIFUNWBPQ-UHFFFAOYSA-N	248.326	1.354	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@@H]2C(=O)O)cc1	6027047	OABUZGQTMZSWTB-CYBMUJFWSA-N	248.326	1.802	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCCO)c1	20597021	PHBPHYBFHIKZNL-QMMMGPOBSA-N	211.261	1.044	10	20	BDCD	
Cc1ccc(O)c(CN(C)C[C@H](C)C(=O)O)c1	86807685	XHKNEGWLTFCVRC-JTQLQIEISA-N	237.299	1.853	10	20	BDCD	
C[C@@H]1C[C@@H](NCCO)c2c(O)ccc(F)c21	381259265	RNMDJPJGVGWXFE-VXNVDRBHSA-N	225.263	1.662	10	20	BDCD	
CC(=O)C(=O)CSc1ncc2ccccn12	808014354	FKDFGWAIPOVAEU-UHFFFAOYSA-N	234.280	1.585	10	20	BDCD	
COC(=O)c1cnc(SCCCCO)s1	295351265	QTTJRDBTVXBYFW-UHFFFAOYSA-N	247.341	1.794	10	20	BDCD	
CCN(C)c1ccc([C@@H](C)NC2CNC2)cc1	817955600	ZRKJYVDWVWGWQC-LLVKDONJSA-N	233.359	1.765	10	20	BDCD	
C[C@@H](CN)CNCc1cccc(Cl)c1O	841049792	WKFULCNIHXSPNW-QMMMGPOBSA-N	228.723	1.730	10	20	BDCD	
Cc1ccc(C(=O)OCCF)c(O)c1O	744909608	JUTMYDYAZHDLLK-UHFFFAOYSA-N	214.192	1.533	10	20	BDCD	
N[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1	843046859	GKTKVXAQNONLFJ-VIFPVBQESA-N	244.697	1.718	10	20	BDCD	
CNC[C@H](C)NCc1cccc(OC)c1O	853248722	JDYRWGSAIPTUNW-VIFPVBQESA-N	224.304	1.098	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)CC[C@H]1N	1120263589	SLBFGUALBDLJBX-GXFFZTMASA-N	219.332	1.438	10	20	BDCD	
C[C@H](N[C@H](C)CC(N)=O)c1c(O)cccc1F	886543170	LIVPPSBYLVVUBP-SFYZADRCSA-N	240.278	1.446	10	20	BDCD	
CC(F)(F)C(=O)NCc1cccc(O)c1O	1123977282	DOFOTOIKQXYBGE-UHFFFAOYSA-N	231.198	1.369	10	20	BDCD	
CN(CC[N+](=O)[O-])Cc1ccccc1O	791053176	BJPYLALINBIUTI-UHFFFAOYSA-N	210.233	1.101	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1C[C@H](CO)C1	897357606	LQXOQDXTKHKUFR-XYPYZODXSA-N	221.300	1.561	10	20	BDCD	
CO[C@@H]1CCO[C@]2(CCN(CCN=[N+]=[N-])C2)C1	409434949	RLAKTJYPLLQEDG-GHMZBOCLSA-N	240.307	1.567	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2C[C@@H]2F)cc1	1122540282	RHOAPAXQPFVSFK-UWVGGRQHSA-N	208.236	1.243	10	20	BDCD	
C[C@H](NC[C@@H]1CCCNC1=O)c1ccccc1O	838916124	DVFBHNBAXFUJPT-QWRGUYRKSA-N	248.326	1.569	10	20	BDCD	
CO[C@@H](C)CC(=O)Nc1ccc(N)cc1	160457490	LALXYYZUCCKDCJ-QMMMGPOBSA-N	208.261	1.632	10	20	BDCD	
COc1ccc(O)c(CN2CCC[C@@H]2CO)c1	179665511	OXUWXHSZPZDCII-LLVKDONJSA-N	237.299	1.358	10	20	BDCD	
Cc1ccc(O)c(CNCCC[S@@](C)=O)c1	116919772	ZVEDHOMMCGHSBV-INIZCTEOSA-N	241.356	1.559	10	20	BDCD	
C[C@H](NCC1(CO)CC1)c1ccccc1O	154741771	QATNFOVSOLLTIC-JTQLQIEISA-N	221.300	1.815	10	20	BDCD	
Cc1ccc(O)c(CN2CCOC[C@@H]2C)c1	132605207	HTHVMGYXEQOQPS-NSHDSACASA-N	221.300	1.921	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@H](CO)C2)cc1C	92763681	HJMOCFLFBFEXLT-LBPRGKRZSA-N	235.327	1.823	10	20	BDCD	
c1cc(CNCc2ccc3c(c2)CCO3)on1	231882796	IIMPFTNWDHQEFE-UHFFFAOYSA-N	230.267	1.899	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCC[C@@H](N)C2)cc1	294779897	NSHMIMSSHGMWOI-GXSJLCMTSA-N	233.315	1.725	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H](N)C2CCC2)cc1	817859015	LTUSMIFPOJYLNS-ZDUSSCGKSA-N	247.342	1.055	10	20	BDCD	
COc1ccc(CNC/C=C\CO)cc1C	717532254	MQQVYFNYTPDXIK-ARJAWSKDSA-N	221.300	1.642	10	20	BDCD	
C[C@@H](NCCCON)c1cc(F)cc(F)c1O	902426918	YYLBXVPZPDMXSF-SSDOTTSWSA-N	246.257	1.601	10	20	BDCD	
C[C@@]1(CNCCc2ccc(N)cc2)CCCNC1	904353631	PJZUTIWMAUMXBB-OAHLLOKOSA-N	247.386	1.791	10	20	BDCD	
Cc1cccc(CN2C[C@H](C)NC[C@H]2C)c1O	843120112	XVAXHMUNUWWCIZ-NWDGAFQWSA-N	234.343	1.883	10	20	BDCD	
Cc1cc(CN(C)C2CC(N)C2)ccc1N(C)C	923361242	HCKWTSYAZSVFKQ-UHFFFAOYSA-N	247.386	1.983	10	20	BDCD	
Cc1cc(CN2CC[C@@H]2CO)ccc1N(C)C	934019357	PLOSJVAVOXURCI-CYBMUJFWSA-N	234.343	1.628	10	20	BDCD	
Cc1nc(CCNCc2c(C)cccc2O)n[nH]1	877180198	QGVXDARYDMLQLU-UHFFFAOYSA-N	246.314	1.459	10	20	BDCD	
Cc1ccc(CNC[C@H](O)C2CCC2)c(O)c1	877574832	WWUDUOJTVLHDNG-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
CN(C)c1ccc(CNc2nncn2C)cc1F	765944834	QDACNSAHLVBWLR-UHFFFAOYSA-N	249.293	1.632	10	20	BDCD	
CCCn1cc(COc2ccc(N)cc2)nn1	880953512	JIBXQABUMIDSLP-UHFFFAOYSA-N	232.287	1.849	10	20	BDCD	
Oc1ccccc1CNCC1CCOCC1	82367493	KOUIHYZWRCZTJH-UHFFFAOYSA-N	221.300	1.908	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H]2F)cc1	1337079629	CVTGVIOVXORMAT-NEPJUHHUSA-N	236.290	1.727	10	20	BDCD	
COCCOCCCNCc1ccccc1O	20191928	WKHLUJUECQVKQV-UHFFFAOYSA-N	239.315	1.535	10	20	BDCD	
CO[C@H](C(=O)NCc1ccccc1O)C1CC1	281445034	FIWWLLXOCXHGRE-LBPRGKRZSA-N	235.283	1.433	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@@H]1COCCO1)CC2	386534201	PRSZTEAAHPQUPJ-VXGBXAGGSA-N	249.310	1.385	10	20	BDCD	
CN(Cc1nccc(N)n1)Cc1ccccc1O	135187012	KHTNRNKUJJYTGP-UHFFFAOYSA-N	244.298	1.396	10	20	BDCD	
CCOC(=O)N1CCN(CCN=[N+]=[N-])CC1	233671803	KOZAGKFZGUKGFK-UHFFFAOYSA-N	227.268	1.071	10	20	BDCD	
CN(Cc1ccoc1)C(=O)c1cccc(O)c1O	126283232	CJRSBZPYHZFBRD-UHFFFAOYSA-N	247.250	1.963	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCO[C@H]2C)c1	134245952	VFKZRPZJNYHXJG-JQWIXIFHSA-N	221.300	1.968	10	20	BDCD	
COC(=O)[C@H](NCc1ccccc1O)C1CC1	234573632	VWPZWJVPDMOVQL-GFCCVEGCSA-N	235.283	1.433	10	20	BDCD	
CC(=O)C(=O)CSc1nc(C)cs1	289737198	TVSIGNVPBKLJMT-UHFFFAOYSA-N	215.299	1.702	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](O)C1)c1ccc(N(C)C)cc1	296094810	YJZIETOCHFVXQO-VHRBIJSZSA-N	234.343	1.927	10	20	BDCD	
CCCN[C@@H](C)C(=O)Nc1ccc(N)cc1	294882804	XPTICJHWPMVMCR-VIFPVBQESA-N	221.304	1.595	10	20	BDCD	
C[C@@H](NCC1CNC1)c1cc(F)cc(F)c1O	817964891	IPPLOYFJABWOTR-SSDOTTSWSA-N	242.269	1.540	10	20	BDCD	
C[C@@H](NCC(F)(F)CN)c1ccccc1O	817966520	PNRQVOGZQXZJIO-MRVPVSSYSA-N	230.258	1.637	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCCNC2)c1	841043051	NLLIFEQHXKWEMN-GFCCVEGCSA-N	220.316	1.542	10	20	BDCD	
Nc1ccc(-n2cc(C[C@H](O)C3CC3)nn2)cc1	849134716	MIFIDSUPRVMDQM-ZDUSSCGKSA-N	244.298	1.163	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC1=NC[C@@H](C)N1	849009171	IBNDGDFVFWUHBV-LLVKDONJSA-N	246.358	1.498	10	20	BDCD	
CN(C(=O)[C@@H]1CCC[C@H](N)C1)c1ccc(N)cc1	877079083	PPGFDFQWBRCMGM-PWSUYJOCSA-N	247.342	1.749	10	20	BDCD	
CNC[C@@H]1CCCN1Cc1ccccc1O	169233789	JPUWJPNXZJGZHY-LBPRGKRZSA-N	220.316	1.576	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1ccccn1	159108775	ZHBHYXTVKCRERT-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
COc1cccc(O)c1CN1CCC(N)CC1	843047337	LXLNXXLJEPBVOY-UHFFFAOYSA-N	236.315	1.324	10	20	BDCD	
CN(C)c1ccc(CN2C[C@@H]3CC[C@H](C2)N3)cc1	873217670	OHQKIROVAJYDDK-OKILXGFUSA-N	245.370	1.689	10	20	BDCD	
CC[C@H](CNC(=O)Nc1ccc(N)cc1)OC	310513859	VADBLQWRWBQADF-LLVKDONJSA-N	237.303	1.815	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)Cc2ccccc2)C1	409422639	HADGZBLFJVWSLI-UHFFFAOYSA-N	216.244	1.750	10	20	BDCD	
COc1ccc(O)c(CNC(=O)[C@@H](C)OC)c1	114541977	VEFUXKJDCPOMTF-MRVPVSSYSA-N	239.271	1.052	10	20	BDCD	
C[C@H]1CCCN(Cc2ccccc2O)[C@@H]1CN	70175711	YSGNHAYMMQYRNB-WCQYABFASA-N	234.343	1.951	10	20	BDCD	
CCN(CCOC)Cc1cccc(OC)c1O	133267554	DGUYDICOXWODME-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2CCCNC2)cc1	132024168	UEIYFHYEABVRON-AWEZNQCLSA-N	247.386	1.842	10	20	BDCD	
CN(Cc1ncnn1C)c1ccc(N)cc1	83971643	HEXBBSAYDWMMKB-UHFFFAOYSA-N	217.276	1.034	10	20	BDCD	
C[C@H]1OCC[C@]1(O)CNCc1ccccc1O	227976239	GVMJINDZUHHTOR-MFKMUULPSA-N	237.299	1.022	10	20	BDCD	
C[C@H](O)CN(C)Cc1cc(Cl)c(F)cc1O	294092177	ZRBJKPAZEQMINR-ZETCQYMHSA-N	247.697	1.997	10	20	BDCD	
C[C@H](NCCNC1CC1)c1cc(F)ccc1O	817953733	PVMPJCCFRHRYOU-VIFPVBQESA-N	238.306	1.934	10	20	BDCD	
O=C(Nc1cn[nH]c1)c1cc(O)cs1	732269501	VKBZNDBPKLHOFO-UHFFFAOYSA-N	209.230	1.429	10	20	BDCD	
O=C(O)[C@@H]1CCC[C@@H]1NCc1ccccc1O	901483802	XDMAMEUYUMKPRR-MNOVXSKESA-N	235.283	1.735	10	20	BDCD	
NC1CC(NCc2cc(Cl)cc(F)c2O)C1	906511204	YHJOKKWEURQRIP-UHFFFAOYSA-N	244.697	1.764	10	20	BDCD	
COCC[C@H](C)CNC(=O)c1cc(O)cs1	839810347	LTFHEIFZKVDOAQ-QMMMGPOBSA-N	243.328	1.856	10	20	BDCD	
COc1cccc(CNC[C@H]2CCCN2)c1O	841035150	IGIFXMBYPZWZQH-LLVKDONJSA-N	236.315	1.242	10	20	BDCD	
COCC1(C(=O)N[C@H](C)c2ccccc2O)CC1	827941110	MIXYBEPBGJCSSL-SNVBAGLBSA-N	249.310	1.996	10	20	BDCD	
CC(=O)C(=O)COc1cc(F)ccc1C	863349711	VEPTZXBUNYQIRQ-UHFFFAOYSA-N	210.204	1.671	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@@H](O)C1CC1	708441042	HWJMQSIXEHBCHX-LLVKDONJSA-N	243.253	1.531	10	20	BDCD	
CC(C)[C@@H](C(=O)NCc1ccc(N)cc1)N(C)C	1343474283	UCEVKYZWTPYLEE-ZDUSSCGKSA-N	249.358	1.471	10	20	BDCD	
C[C@H](NCc1ccccc1O)C(C)(C)O	122089639	LWIQRJVCTPHOIV-VIFPVBQESA-N	209.289	1.641	10	20	BDCD	
CC(C)[C@@H](N)C(=O)Nc1ccc(N)cc1	169813692	HEGCDNWMICIEJZ-SNVBAGLBSA-N	207.277	1.191	10	20	BDCD	
OC[C@@H](NCc1ccc2c(c1)CCO2)C1CC1	734161533	UFVURZPJAOODSH-CYBMUJFWSA-N	233.311	1.482	10	20	BDCD	
Nc1ccc(NC(=O)N2CCCCO2)cc1	841297069	MRBKEZNHRXXFPB-UHFFFAOYSA-N	221.260	1.828	10	20	BDCD	
C[C@@H](NC(=O)CCCCN)c1ccccc1O	870988303	MESNODMMMIHFAY-SNVBAGLBSA-N	236.315	1.698	10	20	BDCD	
CC[C@]1(C(=O)Nc2ccc(N)cc2)CCCN1	134365342	VMDRBVLKADIKCX-CYBMUJFWSA-N	233.315	1.740	10	20	BDCD	
CN1CCCc2cc(CNC(N)=O)ccc21	194604645	LKBVBHGVJOXRDR-UHFFFAOYSA-N	219.288	1.237	10	20	BDCD	
Oc1ccccc1CNC[C@H]1CCCN1	229321445	BLWRWDSYQPBREM-LLVKDONJSA-N	206.289	1.234	10	20	BDCD	
C[C@H](N)[C@H]1CCN(Cc2cc(F)ccc2O)C1	220341268	VTFCCNWUMBNNPC-UWVGGRQHSA-N	238.306	1.700	10	20	BDCD	
CC[C@@H]1CN(Cc2cc(C)ccc2O)C[C@@H]1O	271407560	WZSGUNHIKIWNIY-RISCZKNCSA-N	235.327	1.903	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@H]1CCNC1)CC2	817944609	IAOHRXDULMPLMM-QWRGUYRKSA-N	218.300	1.331	10	20	BDCD	
CCOc1ccc(CNCCNC)c(O)c1	841034824	FPIBLVBWWZUCCR-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
CCCN1CC(=O)N[C@@H]1c1cc(C)c(C)cc1O	840823726	BXYRRMTYTZJQDX-AWEZNQCLSA-N	248.326	1.849	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](O)C1)c1c(O)cccc1F	886621906	FVEWUDVJLUXPCT-XHNCKOQMSA-N	225.263	1.705	10	20	BDCD	
COc1cc(C)cc(CN[C@@H]2CCOC2)c1O	894355517	XXPZQEGEABLBCV-LLVKDONJSA-N	237.299	1.588	10	20	BDCD	
C[C@@H]1CCN1C(=O)c1cccc(O)c1O	706850854	XJACNQPPXWFHAY-SSDOTTSWSA-N	207.229	1.332	10	20	BDCD	
C[C@@H]1COC[C@H]1NCc1ccccc1O	688046041	GWKYORWWPOBGNY-MWLCHTKSSA-N	207.273	1.517	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCCSC1	1262643175	GAQZWLZGCJUADS-UHFFFAOYSA-N	239.296	1.634	10	20	BDCD	
C[C@H]1CCCN1C(=O)c1cccc(O)c1O	163272205	IDXJKRFDCBUVLG-QMMMGPOBSA-N	221.256	1.722	10	20	BDCD	
CNC(=O)N[C@@H](C)c1cc(OC)ccc1O	171409119	HVNPRSNJIZVHOX-ZETCQYMHSA-N	224.260	1.391	10	20	BDCD	
Cc1cccc(O)c1CNCC(C)(C)O	877040472	XIIXLOJCFAIMCL-UHFFFAOYSA-N	209.289	1.561	10	20	BDCD	
Oc1ccc(F)cc1CN1CCC[C@@H](O)C1	179871549	JKORSLQFZOMKQX-LLVKDONJSA-N	225.263	1.488	10	20	BDCD	
Cc1ccc(O)c(CNCCCC(=O)O)c1	70955223	FVICLCOOURRFBI-UHFFFAOYSA-N	223.272	1.655	10	20	BDCD	
C[C@H]1OCC[C@H]1NCc1ccc2c(c1)CCO2	120820928	GJLMVLIBOKYEQM-ZWNOBZJWSA-N	233.311	1.889	10	20	BDCD	
COc1cccc(CN[C@@H](C)CF)c1O	288453172	NEIJHCZCFNQQMJ-QMMMGPOBSA-N	213.252	1.848	10	20	BDCD	
C[C@@H](CN(C)C)NC(=O)c1cc(O)cs1	807777986	QOFHWCHPHCOBRG-ZETCQYMHSA-N	228.317	1.134	10	20	BDCD	
Cc1nn[nH]c1C(=O)N[C@H](C)c1ccccc1O	827946654	NKNAMBJAULHFEQ-SSDOTTSWSA-N	246.270	1.310	10	20	BDCD	
C/C(=C\CN(C)c1ccc2c(c1)OCO2)C(=O)O	833382806	LQYWQJBSVMOTMS-WEVVVXLNSA-N	249.266	1.882	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)CCO	902864674	WXACSGRYQRGLSY-UHFFFAOYSA-N	236.315	1.060	10	20	BDCD	
C[C@H](O)C[C@@H](C)CNC(=O)c1cc(O)cs1	748375766	NDEAFWMGCPLENE-SFYZADRCSA-N	243.328	1.591	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C[C@@H](C)N)c1O	843129552	PPFDTAJXUVKKSN-MNOVXSKESA-N	222.332	1.916	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2CCCNC2)c1	841033414	UIRNPWDWXJGDOX-GFCCVEGCSA-N	234.343	1.790	10	20	BDCD	
CCCN(CCO)Cc1c(O)cccc1OC	768174176	ICQHHBYBHJMREC-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
Cc1ccc(CN(C)C[C@H](C)O)c(O)c1	877320678	QEBVBNOJXLNNDX-JTQLQIEISA-N	209.289	1.513	10	20	BDCD	
OCC[C@@H]1CCCN1Cc1ccccc1O	779201249	CELWONZJMZWFHU-LBPRGKRZSA-N	221.300	1.739	10	20	BDCD	
CC1(C)CNCC[C@H]1NCc1ccc(N)cc1	1120370573	AYTKKQLKEFBIQU-CYBMUJFWSA-N	233.359	1.747	10	20	BDCD	
COC(=O)CCCOC(=O)c1cc(O)cs1	783152868	NWDULIAADBNCKG-UHFFFAOYSA-N	244.268	1.564	10	20	BDCD	
COc1cc(C)cc(CN[C@@H](C)CO)c1O	894317266	XHWAIIJNOIMFND-VIFPVBQESA-N	225.288	1.180	10	20	BDCD	
CC[C@@H](NCc1nnn(C)n1)c1ccccc1O	398086531	QBAJLFACMNUVRV-SNVBAGLBSA-N	247.302	1.157	10	20	BDCD	
CNC(=O)CN(C)c1ccc(OC)c(F)c1	131431780	DKAKLMDNGYNKMJ-UHFFFAOYSA-N	226.251	1.017	10	20	BDCD	
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)F	194848487	DMRYKWSCCALVAV-LURJTMIESA-N	245.225	1.410	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCCNC1	82280826	VKBJUEFKQYYPRG-LLVKDONJSA-N	234.299	1.008	10	20	BDCD	
CC(C)N(C)CC(=O)NCCc1ccc(N)cc1	236649082	FZYNYMJKCHVPFH-UHFFFAOYSA-N	249.358	1.268	10	20	BDCD	
CN(CCc1ccnn1C)c1ccc(N)cc1	230764773	MIKVZGOXRMPLOK-UHFFFAOYSA-N	230.315	1.681	10	20	BDCD	
Cc1cccc(CN2CC[C@@](C)(C(N)=O)C2)c1O	235915318	TWCNCBVSUOYZBE-CQSZACIVSA-N	248.326	1.398	10	20	BDCD	
NCC(F)(F)CN[C@H]1CCc2cccc(O)c21	817967172	DNAQPNKAMFZDLB-VIFPVBQESA-N	242.269	1.563	10	20	BDCD	
Cc1cc(CNC(=O)c2cc(O)cs2)n[nH]1	733366868	NWVKQGANRWWRIE-UHFFFAOYSA-N	237.284	1.415	10	20	BDCD	
O=C(Nc1cccnc1O)c1cc(O)cs1	732280890	ULEIFZUQAHWFMG-UHFFFAOYSA-N	236.252	1.807	10	20	BDCD	
Cc1ccc(CN2CC(=O)N(C3CC3)C2)c(O)c1	877486678	PWTCOPIGAJCGJT-UHFFFAOYSA-N	246.310	1.465	10	20	BDCD	
C[C@H](O)[C@H](C)NCc1ccc(N2CC=CC2)cc1	1327979789	XMCSHSNTDMJVAT-STQMWFEESA-N	246.354	1.922	10	20	BDCD	
CCc1cccc(CN2CC(C(=O)O)C2)c1O	1593642005	GHOUOEMTVXVHOX-UHFFFAOYSA-N	235.283	1.471	10	20	BDCD	
C[C@@H](CO)CNCc1cccc(F)c1O	165167757	KHFQLCJVABJKNJ-MRVPVSSYSA-N	213.252	1.249	10	20	BDCD	
COc1cc(CN2CCOCC2)c(O)cc1C	159464538	PZUXOFBVUVZKOB-UHFFFAOYSA-N	237.299	1.541	10	20	BDCD	
NC[C@@H]1CC[C@@H](NC(=O)Cc2ccc(N)cc2)C1	834860623	CKRAUQBJEQKKQX-DGCLKSJQSA-N	247.342	1.055	10	20	BDCD	
Cc1cccc(O)c1CNCCn1cccn1	876959893	QKWGVINQIVPECC-UHFFFAOYSA-N	231.299	1.687	10	20	BDCD	
CN1CCC[C@H](NCc2ccccc2O)C1=O	704366828	HWDJWWLDJNEHPS-NSHDSACASA-N	234.299	1.103	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCO[C@H]2C2CC2)cc1	1345159808	MQXPQEOAGBLIBS-KGLIPLIRSA-N	232.327	1.926	10	20	BDCD	
CC[C@](C)(CO)NCc1cc(C)ccc1O	70898963	YQARMFVPMKLKHF-CYBMUJFWSA-N	223.316	1.951	10	20	BDCD	
c1cc(CNCc2ccc3c(c2)CCO3)n[nH]1	41015640	GVIMLNRIQJKKLC-UHFFFAOYSA-N	229.283	1.634	10	20	BDCD	
C[C@H](CCO)CNCc1cc(F)ccc1O	226612578	KNSLVBRWMDSYDU-SECBINFHSA-N	227.279	1.639	10	20	BDCD	
CC(=O)C(=O)COc1cccc(C(F)(F)F)n1	289671318	PBJFYDJVMDMJMU-UHFFFAOYSA-N	247.172	1.637	10	20	BDCD	
CC(C)(O)C1CN(Cc2cc(F)ccc2O)C1	297524381	YOKIDHCGWCBTHO-UHFFFAOYSA-N	239.290	1.734	10	20	BDCD	
CC[C@H](NCCN)c1ccc(C)cc1O	817934282	FYROUMLXLOXEMT-NSHDSACASA-N	208.305	1.700	10	20	BDCD	
C[C@H](NCCCON)c1cc(F)ccc1O	902426119	QRGDUQKRLVVONB-QMMMGPOBSA-N	228.267	1.462	10	20	BDCD	
COCC1(C)CN(Cc2ccccc2O)C1	839145061	GRBBKVQMGCESKN-UHFFFAOYSA-N	221.300	1.861	10	20	BDCD	
Cc1ccc(C(=O)O[C@@H]2CCOC2)c(O)c1O	837483341	CWQOKNCUFAFUGN-MRVPVSSYSA-N	238.239	1.352	10	20	BDCD	
CC(C)[C@@H](C)NC(=O)CN(C)c1ccc(N)cc1	49308659	OIQCJFJARQWGQA-LLVKDONJSA-N	249.358	1.866	10	20	BDCD	
COc1ccc(CNCC2CC2)c(O)c1	40905612	OGPUILKGECLPDZ-UHFFFAOYSA-N	207.273	1.900	10	20	BDCD	
O=S(=O)(Nc1ccc(O)cc1)c1ccoc1	795276764	UORGWASDJGAXER-UHFFFAOYSA-N	239.252	1.786	10	20	BDCD	
C[C@H](N[C@H]1CCOC1)c1ccccc1O	87783053	SJLIJQFCALURPS-UWVGGRQHSA-N	207.273	1.832	10	20	BDCD	
CCOCCCNC(=O)Nc1ccc(N)cc1	35407964	VIMURWYVJDWKJB-UHFFFAOYSA-N	237.303	1.817	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C[C@H](C)O)c1	164504185	CPTHIUNDRQPSNZ-QWRGUYRKSA-N	223.316	1.950	10	20	BDCD	
CN(C)C(=O)[C@@H]1CCN(Cc2ccccc2O)C1	840958743	UKOFZNOOHIXRRG-GFCCVEGCSA-N	248.326	1.302	10	20	BDCD	
CO[C@@H](C)CNCc1c(C)cccc1O	877463451	DHDVNCIYUYZHOM-JTQLQIEISA-N	209.289	1.825	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)CCCO)c1	94942654	BSDFBTAKMCZZMQ-JTQLQIEISA-N	239.315	1.651	10	20	BDCD	
Cc1cccc(CNCc2cc[nH]n2)c1O	162826265	VYFXWEKFWQXNLB-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
C[C@@H](CO)CN[C@@H]1CCc2cccc(O)c21	295782696	AZVWVETYNIOKNZ-MWLCHTKSSA-N	221.300	1.598	10	20	BDCD	
CN(CC(=O)O)Cc1ccc(N(C)C)c(F)c1	820568769	CBWRMCIPSYVGTJ-UHFFFAOYSA-N	240.278	1.408	10	20	BDCD	
CCOc1cccc(CN[C@@H]2CCNC2)c1O	841045087	OFGVIADWYRCUCC-LLVKDONJSA-N	236.315	1.242	10	20	BDCD	
Cc1cccc(CN2C[C@H]3C[C@@]3(CO)C2)c1O	783744654	SXYJTZBFYABHGH-OCCSQVGLSA-N	233.311	1.515	10	20	BDCD	
CN(C)C(=O)NCc1ccc(N(C)C)cc1	31726414	ROTSCNGOIDDAMM-UHFFFAOYSA-N	221.304	1.524	10	20	BDCD	
C[C@@H]1CCN[C@@H]([C@H]2CCCC(=O)C2=O)C1	253174100	MKIWVDMMNRFFHU-OPRDCNLKSA-N	209.289	1.313	10	20	BDCD	
COc1cccc(CNCCCN(C)C)c1O	19958560	ISDAHFQBGBBKBH-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
CNC(=O)C[C@@H](C)NCc1ccc(N(C)C)cc1	299283226	DHAURQKSXVHDMI-LLVKDONJSA-N	249.358	1.367	10	20	BDCD	
COc1ccc(N(C)CC[S@](C)=O)cc1	844356737	WOTQECRFCWFGFI-HNNXBMFYSA-N	227.329	1.510	10	20	BDCD	
Oc1ccc(F)cc1CN1CC[C@H](O)C1	179935539	XZLVKRIVURVDPU-JTQLQIEISA-N	211.236	1.098	10	20	BDCD	
OCCN(Cc1cc(F)ccc1O)C1CC1	179932511	XMCSDVLBISKPAO-UHFFFAOYSA-N	225.263	1.488	10	20	BDCD	
CS(=O)(=O)Nc1cc(Cl)c(O)cc1F	170265989	WYKCPHLGGPYDPE-UHFFFAOYSA-N	239.655	1.556	10	20	BDCD	
CN(Cc1cncn1C)c1ccc2c(c1)OCO2	121411432	YBCOOTFAPLDGQB-UHFFFAOYSA-N	245.282	1.785	10	20	BDCD	
C[C@@H]1CN(C(=O)c2cccc(O)c2O)C[C@@H]1C	126471767	URBKVWXSEISMQM-DTORHVGOSA-N	235.283	1.826	10	20	BDCD	
CC[C@H](NC[C@@H](C)O)c1ccccc1O	35601759	GLPQHFJETHNBNS-KOLCDFICSA-N	209.289	1.814	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCOC1	136333722	DXKDMKYTFADMKJ-JTQLQIEISA-N	221.256	1.045	10	20	BDCD	
CCOc1cccc(CN2CC[C@H](O)C2)c1O	271117748	WTPPUTDCTZVLHR-NSHDSACASA-N	237.299	1.358	10	20	BDCD	
Cc1cccc(CN[C@@]2(C)CCOC2=O)c1O	290956151	RBUPQXKINQUVLI-ZDUSSCGKSA-N	235.283	1.496	10	20	BDCD	
O=C(O)[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)C1	849232112	QSHNWYKAVXDBSR-HAQNSBGRSA-N	247.294	1.574	10	20	BDCD	
CCCOCC(=O)NCc1cc(C)ccc1O	862758840	NPTPLABWRDTHAH-UHFFFAOYSA-N	237.299	1.743	10	20	BDCD	
C[C@@H](NCC[N+](=O)[O-])c1ccc(N(C)C)cc1	1119743375	JCNLCOZVSQFAFI-SNVBAGLBSA-N	237.303	1.680	10	20	BDCD	
C[C@@H](NC/C=C/CO)c1c(O)cccc1F	886636069	FSWKWNILDIJVJU-GKQMSVHHSA-N	225.263	1.730	10	20	BDCD	
Cc1cccc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)c1O	895781389	QYLBGAYKRJDHOT-YUTCNCBUSA-N	247.338	1.903	10	20	BDCD	
C[C@@H](CCNCc1ccccc1O)N(C)C	697884609	ATRVLMGKIVBHJJ-NSHDSACASA-N	222.332	1.822	10	20	BDCD	
CNC[C@@H](C)CNCc1cccc(OC)c1O	1327415263	JJINVHIBPHQJRX-SNVBAGLBSA-N	238.331	1.346	10	20	BDCD	
CC1(C)CCN1C(=O)NCc1ccc(N)cc1	1336291094	ZAMVAUGZIYXCAZ-UHFFFAOYSA-N	233.315	1.963	10	20	BDCD	
COc1ccc(CNC(=O)[C@@H]2C[C@H]2F)c(O)c1	1521550143	QXTCLVXABVDDNM-NXEZZACHSA-N	239.246	1.375	10	20	BDCD	
O=C(OCC1(C(=O)O)CC1)c1cc(O)cs1	1610879399	YWXCTOHKMWVGRH-UHFFFAOYSA-N	242.252	1.475	10	20	BDCD	
NCc1nccnc1NCCc1ccc(N)cc1	1580358764	WEYSZFCWYCVZFD-UHFFFAOYSA-N	243.314	1.172	10	20	BDCD	
Cc1ccc([C@H](C)NC[C@@H](C)O)c(O)c1	35601540	YPIMBHDITIXSNT-ZJUUUORDSA-N	209.289	1.732	10	20	BDCD	
Cc1cccc(CNCC23CC(CO2)C3)c1O	529662401	JVIXMCJOYHPGNU-UHFFFAOYSA-N	233.311	1.969	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@@H]2C[C@H]2C1	699172562	JUTQLVFGCSXLKO-BDAKNGLRSA-N	233.267	1.580	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H]3CCNC[C@@H]3C2)c1	904420630	CGAQKPCHBOWKGK-GXTWGEPZSA-N	246.354	1.742	10	20	BDCD	
CN(C(=O)CN=[N+]=[N-])C1CCSCC1	409435859	WXZLNCYHDPUPNF-UHFFFAOYSA-N	214.294	1.651	10	20	BDCD	
Cc1cc(NC(=O)c2cccc(O)c2O)n(C)n1	126220965	XLAJIFSMRRGFTJ-UHFFFAOYSA-N	247.254	1.392	10	20	BDCD	
CC(C)C[C@H](CO)NCc1ccccc1O	40773563	UEAXEJFRXDNORT-GFCCVEGCSA-N	223.316	1.889	10	20	BDCD	
O=C(CCn1cccn1)NCc1ccccc1O	133936326	YOBYKDJLYZQRSU-UHFFFAOYSA-N	245.282	1.295	10	20	BDCD	
C[C@H](NCCC(=O)O)c1cc(F)ccc1O	87111353	WYGILOZFVXPHBN-ZETCQYMHSA-N	227.235	1.657	10	20	BDCD	
CNCCCN(C)Cc1ccccc1O	87472211	FLNRNFVUANHHQJ-UHFFFAOYSA-N	208.305	1.434	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C(C)(C)O)c1	381255783	QSWYQOMRBVYSGA-JTQLQIEISA-N	223.316	1.950	10	20	BDCD	
CC[C@@H](C)CONC(=O)c1cccc(O)c1O	293675715	IYLYAOBSFZHROZ-MRVPVSSYSA-N	239.271	1.805	10	20	BDCD	
CC[C@H](NC[C@H](C)N)c1ccc(F)cc1O	817974172	ZXGLGKUJQDQNIF-KWQFWETISA-N	226.295	1.919	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCOC2)c1	827165857	BSEBPTNBIAVOGT-JTQLQIEISA-N	235.283	1.353	10	20	BDCD	
C[C@H]1C[C@@H]1C(=O)NCc1ccc(O)cc1O	910947811	NPMDRDDCTZBCSB-XVKPBYJWSA-N	221.256	1.370	10	20	BDCD	
COc1cccc(CN(C)[C@@H](C)CCO)c1O	846108571	BLAJYDWSRNXJHO-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
CC[C@@]1(O)CCN(C(=O)c2cc(O)cs2)C1	779506953	ZPUZLJKIOATLRR-LLVKDONJSA-N	241.312	1.441	10	20	BDCD	
COC(=O)C(C)(C)NCc1cc(C)ccc1O	71407682	SAWWPGMJOSUVBT-UHFFFAOYSA-N	237.299	1.742	10	20	BDCD	
COc1cccc(O)c1CN1CCO[C@H](C)C1	768231537	VTAIWLXNIMUJAH-SNVBAGLBSA-N	237.299	1.622	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2C=CCC2)cc1	698310484	WVERIBJBRUAODI-LBPRGKRZSA-N	216.284	1.646	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)[C@H](C)CN1	204098803	XDMVTEMFVWGPDO-WDEREUQCSA-N	219.332	1.451	10	20	BDCD	
COC[C@@H](CO)N[C@H](C)c1cc(F)ccc1O	234898688	WHBSTPBZUBAACS-PSASIEDQSA-N	243.278	1.189	10	20	BDCD	
C[C@@H](NCCO)c1ccc(N(C)C)cc1	37250490	QRESTVSSBZKUFF-SNVBAGLBSA-N	208.305	1.396	10	20	BDCD	
C[C@H]1NCCN(C(=O)Cc2ccc(N)cc2)[C@@H]1C	262804359	PVBNRNAVUQPWHH-GHMZBOCLSA-N	247.342	1.020	10	20	BDCD	
COc1ccc(N(C)CCCN)cc1OC	20239265	GCRWKPYEOZFOOD-UHFFFAOYSA-N	224.304	1.489	10	20	BDCD	
COC(=O)CN(C)Cc1cc(C)ccc1O	179396422	JOCGXOWEOLIMHA-UHFFFAOYSA-N	223.272	1.305	10	20	BDCD	
C[C@@H](O)CN[C@H](C)c1ccc(N(C)C)cc1	37257688	CZLVRXCMSXZNIW-GHMZBOCLSA-N	222.332	1.784	10	20	BDCD	
Nc1ccc(O[C@@H]2CCCC[C@@H]2O)cc1	38055881	JHMFYABGGPNZRG-NWDGAFQWSA-N	207.273	1.951	10	20	BDCD	
CC[C@H](C(=O)O)N(C)Cc1ccccc1O	83414712	CULVRXMFQQFEOZ-SNVBAGLBSA-N	223.272	1.687	10	20	BDCD	
CC[C@H](CO)N(C)Cc1cc(OC)ccc1O	295072621	HMQQSVVNLLFLGT-LLVKDONJSA-N	239.315	1.604	10	20	BDCD	
C[C@@H](NC1CNC1)c1ccc(N(C)C)cc1	817955524	XXLLXMBYNHQYOQ-SNVBAGLBSA-N	219.332	1.375	10	20	BDCD	
CCCN1CC(=O)N[C@H]1c1ccc(N(C)C)cc1	840822703	PICRPNWTFIVBLG-CQSZACIVSA-N	247.342	1.593	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1CSC1	718381328	YNQFTVAECDRFBV-UHFFFAOYSA-N	237.324	1.714	10	20	BDCD	
COC(=O)[C@H](N[C@H](C)c1ccccc1O)C1CC1	879649592	WYSNYYPVYGJVGW-NOZJJQNGSA-N	249.310	1.994	10	20	BDCD	
C[C@H](CN)NCc1ccc(N(C)C)cc1	162082978	KIPUAWUECVAZQO-SNVBAGLBSA-N	207.321	1.189	10	20	BDCD	
Cc1cccc(CN[C@H](C)CCCO)c1O	162871236	CNYMVTRAUMSNSG-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
CCC[C@H](N)C(=O)NCc1ccccc1O	163195264	JOIHVJVWIDTTDG-JTQLQIEISA-N	222.288	1.136	10	20	BDCD	
C[C@H](NC1CC1)C(=O)N(C)Cc1ccccc1O	296454123	OJCGOTAPTJKRMY-JTQLQIEISA-N	248.326	1.491	10	20	BDCD	
Oc1ccccc1CNCCO[C@@H]1CCOC1	724925775	VJWMLRXNSXRDAE-GFCCVEGCSA-N	237.299	1.287	10	20	BDCD	
CC[C@H](C(N)=O)N(C)Cc1ccccc1O	109770437	OLBXDVSSQBLNJF-SNVBAGLBSA-N	222.288	1.088	10	20	BDCD	
Nc1ccc(CN2CCCNCC2)cc1	58006714	MGVJHNZWZYPIGA-UHFFFAOYSA-N	205.305	1.064	10	20	BDCD	
CN(C(=O)C[C@H]1CCCO1)c1ccc(N)cc1	87205579	PFIKGDYIMDAEPF-GFCCVEGCSA-N	234.299	1.801	10	20	BDCD	
Cn1cc(NCc2cc([N+](=O)[O-])ccc2O)cn1	237797000	QTKZXCDGKMEYHN-UHFFFAOYSA-N	248.242	1.646	10	20	BDCD	
CNCCN[C@@H](C)c1c(C)cc(C)cc1O	817951891	KWIZQGOYILCVAH-NSHDSACASA-N	222.332	1.879	10	20	BDCD	
CO[C@H](C)CC(=O)N(C)c1ccc(N)cc1	877078526	SPMRSPNJAIKZKO-SECBINFHSA-N	222.288	1.657	10	20	BDCD	
CC(C)N(C)CC(=O)NCc1ccccc1O	748347413	ZKOVUHZEBYBTPV-UHFFFAOYSA-N	236.315	1.349	10	20	BDCD	
Oc1c(F)cccc1CNC[C@H]1CCCN1	841035760	LKUCVAMQCBCHAM-SNVBAGLBSA-N	224.279	1.373	10	20	BDCD	
CCC(CC)NC(=O)C(=O)Nc1ccc(N)cc1	840999890	NKBYLBHBTPGPCB-UHFFFAOYSA-N	249.314	1.512	10	20	BDCD	
OC[C@H](CCF)N[C@H]1CCc2cccc(O)c21	846210320	XZNCRZMAPNEVPG-QWRGUYRKSA-N	239.290	1.690	10	20	BDCD	
C[C@@H]1NCCN(Cc2cccc(F)c2O)[C@@H]1C	843057228	GXSVQLWCTJRGIF-VHSXEESVSA-N	238.306	1.714	10	20	BDCD	
Cc1cc(CN(C)[C@H]2CCNC2)ccc1N(C)C	923288566	XTLQIMBELRSTQA-AWEZNQCLSA-N	247.386	1.855	10	20	BDCD	
CCN(CCC(=O)NC)Cc1ccccc1O	897709337	AZLFPZLPUXKLPX-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
CN(CSc1nccs1)S(C)(=O)=O	270650032	LPGBXFNVVBYKMS-UHFFFAOYSA-N	238.359	1.084	10	20	BDCD	
C[C@H](O)C[C@@H](C)NCc1cc(F)cc(F)c1O	708483617	DZBYWRCILWDAHC-SFYZADRCSA-N	245.269	1.919	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1[C@H]2CCCO[C@H]21	780449533	COIMUKSBUQKVEN-RAIGVLPGSA-N	247.294	1.433	10	20	BDCD	
CCN(CC(=O)O)Cc1cccc(F)c1O	1596226354	VDHCRJBCKNJTQG-UHFFFAOYSA-N	227.235	1.438	10	20	BDCD	
COc1cccc(CNC(=O)C=C(C)C)c1O	154427516	SJKAKVSIYUZYEP-UHFFFAOYSA-N	235.283	1.983	10	20	BDCD	
CCn1ncc(CN(C)c2ccc(OC)cc2)n1	845998832	QTSCQVJWISXVTA-UHFFFAOYSA-N	246.314	1.943	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC[C@H](C)CO)c1	83216066	XZLJDFQLWLQPHY-WDEREUQCSA-N	223.316	1.980	10	20	BDCD	
CN1CC[C@H](NCc2cc(Cl)ccc2O)C1	42544496	QIGSEKBNJUVJMG-NSHDSACASA-N	240.734	1.839	10	20	BDCD	
Cc1cnc(C(=O)NCc2ccccc2O)cn1	133782271	WPAOQFSWPVMPPW-UHFFFAOYSA-N	243.266	1.421	10	20	BDCD	
CC(C)(F)C(=O)NCc1ccccc1O	379946030	JAYLAQOMQLFJKJ-UHFFFAOYSA-N	211.236	1.757	10	20	BDCD	
C[C@@H](O)CN[C@H](C)c1cc(F)cc(F)c1O	134899900	OCEFYCUWARQNOH-RNFRBKRXSA-N	231.242	1.702	10	20	BDCD	
CC(C)=CCNC(=O)c1cccc(O)c1O	191762410	TVIPWVWLTCLNMM-UHFFFAOYSA-N	221.256	1.794	10	20	BDCD	
COc1ccc(CNC[C@@H](C)CO)cc1C	88195387	JMIMDAZBEVMVEV-SNVBAGLBSA-N	223.316	1.722	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2C[C@]23CCNC3)cc1	376245056	OQIDGYIHSVUQHU-YPMHNXCESA-N	231.299	1.207	10	20	BDCD	
CC[C@H](NCc1c(O)cccc1OC)[C@@H](C)O	1325133330	PIVRNMDTXAPWHX-KOLCDFICSA-N	239.315	1.650	10	20	BDCD	
CC[C@@H](CCO)CNCc1ccccc1O	87362653	WRHXDLQILQVKQL-NSHDSACASA-N	223.316	1.890	10	20	BDCD	
CCN(CCOC)Cc1c(O)cccc1OC	768251376	CEZXOWUEELDWMS-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
Cc1ccc([C@@H](C)NC[C@@H](C)O)c(O)c1	35601539	YPIMBHDITIXSNT-NXEZZACHSA-N	209.289	1.732	10	20	BDCD	
CSC[C@H](O)CN[C@H](C)c1ccccc1O	309911880	NDGZLHOAFJPIJB-NXEZZACHSA-N	241.356	1.767	10	20	BDCD	
CCNC(=O)[C@@H](C)NCc1cccc(C)c1O	127869272	QHKIFUIRJYYHID-SNVBAGLBSA-N	236.315	1.315	10	20	BDCD	
CCN(Cc1cnnn1C)c1ccc(OC)cc1	289415115	VMOYTFPMUFMYTP-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](C)CO)cc1Cl	825319763	BGWYHPHSAJKIMS-QMMMGPOBSA-N	229.707	1.824	10	20	BDCD	
O=C1CC[C@@H]2[C@H]1[C@@H]2C(=O)NCc1ccccc1O	907054950	AAQVHYUYBDZOEL-OASPWFOLSA-N	245.278	1.234	10	20	BDCD	
CC[C@@H](C(=O)NCc1ccccc1O)[C@H](C)O	842230016	OXGFCCMLTQUKCC-GXSJLCMTSA-N	237.299	1.415	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(F)c2O)C[C@H]1N	843120517	OFSOFJLSDYRVOV-LDYMZIIASA-N	224.279	1.310	10	20	BDCD	
Oc1ccc(F)cc1CNC1CCNCC1	841026655	NQPCUZKSQHKSAY-UHFFFAOYSA-N	224.279	1.373	10	20	BDCD	
CC(=O)N1CC[C@@H](NCc2c(C)cccc2O)C1	877646565	JYOSWEROAJMCLT-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
CO[C@H]1CN(Cc2cccc(C)c2O)CCO1	895968196	JLVXSDAOQPGYRC-GFCCVEGCSA-N	237.299	1.505	10	20	BDCD	
Cc1ccc(CN[C@H]2C[C@@H](C(=O)O)C2)c(O)c1	1600417927	LVQKRYIJAFMSOG-PHIMTYICSA-N	235.283	1.653	10	20	BDCD	
CCn1ncc(CN(C)Cc2ccccc2O)n1	838800149	QSZWMPYBYBKOHA-UHFFFAOYSA-N	246.314	1.636	10	20	BDCD	
OCC(F)(F)CN[C@@H]1CCc2cccc(O)c21	296387342	JOOPAZHXBPZLBI-SECBINFHSA-N	243.253	1.597	10	20	BDCD	
CCO[C@@H]1C[C@H]1C(=O)NCc1ccccc1O	299571649	PLTPADOKQSHFJU-ZYHUDNBSSA-N	235.283	1.433	10	20	BDCD	
[N-]=[N+]=NCCN1CCC[C@]2(C[C@@H](O)CCO2)C1	409428592	GSWDXHIUAAGPCR-QWRGUYRKSA-N	240.307	1.303	10	20	BDCD	
CC(C)(C)C(=O)N1CC(Oc2ccc(N)cc2)C1	409423244	AYVQHKWRDHVSJX-UHFFFAOYSA-N	248.326	1.905	10	20	BDCD	
CC[C@H](CO)N[C@@H](C)c1ccc(F)cc1O	62745357	MEXJYXHXBGGISL-WCBMZHEXSA-N	227.279	1.953	10	20	BDCD	
CNC[C@H]1CCN(Cc2cc(C)ccc2O)C1	71409539	VVPNPEXDLMUKJW-GFCCVEGCSA-N	234.343	1.742	10	20	BDCD	
CNC(=O)CCN[C@H](C)c1ccc(N(C)C)cc1	44989745	ISQQOQJDFZHOQE-LLVKDONJSA-N	249.358	1.539	10	20	BDCD	
C[C@@H](CO)N[C@@H](C)c1cc(F)cc(F)c1O	134926183	IXANYTFAWCRUIM-BQBZGAKWSA-N	231.242	1.702	10	20	BDCD	
COCCOCCSc1nccs1	267527519	QFWZDCOVVKZMOK-UHFFFAOYSA-N	219.331	1.898	10	20	BDCD	
CN1CC[C@@H](Sc2nccs2)C1=O	265218940	RKNNBQDOSWZGRK-ZCFIWIBFSA-N	214.315	1.466	10	20	BDCD	
COCCNCCN[C@H](C)c1ccccc1O	817965746	ZQCVKABJQUCHKS-LLVKDONJSA-N	238.331	1.279	10	20	BDCD	
C[C@H](NCC1=CCNCC1)c1ccccc1O	817968716	WKXBEEHBMVVBSQ-NSHDSACASA-N	232.327	1.963	10	20	BDCD	
CC[C@@](C)(O)C(=O)N[C@H](C)c1ccccc1O	828538880	CTFHKLXNPOWURT-NOZJJQNGSA-N	237.299	1.730	10	20	BDCD	
CN(C)c1ccc(OCC[C@@H]2CCNC2=O)cc1	902359919	POUBJSHISZLWPC-NSHDSACASA-N	248.326	1.658	10	20	BDCD	
CC(C)(C)[C@H](CN)NCc1cc(F)ccc1O	841087887	SYIANBPSWHCXFF-LBPRGKRZSA-N	240.322	1.994	10	20	BDCD	
C[C@@H](N(C)C(=O)c1cc(O)cs1)C(C)(C)O	854762537	WHWMNMAJQHOUFO-SSDOTTSWSA-N	243.328	1.685	10	20	BDCD	
Cc1ccc(C(=O)N2C[C@@H]3C[C@H]3C2)c(O)c1O	862557781	ZOOZKIOYHCCYPQ-IUCAKERBSA-N	233.267	1.498	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2C[C@H]2C)c1	862761400	PXVHBTIXFMGEFZ-KOLCDFICSA-N	219.284	1.973	10	20	BDCD	
CC[C@H](N[C@@H]1CCCNC1=O)c1ccccc1O	50394197	QGFJNIYGQRQOOX-NWDGAFQWSA-N	248.326	1.712	10	20	BDCD	
Cn1ncc2c1CN(Cc1cc(F)ccc1O)C2	877633001	VKPSBONPIXALNQ-UHFFFAOYSA-N	247.273	1.781	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccsn1	705406363	GDIKFFUDMOLXLJ-UHFFFAOYSA-N	234.280	1.779	10	20	BDCD	
CCc1cccc(CNCCCO)c1O	691458110	AWIXLZMPKGDPAY-UHFFFAOYSA-N	209.289	1.427	10	20	BDCD	
C[C@@H]1CCN(CCNCc2ccccc2O)C1	692601764	FOZHECGSHDWEDD-GFCCVEGCSA-N	234.343	1.824	10	20	BDCD	
Nc1ccc(CN2CC[C@@H]3NCC[C@H]3C2)cc1	1336286509	QZZQPUFJFLKQLD-JSGCOSHPSA-N	231.343	1.453	10	20	BDCD	
CSCCNCc1cc(F)ccc1O	226582633	SSLKTNYTTDTHDT-UHFFFAOYSA-N	215.293	1.984	10	20	BDCD	
CC[C@@H]1OCC[C@H]1NC(=O)Cc1ccc(N)cc1	1578228747	GWIISZQYMAKLCI-OLZOCXBDSA-N	248.326	1.495	10	20	BDCD	
COc1cccc(O)c1CN[C@H](CO)C1CC1	883002225	AAMVEKBAUOWGQG-LLVKDONJSA-N	237.299	1.261	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@@H]1COCC[C@H]1O)CC2	710859855	JFSMXELLICTNTH-IJLUTSLNSA-N	249.310	1.119	10	20	BDCD	
CCOCC1CCN(C(=O)CN=[N+]=[N-])CC1	409425747	GSHOHLCTOKREEG-UHFFFAOYSA-N	226.280	1.572	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)C[C@H](C)O)c1	228086026	ZFMRZCCVIVUSTI-ZJUUUORDSA-N	239.315	1.650	10	20	BDCD	
N[C@H]1C[C@H](NCc2cc(F)ccc2O)C1	906518306	VPNCVFZGNCHZHI-MGCOHNPYSA-N	210.252	1.111	10	20	BDCD	
O=C1CCN(C(=O)c2cc(O)cs2)CC1	848377726	RPYCUYABZKIQJV-UHFFFAOYSA-N	225.269	1.259	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2C[C@]23CCCNC3)cc1	848393238	WADVVWJOSWXJOS-OCCSQVGLSA-N	245.326	1.597	10	20	BDCD	
CNC[C@@H]1CCCN1Cc1cccc(C)c1O	843055207	GTINOONIZKBDSM-ZDUSSCGKSA-N	234.343	1.884	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1CCCCN1	841032988	LJCDORZLEHISME-GFCCVEGCSA-N	238.306	1.763	10	20	BDCD	
COC(=O)/C=C(\C)CN(C)Cc1ccccc1O	929969858	FEEILKSVDCICMG-DHZHZOJOSA-N	249.310	1.943	10	20	BDCD	
CC1(NCc2cc(F)ccc2O)COC1	877691115	IYYCQOBXASILAP-UHFFFAOYSA-N	211.236	1.410	10	20	BDCD	
C[C@H]1[C@H](C)N(Cc2ccccc2O)CCN1C	775985864	PGZKXTOGCMQLMF-RYUDHWBXSA-N	234.343	1.917	10	20	BDCD	
OCCCCCNCc1ccccc1O	83345891	NXTXAHLQUYUSAL-UHFFFAOYSA-N	209.289	1.644	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@H]1O	897681470	VRPWTDDILCOTIQ-KCJUWKMLSA-N	241.718	1.858	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@H]2C[C@H](O)C2)c1	850579088	SMCBTWJNNKXQTI-GMTAPVOTSA-N	221.300	1.875	10	20	BDCD	
O=C(O)[C@H](CF)NCc1cc(F)ccc1O	1601651340	TYBDYALZCYYUBP-QMMMGPOBSA-N	231.198	1.044	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1CO[C@H](C)C1	877607925	OBFIIFDQGUOLJU-MNOVXSKESA-N	221.300	1.968	10	20	BDCD	
C[C@@H](NCc1ccc(N(C)C)cc1)C1CNC1	686220786	YWABALFTSQBXIR-LLVKDONJSA-N	233.359	1.450	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cncn1C	383603847	CBXJDOXAMHXHSO-UHFFFAOYSA-N	245.282	1.398	10	20	BDCD	
Cc1ccc(CNC[C@H](O)C(F)(F)F)c(O)c1	876965716	IUGPIJGFNFSJLY-JTQLQIEISA-N	249.232	1.713	10	20	BDCD	
CC[C@H]1CN(c2ccc(N)cc2)CC[C@@H]1O	409436078	XYLFIKIJRGJELC-GWCFXTLKSA-N	220.316	1.866	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCC[C@H]2O)cc1	323157999	HTGXDNJJPPVZQT-ZIAGYGMSSA-N	234.343	1.756	10	20	BDCD	
C[C@@H](NCC(F)(F)CO)c1ccccc1O	184699854	KDYHHEOWCGIOPK-MRVPVSSYSA-N	231.242	1.670	10	20	BDCD	
C/C=C/C(=O)N(C)Cc1ccccc1O	87333696	ZMHOBELPNJXJKF-ZZXKWVIFSA-N	205.257	1.927	10	20	BDCD	
COC(=O)CSc1ncc([N+](=O)[O-])s1	190301193	IRJBZPZSTIHVEC-UHFFFAOYSA-N	234.258	1.316	10	20	BDCD	
COC[C@@H](CO)N[C@@H](C)c1cc(C)ccc1O	234889316	PPNDVANZNWUBSY-WDEREUQCSA-N	239.315	1.359	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@H]1O	253232225	BBXURCOIUWHRRZ-SWLSCSKDSA-N	248.370	1.955	10	20	BDCD	
Nc1ccc(CN2C[C@@H]3[C@@H](C2)C3(F)F)cc1	715539270	MIEUFNPPMRYFFJ-GHMZBOCLSA-N	224.254	1.966	10	20	BDCD	
COCCCOc1ccccc1NC[C@H](C)O	819422382	VEKCRDWOCDKKTO-NSHDSACASA-N	239.315	1.895	10	20	BDCD	
Cc1ccc(O)c(CN(C)C2(CO)CC2)c1	827903493	ISWRYWNWQULLNP-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
CNC(=O)CCSc1ncc([N+](=O)[O-])s1	845705243	XRSCBBQJLNQIQO-UHFFFAOYSA-N	247.301	1.280	10	20	BDCD	
Cc1cc(O)c(CNC[C@H]2CCN2C)cc1C	922575137	CUBLETYWERQVHB-CYBMUJFWSA-N	234.343	1.803	10	20	BDCD	
Cc1ccc(CNC[C@@H](C)N(C)C)c(O)c1	877150629	XTPZXBVRLRRIPO-LLVKDONJSA-N	222.332	1.740	10	20	BDCD	
COc1ccc(CNc2cnccn2)c(O)c1	795288528	DBZBAKQTVVEXFQ-UHFFFAOYSA-N	231.255	1.803	10	20	BDCD	
C[C@@H]1C[C@H](NCc2ccc(N)cc2)CCN1	1246168550	FKPTUKBFTVHBBK-ZWNOBZJWSA-N	219.332	1.499	10	20	BDCD	
C[C@H](N)[C@H]1CCCN(Cc2ccc(N)cc2)C1	1334774812	OXZWRQCUCPYWFC-AAEUAGOBSA-N	233.359	1.828	10	20	BDCD	
CC1(C(=O)NCCc2ccc(O)c(O)c2)CC1	122095107	CASSNTZNJCSDAJ-UHFFFAOYSA-N	235.283	1.557	10	20	BDCD	
CC(C)OCC(=O)N[C@H](C)c1ccccc1O	827930962	WXIAOTGGCBZSSW-SNVBAGLBSA-N	237.299	1.994	10	20	BDCD	
CC[C@H](NCCCO)c1ccccc1O	20188187	UXMDTNUBKYZNRL-NSHDSACASA-N	209.289	1.815	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H]2CCCO2)c1	20092617	FUXWXLZIMYGGHR-LBPRGKRZSA-N	237.299	1.669	10	20	BDCD	
Cc1nc(NC(=O)c2ccc(C)c(O)c2O)n[nH]1	182377783	OGXCQUHNAAXELV-UHFFFAOYSA-N	248.242	1.085	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@@H]2CCCCN2)cc1	238115182	KKTXOXRPQYLPBB-ZDUSSCGKSA-N	247.342	1.070	10	20	BDCD	
C[C@H](CCO)NCc1ccc(N(C)C)cc1	96811529	OGKFCMMMGFYFLI-LLVKDONJSA-N	222.332	1.613	10	20	BDCD	
Cc1n[nH]c(CSc2nccs2)n1	291618311	IEPGJHOHMHWWMC-UHFFFAOYSA-N	212.303	1.862	10	20	BDCD	
COc1ccc(O)c(CN(CCO)C(C)C)c1	271793390	JPYQTMMTCWLLDG-UHFFFAOYSA-N	239.315	1.604	10	20	BDCD	
Cc1ccc(C(=O)NOCC2CC2)c(O)c1O	293793608	OXQOHVQOQYJGCW-UHFFFAOYSA-N	237.255	1.478	10	20	BDCD	
CCOC1CN(C(=O)c2cc(O)cs2)C1	832927137	PJYYPWQYGTYCSD-UHFFFAOYSA-N	227.285	1.315	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CC[C@H](CN)C2)c1	841085170	WBTPIRFYPQIGLQ-AAEUAGOBSA-N	234.343	1.918	10	20	BDCD	
CCOc1ccc(CN(C)C2CNC2)c(O)c1	843124972	SWZGQQQKXCJGGN-UHFFFAOYSA-N	236.315	1.195	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CCCNC2)c1	841042259	HQOPMCQRAFBVIG-LLVKDONJSA-N	236.315	1.242	10	20	BDCD	
CCNCCNCc1ccc(OCC)cc1O	841037696	SJQHFXWGNAHRRO-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
CN(Cc1ccccc1O)C1CC(O)C1	761222480	JJJSEXNXPHJFNH-UHFFFAOYSA-N	207.273	1.347	10	20	BDCD	
CCO[C@H](C)C(=O)N(C)c1ccc(N)cc1	877080479	JMIKUJHRKSLELF-SECBINFHSA-N	222.288	1.657	10	20	BDCD	
CN(CCCF)C(=O)c1c(F)ccc(O)c1O	899811414	KHMQQLZMXGYECZ-UHFFFAOYSA-N	245.225	1.669	10	20	BDCD	
C[C@@H]1COC[C@@H](C)N1Cc1ccc(N)cc1	91301841	HENXFLISWTXENK-GHMZBOCLSA-N	220.316	1.878	10	20	BDCD	
C[C@@H](O)CN1CCOc2cc(N(C)C)ccc21	194952192	HPFNYFMUHJKQAV-SNVBAGLBSA-N	236.315	1.332	10	20	BDCD	
CCCN(C)CC(=O)NCc1ccc(N)cc1	1356228822	VOJWKHGJYQQKIN-UHFFFAOYSA-N	235.331	1.227	10	20	BDCD	
COc1ccc(CNC(=O)[C@H]2C[C@@H]2F)c(O)c1	1521550144	QXTCLVXABVDDNM-UWVGGRQHSA-N	239.246	1.375	10	20	BDCD	
CC[C@@H]1COCCN1C(=O)Nc1ccc(N)cc1	36327614	NMAVTSGBSQGEHC-GFCCVEGCSA-N	249.314	1.912	10	20	BDCD	
OC[C@H](NCc1cc(F)ccc1O)C1CC1	309580578	QFZIMLMKUJXIER-NSHDSACASA-N	225.263	1.392	10	20	BDCD	
C[C@@H]1CCCCN1C(=O)CN1CC(N=[N+]=[N-])C1	409422091	AMMLYMALYKOUCX-SECBINFHSA-N	237.307	1.382	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@H](O)[C@H](CCF)C1	409429939	IAMFCAMDQYJCIS-BDAKNGLRSA-N	216.260	1.339	10	20	BDCD	
CN1CCN(Cc2ccc(N(C)C)cc2)CC1=O	127304010	LQOYDHYMGSJZAI-UHFFFAOYSA-N	247.342	1.027	10	20	BDCD	
CC1(O)CCN(Cc2cc(F)ccc2O)CC1	180165700	DTNCFPAZFDIYPR-UHFFFAOYSA-N	239.290	1.878	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H]3CNC[C@@H]3C2)c1	90320542	GDBKXUGGVFMKMQ-BETUJISGSA-N	232.327	1.352	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3CNC[C@H]3C2)c1O	775747940	PAXXTTJBRJZWOI-STQMWFEESA-N	232.327	1.352	10	20	BDCD	
CC1=NO[C@@H](CNCc2cc(C)ccc2O)C1	895308539	MRKCPXSVMOKDMK-GFCCVEGCSA-N	234.299	1.955	10	20	BDCD	
Cc1cccc(O)c1CNC1CC(C(=O)O)C1	1600543186	MVLXBHFHPGCWIU-UHFFFAOYSA-N	235.283	1.653	10	20	BDCD	
O=C(O)c1cnc(SCc2cnn[nH]2)s1	1602537656	ZNERLOSSPGNOFG-UHFFFAOYSA-N	242.285	1.252	10	20	BDCD	
CCNC(=O)[C@H](C)NCc1ccc(C)cc1O	877141572	AGVXUXTVNBZYSM-JTQLQIEISA-N	236.315	1.315	10	20	BDCD	
O=C(NC1CC(F)(F)C1)c1cccc(O)c1O	277665060	VPVSXLJPRHUXCZ-UHFFFAOYSA-N	243.209	1.625	10	20	BDCD	
COc1ccc(O)c(CNC2CCOCC2)c1	36308447	LDNRCMSDNJHKPL-UHFFFAOYSA-N	237.299	1.669	10	20	BDCD	
COC[C@@H](C)NCc1ccc(C)cc1O	83345899	JFVPBQSRTLPTTJ-SNVBAGLBSA-N	209.289	1.825	10	20	BDCD	
C/C=C(/C)C(=O)NCc1cc(OC)ccc1O	255834750	WZGVQKPFPJVLOR-WTKPLQERSA-N	235.283	1.983	10	20	BDCD	
O=C(NCC1CC1)c1c(F)ccc(O)c1O	276474435	DEPGMJMJDGTFAE-UHFFFAOYSA-N	225.219	1.377	10	20	BDCD	
CCN(CCO)Cc1ccc(N(C)C)c(C)c1	293139294	QGWMDFSZGGWAEK-UHFFFAOYSA-N	236.359	1.875	10	20	BDCD	
CCN(CC(=O)OC)C(=O)c1cc(O)cs1	826052374	DBWRLUZEISEQCJ-UHFFFAOYSA-N	243.284	1.089	10	20	BDCD	
C[C@H](NCC(C)(C)O)c1cc(F)ccc1O	87111427	VWXCAQPIOROPLD-QMMMGPOBSA-N	227.279	1.953	10	20	BDCD	
CCO[C@H]1C[C@@H]1C(=O)NCc1ccc(N)cc1	689957559	QVANATAMSBNORS-RYUDHWBXSA-N	234.299	1.310	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)C2(CO)CC2)c1	696064921	XSVHOHWKKJXLQT-LLVKDONJSA-N	235.327	1.951	10	20	BDCD	
CCONC(=O)NCc1cc(OC)ccc1O	163302714	RJEURMIWAVDBHE-UHFFFAOYSA-N	240.259	1.152	10	20	BDCD	
CC[C@]1(NC(=O)Nc2ccc(N)cc2)CCOC1	394090253	HFLDLFLNGDDWDZ-ZDUSSCGKSA-N	249.314	1.959	10	20	BDCD	
COc1cccc(CNC(=O)c2cc[nH]n2)c1O	105651621	KBKIIKSKFNIKDN-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
COC(=O)[C@@H]1CCCN1Cc1ccccc1O	179555432	WEYDOZLTJBTVCL-NSHDSACASA-N	235.283	1.530	10	20	BDCD	
O=C(NCc1ccccc1O)c1cnccn1	133783818	QQMIXELBSXXNCZ-UHFFFAOYSA-N	229.239	1.112	10	20	BDCD	
C[C@H]1C[C@H](N)CCN1Cc1cc(F)ccc1O	220334554	FZIMEWAYARIGJQ-JOYOIKCWSA-N	238.306	1.843	10	20	BDCD	
OCC1(NCc2ccc3c(c2)CCO3)CCC1	133141304	OMZVGIRUXORYLC-UHFFFAOYSA-N	233.311	1.626	10	20	BDCD	
CC(=O)C(=O)COc1ccc2ccc(=O)oc2c1	808011515	WYTAWTCHUJARSP-UHFFFAOYSA-N	246.218	1.330	10	20	BDCD	
C[C@H](NC/C=C/CO)c1ccc(N(C)C)cc1	717533751	YJTDVHJFSQIZPD-ITKZLYELSA-N	234.343	1.952	10	20	BDCD	
CCNCCCN[C@@H]1CCc2cccc(O)c21	817942555	AILIKWAMIUUYDT-GFCCVEGCSA-N	234.343	1.969	10	20	BDCD	
COC(=O)c1cnc(SCCF)s1	829678041	WTIMBAUJLXJZKN-UHFFFAOYSA-N	221.278	1.991	10	20	BDCD	
CO[C@@H](C)c1nc(Cc2ccc(N)cc2)no1	843159183	MBJYNFRVAJVIKU-QMMMGPOBSA-N	233.271	1.950	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)CN1CCC1=O	857228605	BMYLEDDRAHGACZ-UHFFFAOYSA-N	247.342	1.374	10	20	BDCD	
CCC(=O)COC(=O)c1cccc(O)c1O	758557924	LKLRAXKPVKSMLR-UHFFFAOYSA-N	224.212	1.234	10	20	BDCD	
CNC(=O)[C@H]1CCCCN1Cc1ccc(N)cc1	44412655	HNLIEAHBPDJHED-CYBMUJFWSA-N	247.342	1.369	10	20	BDCD	
N[C@@H](CO)c1ccc(N2CCCC2)cc1	72198025	JBVRFPVUUUJYTP-LBPRGKRZSA-N	206.289	1.279	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NC(=O)c1cccc(O)c1O	694373405	WSPWVGGEEXUHGH-SKDRFNHKSA-N	237.255	1.005	10	20	BDCD	
CNC[C@H](C)CNCc1cccc(Cl)c1O	1328677173	KQSVZHGVWRBQCB-VIFPVBQESA-N	242.750	1.991	10	20	BDCD	
C[C@H](O)CCNCc1ccc2c(c1)CCCO2	921744765	ZCHOOADAPJKWJC-NSHDSACASA-N	235.327	1.872	10	20	BDCD	
CNCCN(C)Cc1cc(F)c(F)cc1O	1578704180	OQNZRULONNIOHS-UHFFFAOYSA-N	230.258	1.322	10	20	BDCD	
CCNC(=O)[C@H](C)N[C@@H]1CCc2cccc(O)c21	295778199	ARVMKWNVMYQGMP-GXSJLCMTSA-N	248.326	1.494	10	20	BDCD	
C[C@H]1COC[C@H]1NCc1cc(F)cc(F)c1O	708534685	DDCHXPKUZGARAF-WRWORJQWSA-N	243.253	1.795	10	20	BDCD	
C[C@H](NCCN(C)C)c1ccccc1O	21962115	OWDXXRPQJUHHRT-JTQLQIEISA-N	208.305	1.604	10	20	BDCD	
Nc1ccc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1	127292687	PVHSAYBHOBRVNH-YUTCNCBUSA-N	232.327	1.472	10	20	BDCD	
C[C@H](O)CNCc1ccc2c(c1)CCO2	37363046	IUALAJFTRVNAJV-VIFPVBQESA-N	207.273	1.092	10	20	BDCD	
CNC[C@H]1CCCN(Cc2ccccc2O)C1	40592064	AGPZNXNIQVDWLB-GFCCVEGCSA-N	234.343	1.824	10	20	BDCD	
CC[C@H]1CN(Cc2ccccc2O)C[C@H]1O	272378025	HIESWTNHJVMHHW-GXFFZTMASA-N	221.300	1.595	10	20	BDCD	
C[C@H]1C[C@@H](O)CCN1Cc1ccccc1O	292686301	BAJYOUNHMYYOHO-JQWIXIFHSA-N	221.300	1.737	10	20	BDCD	
CC[C@@H]1C[C@H]1NC(=O)c1c(F)ccc(O)c1O	295138339	MBAZUCJCVKVWDK-HTRCEHHLSA-N	239.246	1.765	10	20	BDCD	
O=Cc1c[nH]c(C(=O)NCc2ccccc2O)c1	815833806	FEHLFDQCTDAKRP-UHFFFAOYSA-N	244.250	1.463	10	20	BDCD	
NC1CCN(Cc2cccc(Cl)c2O)CC1	843047756	ZVEAUJRRPGFPKS-UHFFFAOYSA-N	240.734	1.969	10	20	BDCD	
Cc1ccc(CN(C)CC(C)(C)O)c(O)c1	876736909	MRRXVNXANYSWSV-UHFFFAOYSA-N	223.316	1.903	10	20	BDCD	
COc1ccc(O)c(CNCCOCCF)c1	702645374	LBIYJJWVKGWNHZ-UHFFFAOYSA-N	243.278	1.477	10	20	BDCD	
CC[C@@H](C)N(C)C(=O)c1cccc(O)c1O	163270237	AZOXSJWNLUNKBN-MRVPVSSYSA-N	223.272	1.968	10	20	BDCD	
Cc1sc(NN)nc1-c1ccc(O)c(O)c1	4290830	AVQNPDXTQNUWMO-UHFFFAOYSA-N	237.284	1.815	10	20	BDCD	
CCc1cccc(CN[C@H]2C[C@@H](O)C2)c1O	848915532	XEZRYJMLCMSVSR-TXEJJXNPSA-N	221.300	1.568	10	20	BDCD	
C[C@@H](NCc1ncnn1C)c1ccccc1O	389336752	XQQBYVBHFHGSFV-SECBINFHSA-N	232.287	1.372	10	20	BDCD	
COC[C@]12CCC[C@H]1CN(C(=O)CN=[N+]=[N-])C2	409431721	KCZVZWBVKXXFME-GXSJLCMTSA-N	238.291	1.572	10	20	BDCD	
COc1ccc(O)c(CNCCCC(=O)O)c1	37417241	SBRVMTLJPFZYNL-UHFFFAOYSA-N	239.271	1.355	10	20	BDCD	
Nc1ccc(CN2CC[C@](F)(CO)C2)cc1	1120370956	KZGFZNGIBQTFBG-GFCCVEGCSA-N	224.279	1.175	10	20	BDCD	
CCNCCN[C@H](C)c1cc(OC)ccc1O	817951896	KXWSLDUBVBZABI-SNVBAGLBSA-N	238.331	1.661	10	20	BDCD	
O=S(=O)(NCc1ccccc1O)C1CCC1	717809336	BMGYWTWJWJIJBG-UHFFFAOYSA-N	241.312	1.364	10	20	BDCD	
C[C@H](CN(C)C(=O)c1cc(O)cs1)C(=O)O	736576340	XXODBIWVEVDZHU-ZCFIWIBFSA-N	243.284	1.246	10	20	BDCD	
Nc1ccc(CCN[C@H]2CCC[C@@H](N)C2)cc1	848714490	CACFCXXDWSPVOR-KGLIPLIRSA-N	233.359	1.671	10	20	BDCD	
CC1(CNC(=O)NCCc2ccc(N)cc2)CC1	841852306	YZHXVOPVPNYKCT-UHFFFAOYSA-N	247.342	1.911	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H]2CO)cc1	934014719	NZZMRLSJGGEPKB-ZDUSSCGKSA-N	220.316	1.319	10	20	BDCD	
COC(=O)C1(CNCc2ccc(N)cc2)CC1	1120269660	XRJDHOBWICVHJU-UHFFFAOYSA-N	234.299	1.312	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@](C)(CN)C2)cc1	386458308	SGDRVJALXNOZON-HNNXBMFYSA-N	247.386	1.923	10	20	BDCD	
CC[C@H](NCc1cc(F)cc(F)c1O)[C@@H](C)O	708535839	QVFBBKVLGHYADE-HQJQHLMTSA-N	245.269	1.919	10	20	BDCD	
CCOCC(=O)NCc1ccc(OC)cc1O	794369215	FIPOUNWVHMDCSI-UHFFFAOYSA-N	239.271	1.054	10	20	BDCD	
C[C@@H](NC(=O)COC(F)F)c1ccccc1O	1352251496	ARQLPZSEVQCLDM-SSDOTTSWSA-N	245.225	1.809	10	20	BDCD	
Cc1ccc(C(=O)NCc2ccc(O)c(O)c2)o1	159075608	DHHXILOYMIBYGP-UHFFFAOYSA-N	247.250	1.929	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H]2CCN2C)c1	712585345	FXJBYBMHLMNTFL-NSHDSACASA-N	236.315	1.195	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)CCN1	692161744	QPMROOJYOUYADP-OCCSQVGLSA-N	247.386	1.983	10	20	BDCD	
CNCCCC(=O)N[C@H](C)c1ccccc1O	870988219	JDYFVZJBFYRFFZ-SNVBAGLBSA-N	236.315	1.569	10	20	BDCD	
CCOC[C@H]1CN(C(=O)CN=[N+]=[N-])C[C@@H]1C	409434686	QDIJWWIBZYPPDV-DTWKUNHWSA-N	226.280	1.428	10	20	BDCD	
CN(C(=O)[C@@H]1CCCCO1)c1ccc(N)cc1	50958618	NAQAIONSBSXMQV-LBPRGKRZSA-N	234.299	1.801	10	20	BDCD	
CCCOCC(=O)NCc1ccc(O)c(O)c1	182543208	JMRLZEKGZRVOEI-UHFFFAOYSA-N	239.271	1.141	10	20	BDCD	
Cc1ccc(O)c(CNCCC[C@H](C)O)c1	227952039	NNIQNFQNPIBZAY-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
CC[C@@](C)(CO)NCc1cc(F)ccc1O	226619118	PLQSBDDYTAHZHJ-LBPRGKRZSA-N	227.279	1.782	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCO[C@@H]2C)c1	134245891	VFKZRPZJNYHXJG-ZYHUDNBSSA-N	221.300	1.968	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCCCN1	132520232	HBLZEVQKGCKQJD-LLVKDONJSA-N	234.299	1.151	10	20	BDCD	
CCN(CC(N)=O)c1ccc(OC)c(OC)c1	299285566	QGXNBYYQWJZGLZ-UHFFFAOYSA-N	238.287	1.015	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2N)cc1	294643779	BKNBPBCUFFCEJY-RBJBARPLSA-N	245.326	1.581	10	20	BDCD	
Cc1cc(Cl)cc([C@@H](C)NCCN)c1O	817937612	YKDMECOPRATMEY-MRVPVSSYSA-N	228.723	1.963	10	20	BDCD	
Cc1ccc(C(=O)N2CC[C@@H]3C[C@@H]3C2)c(O)c1O	856060693	ATORDSXQUUSHIJ-NXEZZACHSA-N	247.294	1.888	10	20	BDCD	
CO[C@@H](C)CNC(=O)c1cc(O)cs1	785427379	MVWYYVPXKNSHMY-LURJTMIESA-N	215.274	1.218	10	20	BDCD	
CN[C@@H](C)CCNCc1cccc(OC)c1O	1326076596	PSMPUNJNBWTYKK-JTQLQIEISA-N	238.331	1.488	10	20	BDCD	
CNCC1CCN(Cc2ccc(N)cc2)CC1	1336284960	FMGAVYPUWRHBLU-UHFFFAOYSA-N	233.359	1.700	10	20	BDCD	
C[C@@H](CN[C@H](C)c1c(O)cccc1F)C(=O)O	1589067338	JFHPWHRKFCAMCY-JGVFFNPUSA-N	241.262	1.903	10	20	BDCD	
Cc1nccnc1NCCc1ccc(O)c(O)c1	811811053	KSOWKGQHXJLHID-UHFFFAOYSA-N	245.282	1.851	10	20	BDCD	
C[C@H](CC(N)=O)N[C@@H]1CCc2cccc(O)c21	383581198	FLIXXCWEWWFSFX-PSASIEDQSA-N	234.299	1.233	10	20	BDCD	
COC[C@H]1CN(c2ccc(N)cc2)C[C@@H]1C	409433594	YOKRXZNNSLJWBG-WDEREUQCSA-N	220.316	1.988	10	20	BDCD	
CCN1CCN(Cc2ccc(N)cc2)C[C@@H]1C	110702246	FACSZJHFBODPJI-LBPRGKRZSA-N	233.359	1.795	10	20	BDCD	
COc1cccc(CNC(=O)[C@@H]2C[C@H]2C)c1O	68488615	YLAVUKZVOIRKRU-PSASIEDQSA-N	235.283	1.673	10	20	BDCD	
CO[C@H](C)CNC(=O)c1ccc(C)c(O)c1O	189627349	GWTBAPXSSPDDQQ-MRVPVSSYSA-N	239.271	1.171	10	20	BDCD	
C[C@@H](CO)N[C@H](C)c1ccc(N(C)C)cc1	37258357	BWVNROJIOMNVKB-WDEREUQCSA-N	222.332	1.784	10	20	BDCD	
COc1ccc(N(C)C[C@@H](C)O)c(OC)c1	49820093	WLILNYYFSQHNRN-SECBINFHSA-N	225.288	1.521	10	20	BDCD	
CO[C@H](C)CN(C)C(=O)c1cccc(O)c1O	286395368	MWAFFLWCIRCXTL-MRVPVSSYSA-N	239.271	1.205	10	20	BDCD	
O=C(O)[C@@H]1CCCN1Cc1cc(F)ccc1O	236433633	NVPRHXRPIHPKDL-JTQLQIEISA-N	239.246	1.580	10	20	BDCD	
COCCNCc1ccc(OC)cc1O	40905601	VSRDPJXPZCNEKJ-UHFFFAOYSA-N	211.261	1.137	10	20	BDCD	
CC[C@H](NCCN)c1ccc(N(C)C)cc1	817934249	DWIHTKAOLIIZTG-ZDUSSCGKSA-N	221.348	1.752	10	20	BDCD	
CCc1cccc(CN2CC[C@](C)(O)C2)c1O	848890284	RMSDREBCBMOGIO-AWEZNQCLSA-N	235.327	1.911	10	20	BDCD	
COCCC(=O)COC(=O)c1cc(O)cs1	761951348	ZCZGLQGIOIAULX-UHFFFAOYSA-N	244.268	1.216	10	20	BDCD	
CNC[C@H](C)CNCc1ccc2c(c1)CCO2	1118020720	XQOHDPGXWNUQDV-NSHDSACASA-N	234.343	1.567	10	20	BDCD	
OCC[C@H]1CCCN1Cc1cc(F)ccc1O	779201200	BQTYFDZAXVHLGZ-GFCCVEGCSA-N	239.290	1.878	10	20	BDCD	
CCN(CC)c1ccc(CN(C)CCN)cc1	777398715	OUAKEZVNSRUNLW-UHFFFAOYSA-N	235.375	1.923	10	20	BDCD	
O=C(O)C1CN(Cc2ccc(Cl)cc2O)C1	1606046149	DUUFYJGZEJVTAM-UHFFFAOYSA-N	241.674	1.562	10	20	BDCD	
CN(Cc1ccc(N)cc1)C1CC(N)C1	1334754198	LTEYCHQMTGMDNF-UHFFFAOYSA-N	205.305	1.190	10	20	BDCD	
Cc1cccc(CN[C@H](C)CCCN)c1O	841079494	JDHWTYDVHMJPCA-LLVKDONJSA-N	222.332	1.918	10	20	BDCD	
CC(C)[C@@H](O)CN[C@@H]1CCc2cccc(O)c21	297613964	IREDGLKZDKQTQM-YPMHNXCESA-N	235.327	1.986	10	20	BDCD	
CN(C(=O)C[C@@H]1CCOC1)c1ccc(N)cc1	401383225	PLHOQAFEYCSAIN-JTQLQIEISA-N	234.299	1.658	10	20	BDCD	
CC[C@@H](N)C(=O)NCc1ccc(N(C)C)cc1C	130534425	FMYWPQXZHIQXJN-CYBMUJFWSA-N	249.358	1.415	10	20	BDCD	
CCC[C@@H](NCc1cc(F)ccc1O)C(=O)O	233293725	RIPPYRFUEDGUPU-SNVBAGLBSA-N	241.262	1.874	10	20	BDCD	
CN(C)c1ccc(CN[C@@]2(C)CCOC2=O)cc1	289474289	HPYADGZSKCWPOS-AWEZNQCLSA-N	248.326	1.548	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)C(N)=O)cc1Cl	825716959	ZSTFDMXLCMRICR-SSDOTTSWSA-N	242.706	1.317	10	20	BDCD	
Nc1ccc(/C=C2/SC(=S)NC2=O)cn1	821022487	RMKQHDRXVHUSRT-ZZXKWVIFSA-N	237.309	1.153	10	20	BDCD	
CN(CC(=O)O)Cc1cccc(Cl)c1O	820569478	RPEDIHFXDXGLJV-UHFFFAOYSA-N	229.663	1.562	10	20	BDCD	
O=C(NCC1CCC1)c1cc(O)cs1	732271885	YBALNWUVZTZPEC-UHFFFAOYSA-N	211.286	1.984	10	20	BDCD	
O=C1CC[C@@H]2[C@H]1[C@H]2C(=O)NCc1ccccc1O	907054952	AAQVHYUYBDZOEL-WQAKAFBOSA-N	245.278	1.234	10	20	BDCD	
Cc1cccc(CNCCCON)c1O	904457784	SHQJYIVTNMUUGE-UHFFFAOYSA-N	210.277	1.071	10	20	BDCD	
NC1(CNCc2c(O)ccc(Cl)c2F)CC1	904443158	HSGPPSAVINPKBP-UHFFFAOYSA-N	244.697	1.766	10	20	BDCD	
CCN(CC)c1ccc(CN(C)C(=O)CN)cc1	844167191	UXBISSJPEALFGS-UHFFFAOYSA-N	249.358	1.450	10	20	BDCD	
C[C@@H](C[C@@H](C)N)NCc1cc(F)ccc1O	843127419	DGHDTVQYNBBWRQ-BDAKNGLRSA-N	226.295	1.747	10	20	BDCD	
O=C(OCc1ccno1)c1cccc(O)c1O	758546226	DVCBDVTTXKJCFY-UHFFFAOYSA-N	235.195	1.443	10	20	BDCD	
Nc1ccc(CN2C[C@@H]3CCC[C@H](N)[C@H]3C2)cc1	1337833998	JOIHHEALCWOPMG-QEJZJMRPSA-N	245.370	1.828	10	20	BDCD	
Cc1cccc(CNC[C@H](C)N(C)C)c1O	163729452	PHTIJEIQRXKHCP-NSHDSACASA-N	222.332	1.740	10	20	BDCD	
COC[C@@](C)(O)CNCc1cccc(C)c1O	382551132	HMJIGOARQUTUGC-ZDUSSCGKSA-N	239.315	1.188	10	20	BDCD	
CC1CCN(C(=O)CN2CC(N=[N+]=[N-])C2)CC1	409422327	CNWDHYXSIGZWSA-UHFFFAOYSA-N	237.307	1.239	10	20	BDCD	
CC(C)(CO)NCc1cc(Cl)ccc1O	20196587	QLIFVOSOHQTKRM-UHFFFAOYSA-N	229.707	1.906	10	20	BDCD	
COc1ccc(O)c(CNCCCCN)c1	37715231	WJNIHFAQJSCJET-UHFFFAOYSA-N	224.304	1.229	10	20	BDCD	
Oc1ccc(F)cc1CNCC1(O)CCC1	226609263	IBJNDUDSOVBKTK-UHFFFAOYSA-N	225.263	1.536	10	20	BDCD	
CCOc1ccc(N(C)Cc2n[nH]c(=O)[nH]2)cc1	92618799	LEYOAOJCXCPBKF-UHFFFAOYSA-N	248.286	1.133	10	20	BDCD	
C[C@@H](CCO)NCc1ccc(N(C)C)cc1	96811528	OGKFCMMMGFYFLI-NSHDSACASA-N	222.332	1.613	10	20	BDCD	
CCN(C)C(=O)CN[C@H]1CCc2cccc(O)c21	296418647	LIHCTINGXZOHQK-NSHDSACASA-N	248.326	1.447	10	20	BDCD	
CC(C)[C@H](C(=O)Nc1ccc(N)cc1)[C@H](C)N	818556217	BLRQSZJEEZVFFG-CABZTGNLSA-N	235.331	1.827	10	20	BDCD	
Cc1cccc(CN[C@H](C)CCN)c1O	841049746	GWNSUOGHENUFIM-SNVBAGLBSA-N	208.305	1.528	10	20	BDCD	
CN(C(=O)/C=C/c1cncc(F)c1)c1cn[nH]c1	754348773	FSYYRAFRIYASNF-NSCUHMNNSA-N	246.245	1.620	10	20	BDCD	
Cc1ccc(C(=O)NC2CC(C)C2)c(O)c1O	780963478	PZSDLDPVOZPZFT-UHFFFAOYSA-N	235.283	1.935	10	20	BDCD	
O=C(NCc1ccccc1O)[C@]1(F)CCOC1	1323142835	VYGDHQSNNOIXOY-LBPRGKRZSA-N	239.246	1.137	10	20	BDCD	
C[C@@H](C[C@@H](C)N)NCc1ccc(N)cc1	1336284932	DXKONDUVQGTBMB-ZJUUUORDSA-N	207.321	1.484	10	20	BDCD	
C[C@@H](NCc1ccc(N)cc1)[C@@H]1CCCNC1	1336285370	LHVQVLZPAQVWKW-DGCLKSJQSA-N	233.359	1.747	10	20	BDCD	
C[C@H](CCO)Sc1ncc([N+](=O)[O-])s1	226777894	BXTLIUTZWRIFQY-RXMQYKEDSA-N	234.302	1.914	10	20	BDCD	
CC[C@H](C(=O)Nc1ccc(N)cc1)N(C)C	62460933	AOKIZTRXJWOUFJ-LLVKDONJSA-N	221.304	1.548	10	20	BDCD	
C[C@H](N[C@H](C)c1nncn1C)c1ccccc1O	37017448	MVVIGOBWSNPIOU-VHSXEESVSA-N	246.314	1.933	10	20	BDCD	
C[C@@H](N[C@H](C)c1nncn1C)c1ccccc1O	37017449	MVVIGOBWSNPIOU-NXEZZACHSA-N	246.314	1.933	10	20	BDCD	
CC(C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1	183423064	OJTNCUWANQPWLY-SECBINFHSA-N	237.299	1.801	10	20	BDCD	
OC[C@@H](O)CSc1ncc(Cl)s1	379339027	VDZWZWBWPNMBBC-SCSAIBSYSA-N	225.722	1.242	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@](C)(C(=O)O)C2)c1	86779782	DALJZGSRBJFUQV-AWEZNQCLSA-N	249.310	1.997	10	20	BDCD	
C[C@H](O)[C@H]1CCCN(Cc2ccccc2O)C1	136822265	JDVONYTWGVEICU-RYUDHWBXSA-N	235.327	1.985	10	20	BDCD	
CC(=O)C(=O)Cn1ccnc1C(F)(F)F	919901224	PICWXXCBAYRGAY-UHFFFAOYSA-N	220.150	1.060	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](CN)C1CC1	841028251	NSBRQYUTODJVOT-HNNXBMFYSA-N	247.386	1.888	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCCNC2)c1	841043052	NLLIFEQHXKWEMN-LBPRGKRZSA-N	220.316	1.542	10	20	BDCD	
CN(C)c1ccc(CN(C)C2CCNCC2)cc1	843045961	MSUBNSJLGBFHKR-UHFFFAOYSA-N	247.386	1.936	10	20	BDCD	
CC[C@H](CO)Sc1ncc(C(=O)OC)s1	917777351	FFPCKHJQEJIURM-ZCFIWIBFSA-N	247.341	1.793	10	20	BDCD	
Cc1cc(O)c(CNC[C@H]2C[C@@H](O)C2)cc1C	858296160	KPLVYKLXKXOROV-BJHJDKERSA-N	235.327	1.870	10	20	BDCD	
CN[C@H](C)CCN[C@H]1CCc2cccc(O)c21	1118057218	BVRFYQBVIYTMPC-PWSUYJOCSA-N	234.343	1.967	10	20	BDCD	
Cc1ccc(CN2C[C@H](O)C[C@H]2C)c(O)c1	877468072	YCMCPUSIMCDOAG-ZYHUDNBSSA-N	221.300	1.656	10	20	BDCD	
C[C@H](O)c1cn(Cc2ccc(N(C)C)cc2)nn1	881272015	JBNOAOQIELZRNF-JTQLQIEISA-N	246.314	1.446	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@H]1C[C@@H]1F	1352304146	ZZRYTVXGKHZTAL-IUCAKERBSA-N	225.219	1.072	10	20	BDCD	
Oc1ccccc1CN1CCO[C@@H](CF)C1	840955298	UDWLSMNUDZHUPN-NSHDSACASA-N	225.263	1.563	10	20	BDCD	
C[C@]1(C(=O)NCc2ccc(N)cc2)CC1(F)F	817877612	UKNJQZTXTQYKCD-LLVKDONJSA-N	240.253	1.930	10	20	BDCD	
Nc1ccc(N2CC[C@H]3COC[C@H]3C2)cc1	409432406	VGPWAEKNWKIKCS-WDEREUQCSA-N	218.300	1.742	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)CC[C@H]1N	300417485	VKQVLPSAKUBEOS-JOYOIKCWSA-N	238.306	1.700	10	20	BDCD	
OC[C@H]1CCN(Cc2cccc(Cl)c2O)C1	132499437	AAZUEZRNNUAJGC-VIFPVBQESA-N	241.718	1.860	10	20	BDCD	
COc1cccc(O)c1CN[C@@H]1CCCNC1	841043054	NMWFCPACTATEMC-SNVBAGLBSA-N	236.315	1.242	10	20	BDCD	
CC(C)CC[C@H](N)C(=O)Nc1ccc(N)cc1	876504066	ITHRCOVQVQZMKI-LBPRGKRZSA-N	235.331	1.971	10	20	BDCD	
Cc1cccc(O)c1CN1CC(=O)N(C2CC2)C1	877486625	ORZHRZVPPVPLCL-UHFFFAOYSA-N	246.310	1.465	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](C)N[C@@H](C)C2)c1	70075570	CUGTXCUNGVNVJU-RYUDHWBXSA-N	234.343	1.883	10	20	BDCD	
C[C@@H]1C[C@@H](O)CN1Cc1cc(F)cc(F)c1O	894539841	XKDLVCKCFOPKHH-GMSGAONNSA-N	243.253	1.626	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCNCC1	82653144	NKCLDHQZGJNVKR-UHFFFAOYSA-N	233.359	1.466	10	20	BDCD	
Nc1ccc(N2CCN3C=CC[C@@H]3C2)cc1	514264390	COFRMFJWCPHYMJ-CYBMUJFWSA-N	215.300	1.677	10	20	BDCD	
OC[C@H]1C[C@H](NCc2cccc(Cl)c2O)C1	897357588	LBBSFZWOKANWNP-CZMCAQCFSA-N	241.718	1.906	10	20	BDCD	
CN(CC(=O)N1CCCCC1)c1ccc(N)cc1	20374593	ZGFZUZLWAJKBCQ-UHFFFAOYSA-N	247.342	1.718	10	20	BDCD	
C[C@@H](NS(C)(=O)=O)c1ccccc1O	867835023	QCZKMHGOKJRQNW-SSDOTTSWSA-N	215.274	1.002	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCCC(=O)O)c1	36891972	CSDUUGPAMMBPCS-MRVPVSSYSA-N	239.271	1.526	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NC1CC1	180881821	VJWISDLKZGQZQF-QHHAFSJGSA-N	219.240	1.390	10	20	BDCD	
Cc1ccc(O)c(CNCc2c[nH]cn2)c1	84080881	JDDIDKAGJFKQCY-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
C[C@H](N[C@H]1CCOC1)c1ccc(F)cc1O	87783774	GSDUQCYMOQLTPU-WPRPVWTQSA-N	225.263	1.971	10	20	BDCD	
CNC(=O)[C@@H](C)CN(C)Cc1ccc(N)cc1	234362269	PJZWDRICASVBNB-JTQLQIEISA-N	235.331	1.083	10	20	BDCD	
CC[C@H]1CN(Cc2cccc(C)c2O)C[C@@H]1O	272038305	ZRIADYVQSWNTBG-AAEUAGOBSA-N	235.327	1.903	10	20	BDCD	
C[C@H](CO)N(C)Cc1c(O)cccc1Cl	289394794	FNMMVDJSSVRNAC-MRVPVSSYSA-N	229.707	1.858	10	20	BDCD	
Cc1ccc(O)c(CN2CCNC[C@H]2C)c1	722393860	DQHOLLZBCKXPHX-LLVKDONJSA-N	220.316	1.494	10	20	BDCD	
CN1CCCc2cc(CNCC[N+](=O)[O-])ccc21	905077311	WVIAUTZCXVWTMO-UHFFFAOYSA-N	249.314	1.435	10	20	BDCD	
CC[C@H](N)CNCc1cccc(F)c1O	841071394	FTAHEMBXOHZEQD-VIFPVBQESA-N	212.268	1.358	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)CO	840935327	LYXJFGLDOBQEJE-NSHDSACASA-N	222.332	1.531	10	20	BDCD	
CC[C@H](N)CNCc1cccc(C)c1O	841071342	DJHNWRUUFDPJJT-NSHDSACASA-N	208.305	1.528	10	20	BDCD	
Cc1cccc(O)c1CN1CCC[C@@H](O)C1	876528375	WHCNWVDMYNRHMO-LLVKDONJSA-N	221.300	1.657	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H](O)C1	876561180	MCSLQLGITJZKFA-SNVBAGLBSA-N	207.273	1.267	10	20	BDCD	
CN(C(=O)[C@](C)(O)C1CCC1)c1ccc(N)cc1	1122174386	PCYQTXLSPYNRDY-CQSZACIVSA-N	248.326	1.783	10	20	BDCD	
COC[C@H](CCO)NCc1cc(C)ccc1O	219128096	IIUGZHSGRNGFHP-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
CC[C@H](C)[C@H](N)C(=O)NCCc1ccc(N)cc1	169816547	LOKCQGZNNVAHCR-GWCFXTLKSA-N	249.358	1.301	10	20	BDCD	
Cc1cccc(CNCCC(=O)O)c1O	165148473	DKTZXDGJBWZKQP-UHFFFAOYSA-N	209.245	1.265	10	20	BDCD	
O=C(Nc1cnns1)c1cccc(O)c1O	166373751	PSRGEIOIJPXEMX-UHFFFAOYSA-N	237.240	1.202	10	20	BDCD	
c1cc2c(cc1CN[C@@H]1CCNC1)CCO2	258868728	FYVWNPGPKAQOIN-GFCCVEGCSA-N	218.300	1.073	10	20	BDCD	
Oc1ccc(F)cc1CNCCc1cnccn1	389923295	GRDAWJSCVMPPSL-UHFFFAOYSA-N	247.273	1.654	10	20	BDCD	
Cc1ccc(O)c(CN2CCNC(C)(C)C2)c1	396061158	JYPLPAQJUJSJMP-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@H]2CCC[C@@]2(CO)C1	409426034	BUNABGWWLQANAR-ZJUUUORDSA-N	210.281	1.391	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@@H]2[C@@H](CCC2(F)F)C1	409426069	HLEPWQXJXGSQGM-NKWVEPMBSA-N	230.218	1.800	10	20	BDCD	
CC1(C)[C@@H](NCc2ccc3c(c2)CCO3)C[C@H]1O	129578665	ZCALMRZPUBUJTQ-UONOGXRCSA-N	247.338	1.871	10	20	BDCD	
CC(C)N(C)C(=O)/C=C/c1ccc(O)c(O)c1	180911373	MZFMZIDCNJROLO-FNORWQNLSA-N	235.283	1.978	10	20	BDCD	
COC(=O)CN(C)c1ccc(OC)c(F)c1	82713188	BEICRRSJGKCTEP-UHFFFAOYSA-N	227.235	1.444	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H]3CNC[C@@H]3C2)c1	90320618	RFQOEOYBWYALQB-VXGBXAGGSA-N	248.326	1.052	10	20	BDCD	
C[C@H](O)C(=O)NCc1ccc(N2CCCC2)cc1	276107042	UZCHFHGZRCNKSY-NSHDSACASA-N	248.326	1.284	10	20	BDCD	
Cc1cccc2c1N(C(=O)C1=CC[C@@H](N)C1)CC2	638287697	YXFZSOMGCBWSRT-CYBMUJFWSA-N	242.322	1.932	10	20	BDCD	
CO[C@H](C)CN(C)C(=O)c1cc(O)cs1	807755506	ORKMUGDMADNPDC-SSDOTTSWSA-N	229.301	1.561	10	20	BDCD	
C[C@H](CN)CN[C@H](C)c1cc(F)cc(F)c1O	817961662	BXTVQJUKHQXSBW-HTQZYQBOSA-N	244.285	1.916	10	20	BDCD	
CC[C@H](N[C@@H](C)CN)c1ccccc1O	817970116	LUGZHJJYHNTOLY-ONGXEEELSA-N	208.305	1.780	10	20	BDCD	
CNC[C@H](C)NCc1cc(OC)ccc1O	853248329	DEJHVWVLEKNSPH-VIFPVBQESA-N	224.304	1.098	10	20	BDCD	
CC[C@@H](CO)C(=O)N(C)Cc1ccccc1O	779645236	WMEUTDAUQWBZDH-JTQLQIEISA-N	237.299	1.369	10	20	BDCD	
CN(C)c1ccc(CN2C[C@H]3C[C@@]3(CO)C2)cc1	783740115	JDLWQTDMQBYNBL-HIFRSBDPSA-N	246.354	1.567	10	20	BDCD	
C[C@@]1(O)CCN(Cc2cc(F)cc(F)c2O)C1	1334350297	RWHBKUYTKYUIOY-GFCCVEGCSA-N	243.253	1.627	10	20	BDCD	
CO[C@@H]1CCN(C(=O)NCc2ccc(N)cc2)C1	1335737199	MBSRSQXCDAPVLG-GFCCVEGCSA-N	249.314	1.199	10	20	BDCD	
COc1cccc(O)c1CN(C)CC(C)(C)N	849350510	OUICDOZSAUVNDU-UHFFFAOYSA-N	238.331	1.570	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1CC[C@H](C(N)=O)C1	877574659	REZSSILBFQABBH-WDEREUQCSA-N	248.326	1.444	10	20	BDCD	
C[C@@H](NC(=O)C1(C)CNC1)c1ccccc1O	1335788318	KKIBXPOSCUJMGL-SECBINFHSA-N	234.299	1.179	10	20	BDCD	
COc1ccc(CN[C@H](C)CC(N)=O)cc1C	135729700	YVYUFTCSVKNZGX-SNVBAGLBSA-N	236.315	1.357	10	20	BDCD	
CN(C)c1ccc(CNCc2cnnn2C)cc1	135847945	WFJSHVBYUWAUCI-UHFFFAOYSA-N	245.330	1.171	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@@](C)(O)C2)c1	180634287	IOLBFYOOOUCRDW-CYBMUJFWSA-N	237.299	1.358	10	20	BDCD	
Oc1c(F)cc(Cl)cc1CN[C@H]1C[C@@H](O)C1	825257072	TVHSQSPMIVDEGL-DTORHVGOSA-N	245.681	1.798	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCO[C@@H](CF)C1	839803981	LLIFCYNBVJIIHP-QMMMGPOBSA-N	245.275	1.264	10	20	BDCD	
N=C(NCc1cc(Cl)ccc1O)N1CCC1	849049228	OSFBOSQGCWDDPQ-UHFFFAOYSA-N	239.706	1.776	10	20	BDCD	
Cc1ccc(C(=O)N[C@H]2C=CCC2)c(O)c1O	855429854	QETKSEMDHYSPPD-VIFPVBQESA-N	233.267	1.855	10	20	BDCD	
CCC1(C(=O)N(C)Cc2ccccc2O)COC1	755696515	YODLTHAWKUDTDC-UHFFFAOYSA-N	249.310	1.777	10	20	BDCD	
C/C=C\C(=O)NCc1cc(OC)ccc1O	769530477	CLGSEDSNCKNYSQ-ARJAWSKDSA-N	221.256	1.593	10	20	BDCD	
C[C@]1(C(=O)NCc2ccccc2O)CCCOC1	272973305	ZNKYBCFGNOLDCL-AWEZNQCLSA-N	249.310	1.825	10	20	BDCD	
C[C@H]1CNC[C@@H](C)N1Cc1ccc(N)cc1	1209885780	IXHWSROHGAWFHV-PHIMTYICSA-N	219.332	1.451	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2C[C@@H](O)C2)c1	720937688	WLKHEBILGAZMLB-KLPPZKSPSA-N	221.300	1.561	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCC[C@@H]1CO	1328105904	DXQIYQKGJUSOEJ-MRVPVSSYSA-N	241.312	1.441	10	20	BDCD	
Oc1ccc(F)cc1CN[C@H]1CCOC1	226617184	TYVYAMIOPLAGBC-JTQLQIEISA-N	211.236	1.410	10	20	BDCD	
CC[C@H](NCCN(C)OC)c1ccccc1O	850479159	MPCOOTDJIPKODI-LBPRGKRZSA-N	238.331	1.926	10	20	BDCD	
Cc1ccc(CN2C[C@@H]3CNC[C@@H]3C2)c(O)c1	876817505	IWENZNGTNGQQTM-BETUJISGSA-N	232.327	1.352	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCCN(C)C2=O)c1	707762964	QAFOQWGLUKTWJB-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
CN(C(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc(N)cc1	387086223	AGBAMSHGZSXLGS-JHJVBQTASA-N	246.310	1.799	10	20	BDCD	
C[C@H]1CCCCN1C(=O)CN1CC(N=[N+]=[N-])C1	409422092	AMMLYMALYKOUCX-VIFPVBQESA-N	237.307	1.382	10	20	BDCD	
COc1cccc(CN[C@H](C)C[C@H](C)O)c1O	228085227	FFGGOSLVOCDFME-ZJUUUORDSA-N	239.315	1.650	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)CCO1	22145278	KDMDLLJWRQXWLR-JTQLQIEISA-N	206.289	1.490	10	20	BDCD	
Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCO	20596944	HWDQENKAAFHSPS-UWVGGRQHSA-N	221.300	1.831	10	20	BDCD	
C[C@H](N[C@H](C)CO)c1ccc(N(C)C)cc1	37258355	BWVNROJIOMNVKB-MNOVXSKESA-N	222.332	1.784	10	20	BDCD	
CCN(CC)c1ccc([C@H](N)CO)c(O)c1	72198499	ACOCNCFXRPTYOC-LLVKDONJSA-N	224.304	1.231	10	20	BDCD	
C[C@H]1C[C@@H](N)CCN1Cc1cc(F)ccc1O	220334411	FZIMEWAYARIGJQ-CABZTGNLSA-N	238.306	1.843	10	20	BDCD	
COC[C@@H](O)CN[C@@H](C)c1cc(F)ccc1O	94618275	SEPVVXWBBRPPTM-WPRPVWTQSA-N	243.278	1.189	10	20	BDCD	
CCO[C@@H]1C[C@H]1C(=O)N(C)Cc1ccccc1O	298765966	ANKANIQZSAZICQ-DGCLKSJQSA-N	249.310	1.776	10	20	BDCD	
COC1(C)CN(Cc2cc(C)ccc2O)C1	839102638	QNAUEXQKBFWTDX-UHFFFAOYSA-N	221.300	1.921	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)[C@@H]1CCNC1	843049221	HJLGYMATNJHXTE-OAHLLOKOSA-N	247.386	1.855	10	20	BDCD	
Nc1ccc(CCNC[C@]23CNC[C@@H]2C3)cc1	853245988	FSZUGBMKQXACRR-GXTWGEPZSA-N	231.343	1.010	10	20	BDCD	
CCN(CCN)Cc1cc(Cl)cc(F)c1O	863644067	ISUOSQCHPZNFRI-UHFFFAOYSA-N	246.713	1.965	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1cocn1	778914787	LYYUEKFUBSZLOU-UHFFFAOYSA-N	234.211	1.016	10	20	BDCD	
CC[C@@H](F)C(=O)NCc1ccc(N)cc1	1122538208	BCYPXCAAESSLTF-SNVBAGLBSA-N	210.252	1.633	10	20	BDCD	
COc1cccc(O)c1CN1CCOCC1	31969696	XLZOHRCCUXIMKD-UHFFFAOYSA-N	223.272	1.233	10	20	BDCD	
COC(=O)N1CC(Oc2ccc(N)cc2)C1	396180934	GQZQLXWGVVEOTI-UHFFFAOYSA-N	222.244	1.098	10	20	BDCD	
CC[C@@H](C)[C@H](N)C(=O)NCc1ccc(N)cc1	169816521	RVLJXOCVKMIDBW-SKDRFNHKSA-N	235.331	1.258	10	20	BDCD	
C[C@@H](NCCCO)c1ccc(F)c(F)c1O	191181393	DSTRZXYIGOLRML-SSDOTTSWSA-N	231.242	1.703	10	20	BDCD	
COC(=O)[C@@H]1CC[C@H](NCc2ccccc2O)C1	792197603	ZBIUMUBHKAQFHO-PWSUYJOCSA-N	249.310	1.824	10	20	BDCD	
CCc1cccc(CN[C@@H]2CCC[C@H]2O)c1O	691435445	FAAGHVYTPPYKSN-CHWSQXEVSA-N	235.327	1.958	10	20	BDCD	
CC(C)C(=O)NCCNCc1ccccc1O	20125193	SCLUBPWNHUSPCO-UHFFFAOYSA-N	236.315	1.254	10	20	BDCD	
COCCn1cc(COc2ccc(N)cc2)nn1	864625788	RJSBQIDQGDCDEK-UHFFFAOYSA-N	248.286	1.086	10	20	BDCD	
Cc1cccc(O)c1CNCCn1ccnc1	876891596	BUXYAORGUGBYAB-UHFFFAOYSA-N	231.299	1.687	10	20	BDCD	
C[C@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)CO1	402046781	NPQYFUKFVYJNDL-GZMMTYOYSA-N	235.287	1.568	10	20	BDCD	
CN(C)c1ccc(CN(C)C2[C@@H]3CNC[C@@H]23)cc1	1578425591	HAMGXSMPIYAUFH-ZIAGYGMSSA-N	245.370	1.402	10	20	BDCD	
[N-]=[N+]=NCC(=O)N(CC1CC1)C1CCOCC1	409429962	IAOLANBXDSHLGU-UHFFFAOYSA-N	238.291	1.714	10	20	BDCD	
COC[C@]12CCC[C@@H]1CN(C(=O)CN=[N+]=[N-])C2	409431724	KCZVZWBVKXXFME-MWLCHTKSSA-N	238.291	1.572	10	20	BDCD	
COC[C@H](C)NC(=S)NCc1cccn1C	231647855	MVNGCUUZFPXLSZ-VIFPVBQESA-N	241.360	1.024	10	20	BDCD	
COc1cccc(CN2CCO[C@@H](C)C2)c1O	131952308	JKARMGCLPXXGNV-JTQLQIEISA-N	237.299	1.622	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@@H]1O	190057234	BBXURCOIUWHRRZ-DOMZBBRYSA-N	248.370	1.955	10	20	BDCD	
CC[C@@H](NCCNC)c1ccc(F)cc1O	817953273	YHGLUSDNJWNEQV-LLVKDONJSA-N	226.295	1.791	10	20	BDCD	
C[C@@H](CN)N[C@H](C)c1cc(F)ccc1O	817970049	KHDXHVNKKFDADO-JGVFFNPUSA-N	212.268	1.529	10	20	BDCD	
Cc1cc(CC(=O)NCc2ccccc2O)no1	735858368	ZUZLMTVWTBXODI-UHFFFAOYSA-N	246.266	1.548	10	20	BDCD	
CC(C)NC(=O)COC(=O)c1cc(O)cs1	731910602	TZGGFTMCGKILQZ-UHFFFAOYSA-N	243.284	1.135	10	20	BDCD	
CN(C)c1ccc(CNC[C@H](O)C2CC2)cc1	71277938	GCBODMMHKCNRQU-AWEZNQCLSA-N	234.343	1.613	10	20	BDCD	
C/C=C/[C@@H](O)C(=O)NCc1ccc(N(C)C)cc1	899982883	LGZIVXLNJXGSMY-MUBLQREKSA-N	248.326	1.306	10	20	BDCD	
COCC(C)(C)NCc1ccccc1O	66995979	ZJTWGWHZDBDHTR-UHFFFAOYSA-N	209.289	1.907	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@H]1C[C@@H]1C1CC1	1347542457	MQTQBPVXBLUCAO-MNOVXSKESA-N	247.294	1.760	10	20	BDCD	
C[C@H]1C[C@H]1C(=O)NCc1cccc(O)c1O	1521852481	WLWAGZLJOJPOKK-IONNQARKSA-N	221.256	1.370	10	20	BDCD	
CC[C@@H](CO)Sc1ncc(C(=O)O)s1	1605048104	ZMTPPEYLUGNNKT-YFKPBYRVSA-N	233.314	1.704	10	20	BDCD	
O=C(O)[C@@H]1CCC[C@H]1NCc1ccccc1O	1601810907	XDMAMEUYUMKPRR-GHMZBOCLSA-N	235.283	1.735	10	20	BDCD	
O=C(O)C1CC(NCc2c(O)cccc2F)C1	1594900234	MNVFOJYHRRLYOJ-UHFFFAOYSA-N	239.246	1.484	10	20	BDCD	
O=C(O)CCNCc1cc(Cl)c(F)cc1O	1595060834	BMCIFFXCEWHBSD-UHFFFAOYSA-N	247.653	1.749	10	20	BDCD	
COc1ccc(N(C)C[C@@H]2CCNC2)cc1F	258854555	IEPBHUDWOLWMGH-SNVBAGLBSA-N	238.306	1.880	10	20	BDCD	
OC[C@@H](CC1CC1)NCc1ccccc1O	309560739	JEEQCYZKOAQYOJ-GFCCVEGCSA-N	221.300	1.643	10	20	BDCD	
Cn1cnc(CNCc2cc(F)ccc2O)c1	898044703	ANKGUABEHYBVQM-UHFFFAOYSA-N	235.262	1.555	10	20	BDCD	
CCNC(=O)CNCc1cc(Cl)ccc1O	36780451	WSALTRDLOGOZGE-UHFFFAOYSA-N	242.706	1.271	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@@H]2CC[C@H]2O)c1	378731505	LDPTXKMFSKMGMB-UFGOTCBOSA-N	221.300	1.875	10	20	BDCD	
CNC[C@@H]1CCCN1C(=O)Cc1ccc(N)cc1	161192520	NELWLMKIBGMYRN-ZDUSSCGKSA-N	247.342	1.022	10	20	BDCD	
COCC[C@H](CO)NCc1cc(C)ccc1O	282355736	VVLPNMGWAJNMNJ-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
Cc1ccc(C(=O)N[C@@H](C)CF)c(O)c1O	291949135	NYJLSKZZXYCHGZ-ZETCQYMHSA-N	227.235	1.494	10	20	BDCD	
Cc1ccc(C(=O)N[C@H](C)CF)c(O)c1O	291949132	NYJLSKZZXYCHGZ-SSDOTTSWSA-N	227.235	1.494	10	20	BDCD	
Oc1cccc2c1[C@H](NCC[C@H]1CCNC1)CC2	817954818	KUFBECSPYBDVDQ-DGCLKSJQSA-N	246.354	1.969	10	20	BDCD	
CN(CCCC(=O)O)C(=O)c1cc(O)cs1	737433338	NJSVAWNRJUDSJC-UHFFFAOYSA-N	243.284	1.391	10	20	BDCD	
C/C=C/C[C@H](CO)NC(=O)Nc1ccc(N)cc1	841296481	TYDMDWDAYMWRKU-QAVQXKDTSA-N	249.314	1.717	10	20	BDCD	
C[C@@H](O)[C@H](N)c1cc(Cl)ccc1O	95672765	KCZAICOPPILPEW-ANLVUFKYSA-N	201.653	1.426	10	20	BDCD	
C[C@@](O)(CNCc1ccccc1O)C(F)(F)F	270483084	JSLHQUMCOXJQTH-SNVBAGLBSA-N	249.232	1.795	10	20	BDCD	
C[C@H](N[C@H](C)C[S@](C)=O)c1ccccc1O	164490325	LAYSUMWEBRFCOO-KCWFYHRYSA-N	241.356	1.810	10	20	BDCD	
Oc1c(F)cccc1CNC1CCOCC1	165151604	GNRAZUOJEVTVAO-UHFFFAOYSA-N	225.263	1.800	10	20	BDCD	
Cn1cccc1C(=O)NCc1ccc(O)c(O)c1	159008559	VWUFYHRNAZDDEI-UHFFFAOYSA-N	246.266	1.366	10	20	BDCD	
COc1cccc(CN[C@@H]2CO[C@H](C)C2)c1O	402031063	ILITWIHOKCJPOM-KOLCDFICSA-N	237.299	1.668	10	20	BDCD	
Cc1cccc(CNC[C@H]2CC[C@@H](O)C2)c1O	187987391	BVFAMUXVBMKLCW-WCQYABFASA-N	235.327	1.951	10	20	BDCD	
C[C@@H](N)CN(C)Cc1cc(F)ccc1O	380114025	SRBCADYTAUYQGC-MRVPVSSYSA-N	212.268	1.310	10	20	BDCD	
CCOc1cccc(CN[C@H](C)C(=O)O)c1O	49353450	IIEIBOBKOVBFON-MRVPVSSYSA-N	239.271	1.354	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)C[C@H]1CO	191718327	QAUVOJDQDHTZCI-PWSUYJOCSA-N	221.300	1.452	10	20	BDCD	
Cc1ccc(O)c(CNC2CSC2)c1	701972353	HZSXEOASUYZYGW-UHFFFAOYSA-N	209.314	1.906	10	20	BDCD	
O=C(NC1(CO)CCCC1)c1cc(O)cs1	831250235	UQTDXZVLBQUKTP-UHFFFAOYSA-N	241.312	1.489	10	20	BDCD	
CC(C)C(=O)COC(=O)c1cccc(O)c1O	758557278	AQUSWFCREFWQCH-UHFFFAOYSA-N	238.239	1.480	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H]([C@H](C)O)C1	877184003	JYSGMWKGCRDJID-RYUDHWBXSA-N	235.327	1.903	10	20	BDCD	
C[C@H](O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1	775407794	WMPJOGAOFVULFD-UWVGGRQHSA-N	236.315	1.311	10	20	BDCD	
Cc1cccc(O)c1CN1CCC[C@@H]1C(N)=O	877568814	BRDFSWXZSRUEAC-LLVKDONJSA-N	234.299	1.150	10	20	BDCD	
CC[C@@H](NCc1cccc(C)c1O)[C@H](C)O	386737652	XHQXRQRBRPRZTQ-CMPLNLGQSA-N	223.316	1.950	10	20	BDCD	
C[C@@H](O)CCCN(C)Cc1ccccc1O	789347171	DYFFXEKKYGJEKV-LLVKDONJSA-N	223.316	1.985	10	20	BDCD	
CNC[C@@H]1CCN(Cc2ccc(N)cc2)C1	1335285588	QEQFPBBKSBBCGL-LBPRGKRZSA-N	219.332	1.310	10	20	BDCD	
COCC(=O)CSc1nccs1	231698589	ZPEOFQNETXINHX-UHFFFAOYSA-N	203.288	1.451	10	20	BDCD	
CNCCCC(=O)NCc1ccccc1O	162970279	HUUBZUJWBOWGSE-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
COc1ccc(N(C)Cc2nncn2C)cc1	844353552	XZEFWXVXLXHBAS-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
CON(C)CCN[C@@H](C)c1ccccc1O	850478632	DTBWSYNXGWRMKT-JTQLQIEISA-N	224.304	1.536	10	20	BDCD	
c1cc2c(cc1CNCC1OCCCO1)CCO2	716369880	DFDRLBLKEGPRAC-UHFFFAOYSA-N	249.310	1.474	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2CCOC2)c1	70955250	QHRVJIXAJCZALB-NSHDSACASA-N	221.300	1.827	10	20	BDCD	
O[C@@H]1CCC[C@H]1NCc1ccc2c(c1)CCO2	323277181	KLIUJYPIDSNRAX-CHWSQXEVSA-N	233.311	1.625	10	20	BDCD	
CCOC[C@@H](C)NCc1cc(OC)ccc1O	44690562	LKLRNRVPMMIZBX-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
CN(Cc1ccnn1C)c1ccc2c(c1)OCO2	91076348	HKHZEIZRNZAHHZ-UHFFFAOYSA-N	245.282	1.785	10	20	BDCD	
C[C@@H](O)CN(C)Cc1ccc(N(C)C)c(F)c1	291105755	SAKXSUDSCYASGQ-SNVBAGLBSA-N	240.322	1.704	10	20	BDCD	
CN1CC[C@H]1CNCc1cc(F)ccc1O	712554863	DGBMPTOLTCHSKK-NSHDSACASA-N	224.279	1.325	10	20	BDCD	
CCC[C@@](C)(O)CNC(=O)c1cc(O)cs1	748323027	UOYPRDZTACGMML-LLVKDONJSA-N	243.328	1.735	10	20	BDCD	
C[C@H](CN)CNCc1cc(Cl)cc(F)c1O	841050201	ZRIDKBJJUJGVJY-SSDOTTSWSA-N	246.713	1.869	10	20	BDCD	
Nc1ccc(NC(=O)N[C@@H]2CCC[C@@H]2CO)cc1	841297606	HHVNQJATODADPB-BXKDBHETSA-N	249.314	1.551	10	20	BDCD	
CN(CC[C@H]1CCNC1)c1ccc(N)cc1	863558594	ONOPUSVSLMACIZ-LLVKDONJSA-N	219.332	1.705	10	20	BDCD	
COc1cccc(CN(C)C2CC(O)C2)c1O	761223326	PIVMRKDBGSZRPY-UHFFFAOYSA-N	237.299	1.356	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)N2CC[C@@H](O)C2)o1	1537962506	LOWHKULJRKPJMW-SSDOTTSWSA-N	236.231	1.297	10	20	BDCD	
C[C@H](CC(=O)O)NCc1cc(F)cc(F)c1O	1332012840	NABOTDZFQPSEMX-ZCFIWIBFSA-N	245.225	1.623	10	20	BDCD	
Oc1ccc(F)cc1CN1CCO[C@H](CF)C1	840955750	YOVQOIQLSBYYLX-LLVKDONJSA-N	243.253	1.702	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@@H](CN)C1	843048500	CNJYAOGHLAIKCU-JTQLQIEISA-N	236.315	1.181	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](O)C1)c1ccc(N(C)C)cc1	850581726	YJZIETOCHFVXQO-MPKXVKKWSA-N	234.343	1.927	10	20	BDCD	
Oc1ccc(CCNc2ncccn2)cc1O	301506432	CWLFNDAGRRTFCG-UHFFFAOYSA-N	231.255	1.542	10	20	BDCD	
COc1cccc(O)c1CN[C@@H]1C[C@H]2CC[C@@H]1O2	846073882	SKTILCVJWPJCQR-UDZFHETQSA-N	249.310	1.810	10	20	BDCD	
Nc1ccc(CN2CCC[C@H]2CCO)cc1	304518115	GSXHOCYOBCPKRU-ZDUSSCGKSA-N	220.316	1.616	10	20	BDCD	
COC(=O)[C@@H]1CN(Cc2ccccc2O)C[C@H]1C	280224409	JJOJBSOLKFNQQY-ZYHUDNBSSA-N	249.310	1.633	10	20	BDCD	
Cc1cccc2c1N(C(=O)C1=CC[C@H](N)C1)CC2	638287699	YXFZSOMGCBWSRT-ZDUSSCGKSA-N	242.322	1.932	10	20	BDCD	
COc1cccc(CN2CC3(CCOC3)C2)c1O	293909906	FYEFUUKRIRLUPO-UHFFFAOYSA-N	249.310	1.623	10	20	BDCD	
CC[C@](C)(O)Cc1cn(-c2ccc(N)cc2)nn1	849134257	ABDBSFVNVCRLJS-ZDUSSCGKSA-N	246.314	1.553	10	20	BDCD	
C[C@@H](N[C@H](CO)CCF)c1cc(F)ccc1O	846208310	IGFCZLBSEFVSLV-SCZZXKLOSA-N	245.269	1.902	10	20	BDCD	
OC[C@H](CCF)NCc1ccccc1O	846098165	ZZVQXVAMNANIMR-JTQLQIEISA-N	213.252	1.202	10	20	BDCD	
COC[C@@H](NC(=O)c1cc(O)cs1)C1CC1	750539778	VDOVGGQDEQECND-SECBINFHSA-N	241.312	1.609	10	20	BDCD	
COc1cccc(O)c1CN(C)C1CC1	768335261	KWLRXKZYSAVRKH-UHFFFAOYSA-N	207.273	1.995	10	20	BDCD	
Cc1ccc(CN2CC[C@H](CO)C2)c(O)c1	876659835	HISFNTPZNJYKRH-NSHDSACASA-N	221.300	1.515	10	20	BDCD	
CC[C@H](NCc1ccccc1O)[C@H](C)O	395372181	VAVRPNFYCPEUKL-ONGXEEELSA-N	209.289	1.641	10	20	BDCD	
C[C@@H](O)CNCc1cc(F)cc(F)c1O	708387213	ARWUQNTXKHTQHA-ZCFIWIBFSA-N	217.215	1.141	10	20	BDCD	
O=Cc1ccc(O)c(O)c1C(F)(F)F	39096450	TXWRCLYQXNTTSW-UHFFFAOYSA-N	206.119	1.929	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H]2C[C@@H]2F)cc1	1263063231	PPYKCVZKBOTWTH-MNOVXSKESA-N	222.263	1.286	10	20	BDCD	
CCONC(=O)N(C)Cc1ccccc1O	166440592	KEJLTXCVYIWVAA-UHFFFAOYSA-N	224.260	1.485	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](O)C1)c1cc(F)ccc1O	850578284	IYUCEQYNSRSHPF-HGNGGELXSA-N	225.263	1.705	10	20	BDCD	
CON(C)C(=O)c1ccc(C)c(O)c1O	177659240	ZGEOTKUSYRZPPO-UHFFFAOYSA-N	211.217	1.040	10	20	BDCD	
CCOc1cccc(CNCCCCN)c1O	37714813	PFNPCJHKASJPAX-UHFFFAOYSA-N	238.331	1.619	10	20	BDCD	
O=C(NCc1ccccc1O)c1cncs1	225107544	HOMBCKPXXOWPIY-UHFFFAOYSA-N	234.280	1.779	10	20	BDCD	
CC(=O)N1CCCN(Cc2ccc(N)cc2)CC1	42614087	JCZGBZJKHYQMRT-UHFFFAOYSA-N	247.342	1.323	10	20	BDCD	
O=C(C[C@H]1CCCN1)NCc1ccccc1O	228420328	WANQFANORAWMID-LLVKDONJSA-N	234.299	1.151	10	20	BDCD	
CN(CCCN)Cc1ccc(N(C)C)cc1	84934201	WFXFYGOBKIKTSQ-UHFFFAOYSA-N	221.348	1.533	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](C)NC[C@@H]2C)c1	86467021	PRPHOYXHQQRYFY-NEPJUHHUSA-N	234.343	1.883	10	20	BDCD	
Cc1cccc(CN2C[C@@H](O)C(C)(C)C2)c1O	280452562	LJJSUQYJCXZHGC-GFCCVEGCSA-N	235.327	1.903	10	20	BDCD	
CCOc1cccc(CN(C)[C@H](C)CO)c1O	289386201	DFJISQKCNJBOGQ-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
C[C@H](CN)N[C@@H]1CCc2cccc(O)c21	817966088	GFAGOWMBBNIUMJ-PSASIEDQSA-N	206.289	1.316	10	20	BDCD	
COC(=O)C1(C)CN(Cc2cccc(C)c2O)C1	822534352	DDPSNKLBPBARKK-UHFFFAOYSA-N	249.310	1.696	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CCCNCC2)cc1	846662824	YGKDUIITLMRWAM-SNVBAGLBSA-N	233.315	1.597	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)NCCCF)c1	858304461	BDVLXIGAHZUQDK-UHFFFAOYSA-N	240.278	1.859	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](CO)C1)c1c(O)cccc1F	927142261	BITZESXYLVYLSK-GUBZILKMSA-N	239.290	1.953	10	20	BDCD	
C[C@H](O)CCc1cn(-c2ccc(N)cc2)nn1	864620519	QQKBWUYRYJMPQL-VIFPVBQESA-N	232.287	1.163	10	20	BDCD	
Nc1ccc(CNC2(c3ncon3)CC2)cc1	1580445473	FXMXOZSEJNPWMX-UHFFFAOYSA-N	230.271	1.431	10	20	BDCD	
O=C(Nc1cn[nH]c1)c1cccc(O)c1O	163271097	UJLJHSWWCAMNQQ-UHFFFAOYSA-N	219.200	1.073	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@H](C)CN	843052292	SHOOHMOFDFWMAL-SECBINFHSA-N	224.304	1.180	10	20	BDCD	
CC[C@@](C)(O)CNCc1c(C)cccc1O	876915670	XKWAVBSTOSJRIX-CYBMUJFWSA-N	223.316	1.951	10	20	BDCD	
C[C@]1(CO)CCCN1Cc1ccc(N)cc1	722979156	BSZJXZHKYRYKKK-CYBMUJFWSA-N	220.316	1.616	10	20	BDCD	
C[C@@H](NC[C@]1(O)CCOC1)c1ccccc1O	183629658	JOQGPRGPCPOCSW-ZWNOBZJWSA-N	237.299	1.194	10	20	BDCD	
Cc1c[nH]nc1C(=O)NCc1ccccc1O	379939754	WZCLQXCTPZAUNZ-UHFFFAOYSA-N	231.255	1.354	10	20	BDCD	
COc1cccc(CNC(=O)C(F)F)c1O	194775210	WYAMNESNRMOPEV-UHFFFAOYSA-N	231.198	1.282	10	20	BDCD	
COC[C@@H](CO)NCc1cc(C)c(C)cc1O	279628655	BOGGMAUCHGWPBU-GFCCVEGCSA-N	239.315	1.106	10	20	BDCD	
CCCONC(=O)NCc1ccccc1O	828262899	DTPUEXHLAFHDGL-UHFFFAOYSA-N	224.260	1.533	10	20	BDCD	
C/C=C\C[C@H](CO)NC(=O)Nc1ccc(N)cc1	841296484	TYDMDWDAYMWRKU-ZZKXABKFSA-N	249.314	1.717	10	20	BDCD	
C[C@@H]1C[C@@H](CN)CN1Cc1cccc(F)c1O	843058048	NZRRFYRTVYDVOW-ZJUUUORDSA-N	238.306	1.700	10	20	BDCD	
O=C(OCCOC1CC1)c1cc(O)cs1	922440366	RGLDHTHVXRAKCL-UHFFFAOYSA-N	228.269	1.790	10	20	BDCD	
CN(C)c1ccc(CN2CCCNC(=O)C2)cc1	769108155	LOSXVFQMVZJLJO-UHFFFAOYSA-N	247.342	1.075	10	20	BDCD	
C/C=C/C(=O)N[C@H](C)Cc1ccc(O)c(O)c1	773740169	AGNRDPXMSRUDGT-CDAZIORVSA-N	235.283	1.721	10	20	BDCD	
CO[C@H]1C[C@H](NCc2cc(F)ccc2O)C1	706498622	JTLMXRHDDTWNHC-XYPYZODXSA-N	225.263	1.798	10	20	BDCD	
Cc1ccc(CN[C@@H]2CC[C@H](C(N)=O)C2)c(O)c1	877574794	VUOBQGSNYFZIQZ-CMPLNLGQSA-N	248.326	1.444	10	20	BDCD	
C[C@H](O)[C@@H](C)NCCCSc1nccs1	1327976842	AOTJTOWCOATBFE-BDAKNGLRSA-N	246.401	1.984	10	20	BDCD	
NOCCCNCc1ccc(N2CCCC2)cc1	1262488018	NEQVFKRAWRLJAU-UHFFFAOYSA-N	249.358	1.657	10	20	BDCD	
C[C@H](NCCC(=O)O)c1c(O)cccc1F	1603248018	SDRGYWGDSPUBRN-ZETCQYMHSA-N	227.235	1.657	10	20	BDCD	
O=C(O)[C@H]1CC[C@H](NCc2ccccc2O)C1	1601795570	CNSNRDZZSMMXHG-ONGXEEELSA-N	235.283	1.735	10	20	BDCD	
CN1CC[C@H](N[C@@H]2CCc3cccc(O)c32)C1	380211688	HYELYVPSKVIFFA-NWDGAFQWSA-N	232.327	1.673	10	20	BDCD	
O=C(O)C1CCN(Cc2ccccc2O)CC1	4673003	XWYXZFZGKYUWRQ-UHFFFAOYSA-N	235.283	1.689	10	20	BDCD	
[N-]=[N+]=NCCN1CCN([C@@H]2CCSC2)CC1	409429995	PSTFECXCVICWFP-SNVBAGLBSA-N	241.364	1.420	10	20	BDCD	
C[C@@H](CO)NCc1ccc2c(c1)CCO2	37363050	ZPBWOKDMTZENQZ-VIFPVBQESA-N	207.273	1.092	10	20	BDCD	
CCOC(=O)CN(C)Cc1ccccc1O	119529357	SCCWMGQWIKXWMO-UHFFFAOYSA-N	223.272	1.387	10	20	BDCD	
OC[C@H](O)CSc1ncc(Cl)s1	379339026	VDZWZWBWPNMBBC-BYPYZUCNSA-N	225.722	1.242	10	20	BDCD	
CC[C@@](C)(CO)NCc1cc(C)ccc1O	70898938	YQARMFVPMKLKHF-ZDUSSCGKSA-N	223.316	1.951	10	20	BDCD	
CC[C@H]1CN(Cc2cccc(C)c2O)C[C@H]1O	272038312	ZRIADYVQSWNTBG-WCQYABFASA-N	235.327	1.903	10	20	BDCD	
C[C@@H]1C[C@@H](NCCc2ccc(N)cc2)[C@@H](C)O1	817956795	DBVJPFMIXBEELH-JTNHKYCSSA-N	234.343	1.967	10	20	BDCD	
O=C(O)CCNCc1cc(Cl)cc(F)c1O	821525210	LMHVWFVVLZEESG-UHFFFAOYSA-N	247.653	1.749	10	20	BDCD	
O=C(NC[C@@H]1CCCO1)c1cc(O)cs1	731863892	JBWIPYNQSVFCJG-QMMMGPOBSA-N	227.285	1.363	10	20	BDCD	
Nc1ccc(CCNC(=O)CC2(N)CCC2)cc1	832659105	MHSXJTHSZOYNEH-UHFFFAOYSA-N	247.342	1.199	10	20	BDCD	
CN(Cc1cc(Cl)cc(F)c1O)C1CNC1	843124898	OWQCVUKEBMTSRF-UHFFFAOYSA-N	244.697	1.588	10	20	BDCD	
Oc1c(F)cccc1CNC[C@@H]1CCCCN1	841033625	YCOUPOSMSUHCTF-NSHDSACASA-N	238.306	1.763	10	20	BDCD	
Cc1ccc(O)c(CN2CCc3n[nH]cc3C2)c1	857878178	UNVCFHASCVVUNX-UHFFFAOYSA-N	243.310	1.982	10	20	BDCD	
CC[C@H]1CC[C@H](C(=O)NCc2ccc(N)cc2)O1	1343566068	DJOBKXRHCOYTQO-QWHCGFSZSA-N	248.326	1.843	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1C[C@H](C)[C@@H](O)C1	897680119	PIGUGQQMCIHYCD-WFASDCNBSA-N	248.370	1.874	10	20	BDCD	
C[C@H](N)[C@@H](C)C(=O)Nc1ccc(N)cc1	294873982	CQOFXJYUUJXALP-SFYZADRCSA-N	207.277	1.191	10	20	BDCD	
COc1ccc(O)c(CNCc2cocn2)c1	182239710	BVHCKBNFAHBVJP-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
O=C(C[C@@H]1CCOC1)NCc1ccccc1O	401379427	NXOXUUAKQQNFPN-JTQLQIEISA-N	235.283	1.435	10	20	BDCD	
Oc1ccc(F)cc1CN1CCC[C@H](O)C1	179871529	JKORSLQFZOMKQX-NSHDSACASA-N	225.263	1.488	10	20	BDCD	
COc1ccc(CNCC(F)(F)CO)cc1C	231777509	OWGHELZHSITWPS-UHFFFAOYSA-N	245.269	1.721	10	20	BDCD	
C[C@H](CF)NCc1cccc(F)c1O	290254435	VZSROHQUXYXCQN-SSDOTTSWSA-N	201.216	1.979	10	20	BDCD	
CCN[C@H](C)c1cc(C(=O)OC)ccc1O	273412758	QAVOVMQYQHJRCN-MRVPVSSYSA-N	223.272	1.849	10	20	BDCD	
CCC[C@@H](OC)C(=O)NCc1ccccc1O	294792847	DJUDTVSXPSEQPL-GFCCVEGCSA-N	237.299	1.824	10	20	BDCD	
Cc1ccc(CN2CCC[C@H](C(N)=O)C2)c(O)c1	876511312	DRDIPKPRSFGEAH-LBPRGKRZSA-N	248.326	1.398	10	20	BDCD	
Cc1cccc(O)c1CN1CCc2c[nH]nc2C1	876760923	SLWHVUPIFVZFJT-UHFFFAOYSA-N	243.310	1.982	10	20	BDCD	
C[C@H](NCC1(CO)CC1)c1c(O)cccc1F	886534231	DKNGXRAOYWRCJF-VIFPVBQESA-N	239.290	1.954	10	20	BDCD	
C[C@@H]1CN(C)C(=O)CN1Cc1ccccc1O	783733205	KVNGLAXAURUBQU-SNVBAGLBSA-N	234.299	1.055	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)C[C@@H]1O	897684465	PPMTWQJDBJEWHT-CABZTGNLSA-N	207.273	1.205	10	20	BDCD	
CCN(C[C@@H](C)O)c1ccc(OC)cc1	799129836	XECITRNCWLUTDC-SNVBAGLBSA-N	209.289	1.902	10	20	BDCD	
O=C(NC[C@H]1CCOC1)c1cc(O)cs1	1333805717	OIZDFIIIJVERCQ-SSDOTTSWSA-N	227.285	1.220	10	20	BDCD	
CC1(NC(=O)Nc2ccc(N)cc2)CC1	228883153	VWJMBMHJVVFOSL-UHFFFAOYSA-N	205.261	1.943	10	20	BDCD	
Cc1cc(CNCc2cc(F)ccc2O)n(C)n1	284383756	ONZGDHSXLAXBLF-UHFFFAOYSA-N	249.289	1.863	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccncc2F)C1	409423893	QZLRUZRIVPJKCE-UHFFFAOYSA-N	221.195	1.355	10	20	BDCD	
COc1ccc(N(CC(N)=O)C(C)C)cc1F	60356754	DRDVFEASVAXSFR-UHFFFAOYSA-N	240.278	1.534	10	20	BDCD	
CNC[C@@H]1CCN(Cc2ccccc2O)C1	70798650	KONNOAONTYZBHQ-NSHDSACASA-N	220.316	1.434	10	20	BDCD	
CC(C)[C@H](N)C(=O)N(C)Cc1ccccc1O	37823737	UFHNDKUQXBQRKJ-LBPRGKRZSA-N	236.315	1.334	10	20	BDCD	
C[C@@]1(O)CCCN(Cc2cc(F)ccc2O)C1	180185825	PLQIKNHCYYPJTE-CYBMUJFWSA-N	239.290	1.878	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CC[C@H]2O)cc1	378671324	KFENYAJECBLODM-CHWSQXEVSA-N	220.316	1.366	10	20	BDCD	
C[C@H](CCO)CNCc1ccccc1O	85126588	GSUKVNRPUJPEKI-SNVBAGLBSA-N	209.289	1.500	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCOC1	136333681	DXKDMKYTFADMKJ-SNVBAGLBSA-N	221.256	1.045	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccco1	82277727	RJAFWXBCNHWQBW-UHFFFAOYSA-N	217.224	1.915	10	20	BDCD	
COCCNC(=O)c1ccc(CN=[N+]=[N-])o1	1537963040	QIWUREGECMWGKB-UHFFFAOYSA-N	224.220	1.466	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@@H]1CC1(F)F	296464520	JPEXPAJOBRROCI-ZETCQYMHSA-N	243.209	1.369	10	20	BDCD	
CN(C)c1ccc(CNCC[N+](=O)[O-])cc1F	905076331	OOBOGHDRDKNYOM-UHFFFAOYSA-N	241.266	1.258	10	20	BDCD	
CNC(=S)NCc1ccc(N(C)C)cc1C	734386819	VLGXZDVOGVXPPE-UHFFFAOYSA-N	237.372	1.655	10	20	BDCD	
NC[C@H](NCc1cccc(F)c1O)C1CC1	841028562	PPROGUBVWFANLW-NSHDSACASA-N	224.279	1.358	10	20	BDCD	
COCC(=O)NCc1cc(Cl)ccc1O	846479280	JPEGTVCJEOKIDG-UHFFFAOYSA-N	229.663	1.308	10	20	BDCD	
CN(CCN)Cc1cc(Cl)cc(F)c1O	841101659	ZGDHMPVRGUUOFW-UHFFFAOYSA-N	232.686	1.575	10	20	BDCD	
CC(C)COC(=O)c1cccc(O)c1O	758560577	MVUFEIDLSJSEDO-UHFFFAOYSA-N	210.229	1.911	10	20	BDCD	
COCCN(CCO)Cc1c(C)cccc1O	876683893	YZYBCATXRHSAEN-UHFFFAOYSA-N	239.315	1.141	10	20	BDCD	
Cc1ccc(CN2C[C@H](O)C(C)(C)C2)c(O)c1	877486865	SJFSGBFRSLZZJH-ZDUSSCGKSA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(O)c(CN2CC(=O)N(C)C[C@@H]2C)c1	783733184	KLBPXCHXPPUHGY-NSHDSACASA-N	248.326	1.363	10	20	BDCD	
CCc1cccc(CN[C@@H](C)CO)c1O	709418469	SKNWSMKEPAOYLI-VIFPVBQESA-N	209.289	1.425	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCCO1	80130058	OPJGYPPCNFDOKB-LBPRGKRZSA-N	235.283	1.530	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)[C@H](C)CN1C	775987311	VKSQXHBMKHJWEF-NWDGAFQWSA-N	234.343	1.917	10	20	BDCD	
CC[C@@H](NCc1ccc(Cl)cc1O)C(=O)O	1593607542	JBBRGQFRKWKOPJ-SECBINFHSA-N	243.690	1.998	10	20	BDCD	
Cc1ccc(CN(C)CCC(N)=O)c(O)c1	877520673	FAWKVYWFWBISLB-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
COc1ccc(CNCc2cnnn2C)cc1C	267530009	RRNYVQYJGRHOLT-UHFFFAOYSA-N	246.314	1.422	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC[C@@H]1CF	294247150	XVMDNTRXHYHTLJ-MRVPVSSYSA-N	239.246	1.672	10	20	BDCD	
CC[C@H](N[C@H](C)c1ccccc1O)C(=O)OC	305450818	LQAHRUFDDCFUKX-KOLCDFICSA-N	237.299	1.994	10	20	BDCD	
Cc1ccc(C(=O)NCc2ccc[nH]2)c(O)c1O	182523010	UIOUMKVUXZIXTN-UHFFFAOYSA-N	246.266	1.664	10	20	BDCD	
NC[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1	237857035	ILWQDIZEBVXFOC-GFCCVEGCSA-N	247.342	1.009	10	20	BDCD	
C[C@H](CO)CN[C@H](C)c1cc(F)ccc1O	87111425	IJJORDKEBAVHLH-DTWKUNHWSA-N	227.279	1.810	10	20	BDCD	
Cc1cccc(CN2CCC(O)CC2)c1O	132485266	CFWFZFQXFWDJLS-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
Cc1ccc(O)c(CN(C)CC[C@@H](C)O)c1	93481761	QTEUIZAKAGSRBO-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
CCNC(=O)CCCC(=O)Nc1ccc(N)cc1	236880516	UYOAVTJLBRONEU-UHFFFAOYSA-N	249.314	1.514	10	20	BDCD	
Cc1cc(O)c(CNC[C@@H](N)C2CC2)cc1C	841049578	LRIZUUYOYLKBDS-CYBMUJFWSA-N	234.343	1.836	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCCN1	854427710	IYLOPRXWZDEPFE-UHFFFAOYSA-N	212.274	1.194	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H]([C@H](C)O)C1	877184002	JYSGMWKGCRDJID-NWDGAFQWSA-N	235.327	1.903	10	20	BDCD	
C[C@H]1CN(C)C(=O)CN1Cc1ccccc1O	783733204	KVNGLAXAURUBQU-JTQLQIEISA-N	234.299	1.055	10	20	BDCD	
CC[C@@](C)(O)CNCc1cc(OC)ccc1O	87011390	FKJUNFJDTYVJOW-CYBMUJFWSA-N	239.315	1.651	10	20	BDCD	
Nc1ccc(N2CC[C@@H]3COC[C@H]3C2)cc1	409432402	VGPWAEKNWKIKCS-GHMZBOCLSA-N	218.300	1.742	10	20	BDCD	
Oc1ccccc1CN1CCN(CC2CC2)CC1	179559754	GXNBZTJMXNZZKU-UHFFFAOYSA-N	246.354	1.920	10	20	BDCD	
C/C=C/C[C@H](CO)NCc1ccccc1O	185818621	AZZTZHCQGAJKSE-QAVQXKDTSA-N	221.300	1.809	10	20	BDCD	
CNCCCC(=O)N(C)Cc1ccccc1O	37823781	JPBDLTOBAJDHFV-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
CCN(CC(=O)O)Cc1cc(C)ccc1O	83411056	CFCXIMABRYBPIV-UHFFFAOYSA-N	223.272	1.607	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)CCN1	226561645	XSMIRUOLBNEZCM-VIFPVBQESA-N	224.279	1.325	10	20	BDCD	
C[C@H](NCCN1CCC1)c1ccccc1O	381483373	UGKVAOJCNBJPQP-NSHDSACASA-N	220.316	1.749	10	20	BDCD	
C[C@@H](NC(=O)NCc1ccccc1O)C1CC1	298355079	HRDBDLRSTGPRQL-SECBINFHSA-N	234.299	1.990	10	20	BDCD	
Cc1cc(O)c(CNC[C@H](O)C2CC2)cc1C	266219713	RAFWXPXSAIFYQC-AWEZNQCLSA-N	235.327	1.870	10	20	BDCD	
CO[C@H](C)CN(C)Cc1cc(F)ccc1O	289195648	BBNARZKMJSASDL-SECBINFHSA-N	227.279	1.998	10	20	BDCD	
Cc1cc(C)c([C@@H](C)NCCN)c(O)c1	817937659	ZAFJEHXLMFBCQX-SNVBAGLBSA-N	208.305	1.618	10	20	BDCD	
CCOc1ccc(N(C)Cc2nnnn2C)cc1	739923118	XEFMMUQVSQUZLI-UHFFFAOYSA-N	247.302	1.245	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](N)C(C)C)c1	841028846	IRVHKVMZHXTWIN-GFCCVEGCSA-N	222.332	1.774	10	20	BDCD	
C[C@H](NC(=O)NCc1ccc(N)cc1)C1CC1	1337623285	XPZARSQTINFIAW-VIFPVBQESA-N	233.315	1.867	10	20	BDCD	
COc1ccc(CNCCN(C)OC)cc1C	883172538	KRDPWFIAMCFUKE-UHFFFAOYSA-N	238.331	1.586	10	20	BDCD	
CCN(Cc1ccc(C)cc1O)[C@H](C)CO	877543262	BCTQZMQQJWBDIN-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
C[C@@H](O)CSc1ncc([N+](=O)[O-])s1	882737193	BYRBOJCLDVWUSL-SCSAIBSYSA-N	220.275	1.524	10	20	BDCD	
CC1(C)CN(Cc2ccccc2O)CCN1	390554980	QCCCNKXXTISQLJ-UHFFFAOYSA-N	220.316	1.576	10	20	BDCD	
Cc1nnc(N(C)Cc2ccccc2O)nc1C	775517863	ADEISHDSEVAHNH-UHFFFAOYSA-N	244.298	1.830	10	20	BDCD	
NC1CCC(NCc2cccc(F)c2O)CC1	158753237	VAVVQLRUMSOWQQ-UHFFFAOYSA-N	238.306	1.891	10	20	BDCD	
Cc1ccc(O)c(CNCc2cnnn2C)c1	288406739	INDVUROZXLAFCK-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
C[C@@H]1NCCC[C@@H]1NCc1ccc(N(C)C)cc1	396726136	YSWDGASQCPBEAK-WFASDCNBSA-N	247.386	1.983	10	20	BDCD	
C[C@]1(C(=O)O)CCN(Cc2ccc(N)cc2)C1	1604500050	CORUYCFUUPBUJT-ZDUSSCGKSA-N	234.299	1.565	10	20	BDCD	
O=C(CSc1nccs1)N1CCOCC1	6537109	QXBXEIONWIVXCZ-UHFFFAOYSA-N	244.341	1.094	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCCC[C@@H]1O	51991274	OXIYYLGPQMPKBV-AAEUAGOBSA-N	221.300	1.785	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2C[C@H]3CC[C@H]2O3)cc1	250230407	ACLAIEMJNLMQJY-FRRDWIJNSA-N	246.310	1.247	10	20	BDCD	
C[C@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1	37801156	QJTLUEHRABXUQI-JTQLQIEISA-N	235.331	1.058	10	20	BDCD	
CCNC(=O)CN(CC)Cc1ccccc1O	133614385	PFUYACNEXGUTTK-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
CCC1(C(=O)NCc2ccc(O)c(O)c2)CC1	272325539	LJCJDPUMTZDFKD-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CCN(C)S(=O)(=O)Nc1ccc(O)cc1	271990804	ZCLNXZBHHBOJDS-UHFFFAOYSA-N	230.289	1.001	10	20	BDCD	
NCC1(CC(=O)NCc2ccccc2O)CC1	817997190	VEQFIVQTXLKPHF-UHFFFAOYSA-N	234.299	1.137	10	20	BDCD	
Cc1cccc(O)c1CNCC(C)(C)CO	877117119	JOPIUYYGZKKBNM-UHFFFAOYSA-N	223.316	1.809	10	20	BDCD	
CC[C@@H](NC(=O)c1cc(O)cs1)[C@@H](C)O	839783350	XDWINTFTYXVJGV-HTRCEHHLSA-N	229.301	1.343	10	20	BDCD	
CC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)NC	697847687	BJKMAAUEQVJZQA-GFCCVEGCSA-N	248.326	1.236	10	20	BDCD	
COc1ccc(CN2C[C@H]3C[C@H]3C2)c(O)c1OC	895558958	MOASIBAAAWOHQR-PHIMTYICSA-N	249.310	1.861	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](CO)C1)c1ccc(F)cc1O	707597450	YBRKJSHWYGBWAS-ATZCPNFKSA-N	239.290	1.953	10	20	BDCD	
O[C@H]1C[C@H](CNCc2ccc3c(c2)CCO3)C1	720935863	JTBRYVFVJPUQTH-AULYBMBSSA-N	233.311	1.482	10	20	BDCD	
COc1cc(C)cc(CN2CCO[C@H]3C[C@@H]32)c1O	793614915	NAJWOIVMXYCELH-RYUDHWBXSA-N	249.310	1.682	10	20	BDCD	
COc1ccc(N(C)CC(OC)OC)cc1	85351213	ICNJUMIORDYPPY-UHFFFAOYSA-N	225.288	1.750	10	20	BDCD	
O=C(O)CN(C(=O)c1cc(O)cs1)C1CC1	1602051517	WEFWQALBYKSPOF-UHFFFAOYSA-N	241.268	1.143	10	20	BDCD	
COc1cccc(O)c1CNC[C@H]1C[C@H](O)C1	873177267	CFTQDZAOOHDEPX-MGCOHNPYSA-N	237.299	1.261	10	20	BDCD	
C[C@H]1C[C@@H](NCc2ccc3c(c2)CCO3)CO1	402024788	GLZAACGWZVRGPM-GXFFZTMASA-N	233.311	1.889	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@@H]1C[C@H]1C(=O)O	1593303163	DGQRJLQGOSIMFY-INTQDDNPSA-N	235.283	1.591	10	20	BDCD	
C[C@H](N[C@@H]1CCN(C)C1)c1ccc(F)cc1O	62748156	DAUYLUTXJRVQSQ-GXSJLCMTSA-N	238.306	1.886	10	20	BDCD	
N[C@H](CCO)c1ccc(N2CCCC2)cc1	44236249	AWPBEZOTPHPNID-CYBMUJFWSA-N	220.316	1.669	10	20	BDCD	
COc1cc(Cl)cc(CN[C@@H](C)CO)c1O	128612166	SVEWLCDKTNZBMZ-ZETCQYMHSA-N	245.706	1.525	10	20	BDCD	
Oc1cc2c(cc1CNCc1cc[nH]n1)OCO2	42880407	CFTUVEZKLSRACR-UHFFFAOYSA-N	247.254	1.134	10	20	BDCD	
COc1cccc(CN(C)C[C@@H](C)N)c1O	380612469	YPYVYROCJPJDLX-SECBINFHSA-N	224.304	1.180	10	20	BDCD	
C[C@@](O)(CC(=O)NCc1ccccc1O)C1CC1	270021344	AMKAGZOKTDRSRX-CQSZACIVSA-N	249.310	1.560	10	20	BDCD	
C[C@@H](c1nncn1C)N(C)Cc1ccccc1O	287761029	MGVBECVMTKBQBX-JTQLQIEISA-N	246.314	1.714	10	20	BDCD	
C[C@H](NC/C=C\CO)c1ccc(N(C)C)cc1	717533753	YJTDVHJFSQIZPD-RXNFCKPNSA-N	234.343	1.952	10	20	BDCD	
Cc1cc(O)c(CNC/C=C\CO)cc1Cl	826942157	NKEBLJKOPXRBIU-IHWYPQMZSA-N	241.718	1.992	10	20	BDCD	
OC[C@@H]1CCN1Cc1cc2c(cc1O)CCC2	902630578	PCFRLYJCHBJPJW-ZDUSSCGKSA-N	233.311	1.448	10	20	BDCD	
Cc1cccc(CNC[C@@H]2C[C@H](F)CN2)c1O	841077575	BURCXSLURNCRRT-RYUDHWBXSA-N	238.306	1.490	10	20	BDCD	
CN(CCN)Cc1cccc(Cl)c1O	841100187	FSJZCPJVOSYWBD-UHFFFAOYSA-N	214.696	1.436	10	20	BDCD	
CN(Cc1cnsn1)c1ccc2c(c1)OCO2	846834730	DMUYQHPVMIFRMS-UHFFFAOYSA-N	249.295	1.903	10	20	BDCD	
O=C(COC(=O)C1CC1)c1ccc(O)c(O)c1	916589379	CDNRXOFHYDUVDC-UHFFFAOYSA-N	236.223	1.234	10	20	BDCD	
CCC(F)(F)C(=O)NCCc1ccc(N)cc1	701200772	RNBUEDDOHVWFRC-UHFFFAOYSA-N	242.269	1.973	10	20	BDCD	
Cc1ccc(CNCC(F)(F)CO)c(O)c1	877392957	IZKKZSBSMKDPNW-UHFFFAOYSA-N	231.242	1.418	10	20	BDCD	
C[C@H](NCCN(C)C)c1c(O)cccc1F	886608899	HXODKUUYGCNURP-VIFPVBQESA-N	226.295	1.744	10	20	BDCD	
C[C@H](CO)N(C)Cc1cc(F)cc(F)c1O	894771227	ZNFXQLOQFKEUMF-SSDOTTSWSA-N	231.242	1.483	10	20	BDCD	
C[C@H](NC[C@H]1CNCCO1)c1ccccc1O	817984035	VCIKIOFLHGPVRD-WDEREUQCSA-N	236.315	1.031	10	20	BDCD	
CN(C)c1ccc(CN[C@H](CN)C2CC2)cc1	841027485	BYUAIVVLONPBQK-CQSZACIVSA-N	233.359	1.580	10	20	BDCD	
COc1cccc(O)c1CN[C@@H]1C[C@]1(C)OC	850408758	DVXHMJXUTQXUFO-OLZOCXBDSA-N	237.299	1.668	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@](C)(CN)C2)c1	310372969	OMRUSHXUWQPLOD-AWEZNQCLSA-N	234.343	1.871	10	20	BDCD	
C[C@]1(NC(=O)Cc2ccc(N)cc2)CCOC1	119127600	FNHMEGGUINJQGN-ZDUSSCGKSA-N	234.299	1.107	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H](C)CO)c1	35602997	DUYOAJLSKAHSLA-BDAKNGLRSA-N	225.288	1.432	10	20	BDCD	
CNC(=O)CCCNCc1c(C)cccc1O	876983447	QFWFGEGNUKWUKV-UHFFFAOYSA-N	236.315	1.316	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)C[C@H](C)O	877195270	FWVZDSPZDRFHBD-QWRGUYRKSA-N	223.316	1.950	10	20	BDCD	
C/C=C/COC(=O)c1cccc(O)c1O	776282088	NSOAGSBLEVNRLI-NSCUHMNNSA-N	208.213	1.831	10	20	BDCD	
Cc1cc(CNCc2ccccc2O)no1	44692240	WAZVZVPNHCKNHV-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
C[C@H](NCc1ccc(F)c(F)c1O)C(=O)O	703330745	YUANYPTXIPFNQF-YFKPBYRVSA-N	231.198	1.233	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@@H]2C=CCC2)cc1	711767221	KNDSVBCWERTXCX-GFCCVEGCSA-N	230.311	1.894	10	20	BDCD	
CO[C@H]1CCC[C@@H]1C(=O)NCc1ccc(N)cc1	1263303747	HCEFYZBCNKIVQU-STQMWFEESA-N	248.326	1.700	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccc(N)cc2)CCCNC1	1341923231	JQPRBQQVSMJYDX-CQSZACIVSA-N	247.342	1.275	10	20	BDCD	
C[C@H](N[C@H](C)CC(N)=O)c1ccc(N(C)C)cc1	161364415	PUUJPRYFYWJEQB-MNOVXSKESA-N	249.358	1.667	10	20	BDCD	
Cc1cccc(CNC[C@H](O)C(C)C)c1O	162628341	IFBBMFPZSMCWQU-LBPRGKRZSA-N	223.316	1.807	10	20	BDCD	
CO[C@@H](C(=O)NCc1ccccc1O)C1CC1	281442830	FIWWLLXOCXHGRE-GFCCVEGCSA-N	235.283	1.433	10	20	BDCD	
O=C(O)CCN[C@@H]1CCc2cccc(O)c21	309542007	YNDYXJAHJBGXRZ-SECBINFHSA-N	221.256	1.444	10	20	BDCD	
CCOc1cccc(CN2CC[C@H](N)C2)c1O	50227656	KAUWTBDKRLVVCY-NSHDSACASA-N	236.315	1.324	10	20	BDCD	
CC[C@@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1	37801172	MRCBIXLYLNTNBP-CYBMUJFWSA-N	249.358	1.448	10	20	BDCD	
NC[C@@H]1CCN(Cc2c(O)cccc2Cl)C1	128320433	SIHJNYDOUYHRCI-VIFPVBQESA-N	240.734	1.826	10	20	BDCD	
CN(CCC(N)=O)Cc1c(O)cccc1Cl	289575461	JREKWKKGUVDGSK-UHFFFAOYSA-N	242.706	1.353	10	20	BDCD	
CC(C)[C@@H](N)CNCc1cc(F)ccc1O	841031764	WQXUMVLMIUDZKZ-NSHDSACASA-N	226.295	1.604	10	20	BDCD	
CCOCCN1CCCc2cc(CN)ccc21	62801586	MLJLIIAXPYCXGN-UHFFFAOYSA-N	234.343	1.934	10	20	BDCD	
O=C(OCC(F)F)c1cc(O)cs1	393534159	FZYCUQVKRWCMHK-UHFFFAOYSA-N	208.185	1.876	10	20	BDCD	
COc1ccc(N(C)CCC2OCCO2)cc1	686604372	NVSXKMJZYFKVQQ-UHFFFAOYSA-N	237.299	1.894	10	20	BDCD	
CC[C@@](C)(CCO)NCc1ccc(N)cc1	1262487790	GEOMNLLKBADHOM-ZDUSSCGKSA-N	222.332	1.910	10	20	BDCD	
C[C@@H]1CCC[C@H]([C@@H]2CCCC(=O)C2=O)N1	130378832	AKLOMWPYVUZNHM-KXUCPTDWSA-N	209.289	1.455	10	20	BDCD	
Cc1ccc(CNCC(F)(F)CN)c(O)c1	1579696740	CIKCSSKULXGTSP-UHFFFAOYSA-N	230.258	1.384	10	20	BDCD	
Cc1ccc(CNCc2cocn2)c(O)c1	877046659	ODRYBHLLEKJGAC-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
Cc1cccc(O)c1CNCC1(CO)CCC1	877315390	HETRYXYKFGSHNN-UHFFFAOYSA-N	235.327	1.953	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)C[C@H]1CC(=O)O	1607438527	NWNCYDOHNHRVHX-ZYHUDNBSSA-N	248.326	1.811	10	20	BDCD	
CCOc1cccc(CNC[C@@H](C)CO)c1O	112017455	YOOKFZVFJVTBEO-SNVBAGLBSA-N	239.315	1.509	10	20	BDCD	
CC[C@H](NCCOCCO)c1ccccc1O	20198902	RRKHTSQVELCDHR-LBPRGKRZSA-N	239.315	1.442	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@]1(C)CCNC1	62896292	LDNAYBUZFZROHY-CQSZACIVSA-N	248.326	1.350	10	20	BDCD	
C[C@H](NCCCCN)c1cc(F)ccc1O	87111385	XNQWGWCQMCICES-VIFPVBQESA-N	226.295	1.921	10	20	BDCD	
CC(=O)C(=O)COc1ccc(Cl)nc1	808033743	OMJWDOULEJHWKU-UHFFFAOYSA-N	213.620	1.272	10	20	BDCD	
C[C@H](CCN)NCc1ccc(N(C)C)c(F)c1	841049452	DXMLRKGRWSGEKZ-SNVBAGLBSA-N	239.338	1.719	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)CN	841060868	RIHTWBCWANFFEH-LLVKDONJSA-N	221.348	1.498	10	20	BDCD	
Cc1ccc(C(=O)N2C[C@H]3C[C@H]3C2)c(O)c1O	862557779	ZOOZKIOYHCCYPQ-DTORHVGOSA-N	233.267	1.498	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@](C)(O)C2CC2)c1	862755046	BCUNKKYALIMLBY-AWEZNQCLSA-N	249.310	1.478	10	20	BDCD	
Cn1nccc1COC(=O)c1cc(O)cs1	773519377	WETDUJVOINMPIT-UHFFFAOYSA-N	238.268	1.544	10	20	BDCD	
Cc1ccc(C(=O)N2CC=CCC2)c(O)c1O	781021803	SBEGRIKCKDURSX-UHFFFAOYSA-N	233.267	1.808	10	20	BDCD	
CC(C)[C@@H](F)C(=O)NCc1ccc(O)c(O)c1	784441920	JMKIIUHPYPTFLL-LLVKDONJSA-N	241.262	1.708	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)cc(F)c2O)CCO1	708414366	RJXAYBCQUCUALX-QMMMGPOBSA-N	243.253	1.891	10	20	BDCD	
CNC[C@H](C)CNCc1cc(OC)ccc1O	1325321349	VLNODWDKAHWZFH-JTQLQIEISA-N	238.331	1.346	10	20	BDCD	
CC[C@@H](C)C(=O)NCc1cccc(O)c1O	1349077905	FOIGEIJBGFXQRM-MRVPVSSYSA-N	223.272	1.760	10	20	BDCD	
C[C@@H](N)[C@@H](C)C(=O)N(C)Cc1ccccc1O	156654902	AONQCUZCVVNYFQ-NXEZZACHSA-N	236.315	1.334	10	20	BDCD	
COc1ccc(O)c(CNCC2CC2)c1	20086321	DBLRYXKRVMYRQK-UHFFFAOYSA-N	207.273	1.900	10	20	BDCD	
C[C@H]1COC[C@@H]1NC(=O)Nc1ccc(N)cc1	699776766	INXZNLNAGMICJF-KWQFWETISA-N	235.287	1.425	10	20	BDCD	
C[C@H](N)[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1	126808987	IZIWIZHNIOPASS-GXTWGEPZSA-N	247.386	1.922	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCCS1	127991033	RKCYXTHSFLOTOC-NSHDSACASA-N	237.324	1.904	10	20	BDCD	
CC(=O)N1CCN(Cc2cc(C)ccc2O)CC1	131776598	ILERCZODEKJBAI-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
C[C@H](CO)CN[C@H](C)c1ccc(F)cc1O	83218839	KEVIVFIWRQBOCL-DTWKUNHWSA-N	227.279	1.810	10	20	BDCD	
CC(C)CN(CC(=O)O)Cc1ccccc1O	86778134	GJKJIROPCYAACO-UHFFFAOYSA-N	237.299	1.935	10	20	BDCD	
Cc1ccc(O)c(CN2CCC(CO)CC2)c1	271029820	GFPLMPIQNAIJOJ-UHFFFAOYSA-N	235.327	1.905	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H]([C@H](C)O)C2)c1	272531831	NDLUTXPRJBSOLX-NWDGAFQWSA-N	235.327	1.903	10	20	BDCD	
COc1ccccc1C(=O)OCC(=O)C(C)=O	808488564	IYOOIQJDGHFAEZ-UHFFFAOYSA-N	236.223	1.010	10	20	BDCD	
CC[C@@H](NCCNC)c1ccccc1O	817952228	OOWYECGDXMHXCP-LLVKDONJSA-N	208.305	1.652	10	20	BDCD	
CCCN(C)C(=O)NCCc1ccc(N)cc1	841953832	DXFQYIWIFFXUOW-UHFFFAOYSA-N	235.331	1.863	10	20	BDCD	
CNC[C@@H](C)N[C@@H](C)c1ccc(C)cc1O	854232556	SKNSDZOCPDTFDI-MNOVXSKESA-N	222.332	1.959	10	20	BDCD	
Cc1ocnc1C(=O)NCc1ccc(O)c(O)c1	778917102	WQLPVGPKXFIPKG-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
COc1cccc(CNCc2cc(C)[nH]n2)c1O	716457870	CLHAXECFXXFNIX-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
CN(C)c1ccc(CNCc2c[nH]cn2)cc1	54763709	YOQDWRFVZGCLAZ-UHFFFAOYSA-N	230.315	1.766	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2CCCCO2)cc1	50958859	ROSCTOJBVBRPDM-LBPRGKRZSA-N	234.299	1.454	10	20	BDCD	
N[C@H]1CCN(Cc2c(O)cccc2Cl)C1	128319700	JMLWGGLIQUVZGU-QMMMGPOBSA-N	226.707	1.579	10	20	BDCD	
C[C@H](CO)CN[C@@H](C)c1ccc(F)cc1O	83218834	KEVIVFIWRQBOCL-IUCAKERBSA-N	227.279	1.810	10	20	BDCD	
Cc1cccc(CN(CCO)C(C)C)c1O	132484166	UUIMRWXAHHAQGG-UHFFFAOYSA-N	223.316	1.903	10	20	BDCD	
CC[C@H](N[C@@H]1CCNC1)c1ccc(F)cc1O	817945166	WARRLEVCSNVKJT-PWSUYJOCSA-N	238.306	1.934	10	20	BDCD	
C[C@H](N)CCN[C@@H](C)c1ccc(F)cc1O	817951244	CGLPMKZKSXVONN-IUCAKERBSA-N	226.295	1.919	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@H]1CC12CCC2	910950854	KYWZDFVXYLRHID-LLVKDONJSA-N	247.294	1.904	10	20	BDCD	
N[C@H](CO)c1ccc(N2CCCC2)cc1	72198024	JBVRFPVUUUJYTP-GFCCVEGCSA-N	206.289	1.279	10	20	BDCD	
Cc1ccc(CN2C[C@@H]3CNC[C@H]3C2)c(O)c1	876817507	IWENZNGTNGQQTM-STQMWFEESA-N	232.327	1.352	10	20	BDCD	
Cc1ccc(CN2CCC(O)CC2)c(O)c1	876541039	RPBJVXFZXKMCJX-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
C/C=C\C(=O)N[C@H](C)Cc1ccc(O)c(O)c1	773740175	AGNRDPXMSRUDGT-ZBJFTSOASA-N	235.283	1.721	10	20	BDCD	
C[C@H](O)CCCNC(=O)c1cc(O)cs1	791010060	DXSNZAOMHGDYJS-ZETCQYMHSA-N	229.301	1.345	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H]2CCOC2)c1	37738330	SIFKFWMOXHDSLH-JTQLQIEISA-N	237.299	1.527	10	20	BDCD	
COC(=O)C1CCN(Cc2ccccc2O)CC1	84857714	ATQPUEVSRNENJM-UHFFFAOYSA-N	249.310	1.777	10	20	BDCD	
OCCOCCNCc1c(O)cccc1Cl	83551516	FIPMMLOSQLBJLI-UHFFFAOYSA-N	245.706	1.144	10	20	BDCD	
CNC[C@@H](C)CNCc1cc(OC)ccc1O	1325321350	VLNODWDKAHWZFH-SNVBAGLBSA-N	238.331	1.346	10	20	BDCD	
COC[C@@H](C)NC(=O)NCc1ccc(N)cc1	1336873956	SDGXBHRGNWKMAK-SECBINFHSA-N	237.303	1.103	10	20	BDCD	
NC[C@@H]1CCCC[C@H]1NCc1ccc(N)cc1	1352788133	DBEWNIAXPIFPQA-GXTWGEPZSA-N	233.359	1.876	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)CC(=O)O)c1	1605296537	JYEYKMNCZBRJOZ-VIFPVBQESA-N	223.272	1.653	10	20	BDCD	
N[C@H](CC(=O)O)c1cc(C(F)(F)F)ccc1O	217970200	DVNHHWYGDWJMDS-SSDOTTSWSA-N	249.188	1.886	10	20	BDCD	
CN1CCC[C@@H]1CNCc1ccccc1O	163759143	QCBLHTHXXQCFSM-GFCCVEGCSA-N	220.316	1.576	10	20	BDCD	
NC1(CNCc2ccccc2O)CCCC1	849349810	JMIUXHCTFVWAQY-UHFFFAOYSA-N	220.316	1.753	10	20	BDCD	
CNC[C@@H](C)C(=O)Nc1ccc(N)cc1	237250231	HGXHNVBVPAWQRC-MRVPVSSYSA-N	207.277	1.063	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cc[nH]n1	394938355	DWYSBYWPFRVVMQ-UHFFFAOYSA-N	231.255	1.388	10	20	BDCD	
N[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1	50227705	KRRNFZYQYCCCAB-SNVBAGLBSA-N	226.707	1.579	10	20	BDCD	
CC(C)(C)[C@@H](CO)NCc1ccccc1O	34510913	WHJPLZJRKJLOTE-GFCCVEGCSA-N	223.316	1.889	10	20	BDCD	
CC(C)[C@@H](CO)NCc1ccc2c(c1)CCO2	80789515	PECUEXZQTOMWMK-CYBMUJFWSA-N	235.327	1.728	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCOC2)c1	87784958	WNAUBPSVOHZYLE-NSHDSACASA-N	207.273	1.579	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@](C)(C(N)=O)C2)c1	235893709	XBARFFRNRPTQRV-AWEZNQCLSA-N	248.326	1.398	10	20	BDCD	
CCOCC1(C(=O)NCc2ccccc2O)CC1	281919248	JIKMAEOWZBYXHY-UHFFFAOYSA-N	249.310	1.825	10	20	BDCD	
CSCCONC(=O)c1cccc(O)c1O	280023662	NYASGFUAZYJWTN-UHFFFAOYSA-N	243.284	1.122	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@@H]1CCCNC1)CC2	817945623	ICZSWODNQYKZKI-DGCLKSJQSA-N	246.354	1.969	10	20	BDCD	
Cc1cccc(CN2CC[C@H]3NCC[C@H]3C2)c1O	843127258	PCQWBTMSVVHONB-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
CNC[C@H]1CCN(Cc2cccc(C)c2O)C1	843053506	ZKXWJCAHBPXWNJ-GFCCVEGCSA-N	234.343	1.742	10	20	BDCD	
Cc1cc(O)c(CNC[C@@H]2CCN2C)cc1C	922575139	CUBLETYWERQVHB-ZDUSSCGKSA-N	234.343	1.803	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](CO)C1)c1c(O)cccc1F	886644368	BITZESXYLVYLSK-LPEHRKFASA-N	239.290	1.953	10	20	BDCD	
C[C@@]1(CO)CCCN1Cc1cc(F)ccc1O	788435041	DISOIGPMKPEQEV-ZDUSSCGKSA-N	239.290	1.878	10	20	BDCD	
Cc1cccc(CN2C[C@H](O)C[C@@H]2C)c1O	788266733	BIEMVSZAHQVWEI-CMPLNLGQSA-N	221.300	1.656	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)N2CC(O)C2)s1	1537963058	RUWWCSPWGHIVHP-UHFFFAOYSA-N	238.272	1.375	10	20	BDCD	
CO[C@]1(C(F)(F)F)CCN(CCN=[N+]=[N-])C1	409432458	LJBWPWHEIBSEJW-SSDOTTSWSA-N	238.213	1.950	10	20	BDCD	
C[C@@H](NCc1cc(F)ccc1O)C1(CO)CC1	696091763	VAPHDONFMNACAO-SECBINFHSA-N	239.290	1.782	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1CCCN1)CCO2	259018533	YKFVJQIKIUESHB-ZDUSSCGKSA-N	232.327	1.463	10	20	BDCD	
C[C@@H]1OCCN(C(=O)Cc2ccc(N)cc2)[C@@H]1C	125311681	FYBNZDQISKLHNY-MNOVXSKESA-N	248.326	1.447	10	20	BDCD	
Oc1ccccc1CN1CC[C@@H]2NCC[C@@H]2C1	383862460	ODYOVAZMJFDTFD-YPMHNXCESA-N	232.327	1.576	10	20	BDCD	
CC(C)CNC(=O)NCCc1ccc(N)cc1	841506250	BSAXJLFPKPMHTE-UHFFFAOYSA-N	235.331	1.767	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@@H](O)[C@@H](CC2CC2)C1	409435131	SMRNRWQBUDHJHO-VHSXEESVSA-N	238.291	1.306	10	20	BDCD	
COc1cccc(CN(C)Cc2nnc[nH]2)c1O	179795947	IOIBBQDEAOYAHU-UHFFFAOYSA-N	248.286	1.151	10	20	BDCD	
CO[C@@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1	151884506	ATFFQTXXQNSZEN-CYBMUJFWSA-N	248.326	1.449	10	20	BDCD	
CO[C@H]1CC[C@H](NC(=O)Nc2ccc(N)cc2)C1	234828916	KFCDGYVSDBYNKV-RYUDHWBXSA-N	249.314	1.958	10	20	BDCD	
COCC[C@@H](C)NC(=O)c1cc(O)cs1	732283649	RODIORLMRQDIGP-SSDOTTSWSA-N	229.301	1.609	10	20	BDCD	
COc1cccc(CNC[C@@H](C)CN)c1O	841048536	JYPUNIMBHXISPA-VIFPVBQESA-N	224.304	1.085	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](CO)C1)c1cc(F)ccc1O	707593336	HROIXPWZKAUWDK-ATZCPNFKSA-N	239.290	1.953	10	20	BDCD	
COc1cccc(O)c1CNCC1(O)CCC1	732229294	OWCJFEXGQSAUQV-UHFFFAOYSA-N	237.299	1.405	10	20	BDCD	
Cc1cccc(CN[C@@H]2CC[C@@H](CN)C2)c1O	841084090	FZVVQSXDDKLBTG-DGCLKSJQSA-N	234.343	1.918	10	20	BDCD	
Cc1cccc(O)c1CNCC1(O)CCC1	877040381	VVUMXAQCSGOSLI-UHFFFAOYSA-N	221.300	1.705	10	20	BDCD	
C[C@H]1COC[C@@H]1NCc1ccc(N(C)C)cc1	688042873	JNTYCMZLUBDGFK-FZMZJTMJSA-N	234.343	1.877	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@@H]1CC[C@H]1O)CC2	818358283	SRRYNPUUXFDBGR-OUAUKWLOSA-N	219.284	1.492	10	20	BDCD	
Cn1cc(C(=O)CSc2nccs2)cn1	78056159	RPYNDYXTCAMGOU-UHFFFAOYSA-N	239.325	1.852	10	20	BDCD	
C[C@H](NC(=O)Cc1ccc(N)cc1)C1CC1	35732593	IXOCIIBEUFRDFG-VIFPVBQESA-N	218.300	1.726	10	20	BDCD	
CN(C)c1ccc(CN(C)[C@@H]2CCNC2)cc1	71309445	QMCQQNNGSVMTRU-CQSZACIVSA-N	233.359	1.546	10	20	BDCD	
CC1(NC(=O)Cc2ccc(N)cc2)CCC1	228826641	MWGDPOBFWXRJFH-UHFFFAOYSA-N	218.300	1.870	10	20	BDCD	
CC(=O)C(=O)CSc1ncc(C)cn1	289611228	KXHZEZQKFMSGLY-UHFFFAOYSA-N	210.258	1.035	10	20	BDCD	
COC(=O)[C@H]1C[C@@H](NCc2ccccc2O)C1	827501269	STIFPVKVQDDTKL-PHIMTYICSA-N	235.283	1.433	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H]1CCNC1	841045327	SVVBEJPBXMBIND-ZDUSSCGKSA-N	233.359	1.513	10	20	BDCD	
CCN(CC)c1ccc(CN(C)C2CNC2)cc1	843125142	XMELTTIJOWZCFS-UHFFFAOYSA-N	247.386	1.936	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C[C@H](C)N)c1	843128159	IIJBBYWEMVXPEG-QWRGUYRKSA-N	222.332	1.916	10	20	BDCD	
Cc1cc(CN2CCCNCC2)ccc1N(C)C	923278633	XKTZIMAZEXGMFJ-UHFFFAOYSA-N	247.386	1.856	10	20	BDCD	
Cc1ccc(CNc2cnn(CCO)c2)c(O)c1	877122555	YHMCYDWLUYDOQZ-UHFFFAOYSA-N	247.298	1.502	10	20	BDCD	
N[C@@H](CC(=O)O)c1cccc(Cl)c1O	82969557	PEXMJKSFCLVJKA-ZETCQYMHSA-N	215.636	1.520	10	20	BDCD	
CCCN(Cc1ccccc1O)[C@H]1CCOC1=O	76074462	TVXNBXNKAUNTTF-LBPRGKRZSA-N	249.310	1.920	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCCN(C)C2=O)c1O	704379914	FZJAKFNDFBOYSN-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
CC[C@H](F)C(=O)NCCc1ccc(O)c(O)c1	1335855859	ONMIMGWWXKLGSR-VIFPVBQESA-N	241.262	1.505	10	20	BDCD	
CC(=O)CCC(=O)N[C@H](C)c1ccccc1O	827918749	YRRGYEBQZPLWHO-SNVBAGLBSA-N	235.283	1.939	10	20	BDCD	
OC[C@H]1CCCN1Cc1cc(F)ccc1O	179912061	XBIMAHYLASNODZ-LLVKDONJSA-N	225.263	1.488	10	20	BDCD	
CCCN(CC(=O)NC)Cc1ccccc1O	76074194	LMOJBFYGBSFMTA-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
CN(C)c1ccc(CNCCF)cc1F	280828088	WHLNTNUGPRPDSI-UHFFFAOYSA-N	214.259	1.951	10	20	BDCD	
COCCN(C)Cc1cc(OC)ccc1O	132706658	ZFANBNJGSFTJCE-UHFFFAOYSA-N	225.288	1.479	10	20	BDCD	
OCC(F)(F)CNCc1ccccc1O	183873273	WXLDBBIWTLDZQH-UHFFFAOYSA-N	217.215	1.109	10	20	BDCD	
CC[C@@H](C)NC(=O)NCc1ccccc1O	299469962	CURGQHQVUIYXKB-SECBINFHSA-N	222.288	1.990	10	20	BDCD	
C[C@@H](NC[C@@H]1CCCN1)c1ccc(F)cc1O	817951225	BXLWVNNXVCZYHA-KOLCDFICSA-N	238.306	1.934	10	20	BDCD	
CC[C@H](N)CN[C@H]1CCc2cccc(O)c21	817980649	WFAXKQLJADDYJS-QWRGUYRKSA-N	220.316	1.706	10	20	BDCD	
C[C@H](NC[C@H]1CCCN1)c1cc(F)ccc1O	817951619	HOSVXMSNMAKAKG-GXSJLCMTSA-N	238.306	1.934	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)C[C@@]1(C)CO	827700460	UKCZMKMPXNKFOI-RISCZKNCSA-N	235.327	1.843	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1[C@@H]2CCC(=O)[C@@H]12	907054944	AAQVHYUYBDZOEL-ICCXJUOJSA-N	245.278	1.234	10	20	BDCD	
C[C@H](CNC(=O)c1cc(O)cs1)N(C)C	732268170	DAQDTXAKIUHJCU-SSDOTTSWSA-N	228.317	1.134	10	20	BDCD	
O=C(OC[C@@H]1CCOC1)c1cc(O)cs1	732354836	SVHDDJAWZRNHME-SSDOTTSWSA-N	228.269	1.647	10	20	BDCD	
COc1cccc(CN[C@H]2C[C@H](OC)C2)c1O	706498888	YPJZDRRQEHIEJQ-XYPYZODXSA-N	237.299	1.668	10	20	BDCD	
C[C@@H](N)[C@@H]1CCN(Cc2ccc(N)cc2)C1	1334753482	FFHYEKMCJBSBQH-ZYHUDNBSSA-N	219.332	1.438	10	20	BDCD	
CCCNC(=O)CN[C@H]1CCc2cccc(O)c21	295856494	GJXLFHLHXOSABU-NSHDSACASA-N	248.326	1.495	10	20	BDCD	
[N-]=[N+]=NCCn1cc(-c2cnccn2)cn1	409440813	UZTCJJJLAQLYIU-UHFFFAOYSA-N	215.220	1.650	10	20	BDCD	
Cc1ccc(C(=O)NC(C)(C)C)c(O)c1O	179411094	RXUICSDHDUDKFB-UHFFFAOYSA-N	223.272	1.935	10	20	BDCD	
Cc1cc(C(=O)NCc2ccccc2O)nn1C	304821145	BUEUUKBHDJWCBZ-UHFFFAOYSA-N	245.282	1.364	10	20	BDCD	
CC(C)(C)NC(=O)NCc1ccc(N)cc1	37666352	DZVUUJGUZBCOCH-UHFFFAOYSA-N	221.304	1.867	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)CC[C@@H]1N	220189267	VKQVLPSAKUBEOS-SKDRFNHKSA-N	238.306	1.700	10	20	BDCD	
CN(C)c1ccc(CNC2(C(=O)O)CC2)cc1	284246432	OCVRDOIAEUHROP-UHFFFAOYSA-N	234.299	1.459	10	20	BDCD	
C[C@@H](NCCCCO)c1ccc(F)cc1O	193282125	MPZQROQZCWMVMS-SECBINFHSA-N	227.279	1.954	10	20	BDCD	
CCN(CCCO)Cc1cccc(OC)c1O	271182875	IFYXMRNDBPYPMY-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
C[C@H](NC1CNC1)c1ccc(F)cc1O	817956027	OBQKONCWIIOISV-ZETCQYMHSA-N	210.252	1.154	10	20	BDCD	
NC[C@@H](NCc1cccc(F)c1O)C1CC1	841028561	PPROGUBVWFANLW-LLVKDONJSA-N	224.279	1.358	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1CCCNC1	841043053	NMWFCPACTATEMC-JTQLQIEISA-N	236.315	1.242	10	20	BDCD	
C[C@H](O)C(=O)NCc1cc(Cl)ccc1O	846474345	UUVOVMCBTBNQOE-LURJTMIESA-N	229.663	1.043	10	20	BDCD	
CCOc1cccc(CN[C@@H](C)CNC)c1O	853248083	AKKSPAXJUNPWMU-JTQLQIEISA-N	238.331	1.488	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@H]2C[C@@]2(CO)C1	877463039	YYMQTQMLMWKSTD-RISCZKNCSA-N	233.311	1.515	10	20	BDCD	
CCCN(CC(=O)O)Cc1cc(C)ccc1O	86776009	RMFFHPSPGGBRPR-UHFFFAOYSA-N	237.299	1.997	10	20	BDCD	
C[C@@H](C(=O)NCc1cccc(O)c1O)C1CC1	1350299484	AVEQMMQJEYNTDT-MRVPVSSYSA-N	235.283	1.760	10	20	BDCD	
C[C@@H]1COC[C@@H]1NCc1ccc(N(C)C)cc1	688042875	JNTYCMZLUBDGFK-RISCZKNCSA-N	234.343	1.877	10	20	BDCD	
OC[C@@H](CC(F)(F)F)NCc1ccccc1O	717788447	BMUBNVWPYOOSOS-SECBINFHSA-N	249.232	1.795	10	20	BDCD	
O=C1CCCN1C(=O)CSc1nccs1	64660279	DXNSUYKZXBLZOC-UHFFFAOYSA-N	242.325	1.384	10	20	BDCD	
Cc1ccc(O)c(CN(C)CC(=O)N(C)C)c1	132120232	KFLRMGYBZZMAAW-UHFFFAOYSA-N	236.315	1.221	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)C[C@@H](C)O)c1	228086009	ZFMRZCCVIVUSTI-NXEZZACHSA-N	239.315	1.650	10	20	BDCD	
CC[C@H](CO)NCc1ccc(C)cc1O	83345888	VNDMMXWEMUJRFW-LLVKDONJSA-N	209.289	1.561	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(C)s1	808488553	XEIUUBGNCHHEAB-UHFFFAOYSA-N	226.253	1.371	10	20	BDCD	
C[C@@H](C(=O)O)N(C)Cc1cccc(Cl)c1O	819895306	FQERWMKCINOGMI-ZETCQYMHSA-N	243.690	1.951	10	20	BDCD	
Cc1cc(O)c([C@@H]2NC(=O)CN2C)cc1Cl	849184110	YGIFVRXPNUJVMJ-LLVKDONJSA-N	240.690	1.414	10	20	BDCD	
COC/C(C)=C/C(=O)NCc1ccccc1O	845832283	AKWGDGRKGNUBCQ-JXMROGBWSA-N	235.283	1.601	10	20	BDCD	
C[C@@H](CNCc1cc(F)cc(F)c1O)C(=O)O	1119549077	DWZKIAYTLMADQV-LURJTMIESA-N	245.225	1.481	10	20	BDCD	
COC[C@@H](O)CN[C@H](C)c1c(O)cccc1F	886607304	OZQMYZNOVADCFP-BDAKNGLRSA-N	243.278	1.189	10	20	BDCD	
COc1cc(C)cc(CN2CCO[C@@H]3C[C@@H]32)c1O	793614913	NAJWOIVMXYCELH-NWDGAFQWSA-N	249.310	1.682	10	20	BDCD	
C[C@H](N)[C@@H]1CCCCN1Cc1ccc(N)cc1	1356082909	HMAWKOXSCSYRIL-FZMZJTMJSA-N	233.359	1.971	10	20	BDCD	
C[C@H](CO)CNCc1cc(F)ccc1O	226586252	YZJFCRSJFNISOD-QMMMGPOBSA-N	213.252	1.249	10	20	BDCD	
CCn1cc(CNCc2ccccc2O)nn1	404459687	SIZYABKFPGZOGR-UHFFFAOYSA-N	232.287	1.293	10	20	BDCD	
Cc1nnc(CN[C@H](C)c2ccccc2O)n1C	393251247	BYLPPBDDWDLKOW-SECBINFHSA-N	246.314	1.680	10	20	BDCD	
CN(C)c1ccc(CNCc2cncn2C)cc1	112339226	UGKPHMFHJZLLDR-UHFFFAOYSA-N	244.342	1.776	10	20	BDCD	
C[C@@H](CCN)NCc1ccc2c(c1)CCCO2	136140311	QVWRGMHZGVQRTM-NSHDSACASA-N	234.343	1.839	10	20	BDCD	
COc1ccc(O)c(CNCc2ccon2)c1	148756136	BRDBWULHTSRCOF-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
O=C(NCc1ccccc1O)NCC(F)F	73939443	PAYNAPDKWDZAGS-UHFFFAOYSA-N	230.214	1.457	10	20	BDCD	
COc1ccc(CNC[C@@H](C)CN)cc1C	258658607	BMGZGCWKZVDBQH-JTQLQIEISA-N	222.332	1.688	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2C[C@@H](O)C2)cc1C	294810266	JKRHPOMMXPYHDD-TXEJJXNPSA-N	221.300	1.622	10	20	BDCD	
Cc1ccc(O)c(CN(C)C[C@@H](O)C2CC2)c1	809751778	KGFPMAQVECMUKO-CQSZACIVSA-N	235.327	1.903	10	20	BDCD	
C[C@H](N)CN[C@H](C)c1cc(F)cc(F)c1O	817971846	HTTHQUSQVAMYDZ-NKWVEPMBSA-N	230.258	1.668	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN=c1nc[nH]n1C	840879622	RIZIPFPJKUZXRR-UHFFFAOYSA-N	245.330	1.224	10	20	BDCD	
CNC[C@H](C)N[C@H](C)c1cc(C)ccc1O	854233097	XMEXQAOZVZJPAM-WDEREUQCSA-N	222.332	1.959	10	20	BDCD	
O=C(OCCOC1CC1)c1cccc(O)c1O	922620770	XQXBBQZNUWEJLG-UHFFFAOYSA-N	238.239	1.434	10	20	BDCD	
OC/C=C\CNCc1c(O)ccc(Cl)c1F	850357988	XYXHBWSPRLFMTA-UPHRSURJSA-N	245.681	1.823	10	20	BDCD	
CCOCCOC(=O)c1cccc(O)c1O	776282798	YQPFGGGUGMNEHR-UHFFFAOYSA-N	226.228	1.291	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1cc[nH]c1	778916380	GHRQVZOSYHQFKZ-UHFFFAOYSA-N	232.239	1.356	10	20	BDCD	
COC[C@H](C)NCc1cc(C)cc(OC)c1O	894149999	TVJKTLKQVMUWIC-JTQLQIEISA-N	239.315	1.834	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)Cc2cccs2)C1	409424572	WEYIFSRWZLYORS-UHFFFAOYSA-N	222.273	1.812	10	20	BDCD	
CC(C)N(C)C(=O)NCc1ccc(N)cc1	1337070399	PLNLCJDVJATNOI-UHFFFAOYSA-N	221.304	1.819	10	20	BDCD	
Oc1ccc(F)cc1CN[C@@H]1C[C@H]2CC[C@@H]1O2	226615803	ZNCOWWBTNQLBHB-WZRBSPASSA-N	237.274	1.941	10	20	BDCD	
Cc1ccc(CNCC2(CO)CCC2)c(O)c1	877315160	AEVZSFWFQXFQAA-UHFFFAOYSA-N	235.327	1.953	10	20	BDCD	
COC(=O)[C@H](C)NCc1cc(F)cc(F)c1O	708482644	XUTZCTCZIAIAJQ-LURJTMIESA-N	245.225	1.322	10	20	BDCD	
CCOc1ccc(CNc2ncn(C)n2)c(O)c1	814255357	JUZRFKCPFCMHAJ-UHFFFAOYSA-N	248.286	1.532	10	20	BDCD	
CC[C@H](N[C@@H]1CCNC1)c1ccccc1O	817944914	OYTKDFREGPLTGM-PWSUYJOCSA-N	220.316	1.795	10	20	BDCD	
NCC(F)(F)CN[C@@H]1CCc2cccc(O)c21	817967171	DNAQPNKAMFZDLB-SECBINFHSA-N	242.269	1.563	10	20	BDCD	
CCN(CC(C)(C)O)C(=O)c1cc(O)cs1	748420175	XRERLDLZRCKNGP-UHFFFAOYSA-N	243.328	1.687	10	20	BDCD	
Cc1cccc(CN[C@@H](CCN)C(F)F)c1O	841075067	VLFSONPPIXEMGH-JTQLQIEISA-N	244.285	1.773	10	20	BDCD	
CCC1CN(C(=O)c2cccc(O)c2O)C1	698544083	VCRJJCTYUFQNFZ-UHFFFAOYSA-N	221.256	1.580	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H]3C[C@H]3C2)c1	862444049	WXGREWVCIAYBIF-UWVGGRQHSA-N	219.284	1.853	10	20	BDCD	
Cc1cccc(CN(C)C2CC(O)C2)c1O	761223838	SIRIJEDPBUMKIJ-UHFFFAOYSA-N	221.300	1.656	10	20	BDCD	
C[C@@H](NCC[C@H]1CCOC1=O)c1ccccc1O	879648487	RCVVZUFPHCBRKU-MNOVXSKESA-N	249.310	1.996	10	20	BDCD	
CCO[C@@H](C)C(=O)NCc1ccc(N)cc1	1122536139	SJGBVSHLTUWAOD-VIFPVBQESA-N	222.288	1.310	10	20	BDCD	
O=C(c1cc(O)cs1)N(CCO)C1CCC1	784806076	ORPSUHXGXOYOOF-UHFFFAOYSA-N	241.312	1.441	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@@H](C)CN)c1	274697087	WXJOKTQEPLXYPK-JTQLQIEISA-N	208.305	1.480	10	20	BDCD	
CC(=O)C1(NC(=O)c2cc(O)cs2)CC1	1339553270	HXRMSKLKQKJKGE-UHFFFAOYSA-N	225.269	1.305	10	20	BDCD	
CNC(=O)[C@]1(C)CCN(Cc2ccccc2O)C1	228099606	XNAHWMJRMPYMGI-CQSZACIVSA-N	248.326	1.350	10	20	BDCD	
CN(CC(F)F)C(=O)c1cccc(O)c1O	163279705	VDWZBRHFLRYFCJ-UHFFFAOYSA-N	231.198	1.435	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)c1ccc[nH]1	153903689	YWCATLLSODONOS-UHFFFAOYSA-N	246.266	1.398	10	20	BDCD	
Cc1ccnc(NCCc2ccc(O)c(O)c2)n1	301555676	IKXLGZDGUAVCOR-UHFFFAOYSA-N	245.282	1.851	10	20	BDCD	
C[C@H]1C[C@H](NCc2ccccc2O)CO1	401968300	IBLUXNBKZIKOMC-ONGXEEELSA-N	207.273	1.659	10	20	BDCD	
C[C@@H](NC(=O)CC1COC1)c1ccccc1O	913763642	MPEZCEZGRQCHPT-SECBINFHSA-N	235.283	1.606	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C(=O)N(C)C)c(O)c1	877474396	VBJIQQPCHKDIPN-JTQLQIEISA-N	236.315	1.267	10	20	BDCD	
C[C@@H](NCC1(N)CCC1)c1ccccc1O	817965576	XWEYINIHASEUJJ-SNVBAGLBSA-N	220.316	1.924	10	20	BDCD	
CC(C)(CN)CC(=O)Nc1ccc(N)cc1	911661518	WAYFNNKJBIRBII-UHFFFAOYSA-N	221.304	1.582	10	20	BDCD	
C[C@H](NC(=O)c1cc(O)cs1)C1(CO)CC1	855478781	YPOYSRJVHDEMQM-ZETCQYMHSA-N	241.312	1.345	10	20	BDCD	
Nc1ccc(CN[C@H]2CCC[C@H](N)C2)cc1	1120370692	DMIFOOCYBKCMMR-STQMWFEESA-N	219.332	1.628	10	20	BDCD	
CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1	774015291	CUMICKRZTKFDEA-SECBINFHSA-N	221.304	1.743	10	20	BDCD	
Cc1cccc(CN[C@@H]2CC(=O)N(C)C2)c1O	271905205	WMVLIPZLPGIOJP-LLVKDONJSA-N	234.299	1.021	10	20	BDCD	
OC[C@H]1C[C@@H](NCc2cc(F)ccc2O)C1	707670178	RKAJZQSHDUDTFW-DKTWLAJQSA-N	225.263	1.392	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](C)CN(C)C	850298766	PUTGSIKPTTYSKZ-JTQLQIEISA-N	238.331	1.441	10	20	BDCD	
COc1cc(C)c(CN[C@H]2C[C@H](N)C2)c(O)c1	1579144421	FXHQSWVKWUJSPI-MGCOHNPYSA-N	236.315	1.289	10	20	BDCD	
COCCN[C@H](C)c1cc(C)ccc1O	35628471	SSQCQWOLLATKQJ-SNVBAGLBSA-N	209.289	1.998	10	20	BDCD	
COC[C@@](C)(CO)NCc1ccc(C)cc1O	877155636	ISKOJCZVJHBOAE-CYBMUJFWSA-N	239.315	1.188	10	20	BDCD	
Cc1cccc(CN(C)[C@@H]2CCN(C)C2=O)c1O	271797276	KFONHAUTTFENHS-GFCCVEGCSA-N	248.326	1.363	10	20	BDCD	
CN(Cc1nncn1C)c1ccc(N)cc1	309319715	PWLKMMTXGMFZHE-UHFFFAOYSA-N	217.276	1.034	10	20	BDCD	
Cc1cccc(CNC[C@H]2COCCO2)c1O	124719458	NWYFNYOQBQJJML-LBPRGKRZSA-N	237.299	1.206	10	20	BDCD	
CN(Cc1ccccc1O)[C@@H]1CCNC1	70892617	WQVZDDGVZPLPNI-LLVKDONJSA-N	206.289	1.186	10	20	BDCD	
C[C@@H]1NCC[C@H]1C(=O)NCc1ccccc1O	228421987	SNSDKJUIOKJBOE-GXSJLCMTSA-N	234.299	1.006	10	20	BDCD	
CCOCCNC(=O)CSc1nccs1	194572838	JFWQUZFBEHIROR-UHFFFAOYSA-N	246.357	1.388	10	20	BDCD	
Cc1cccc(CNC[C@H](C)CCO)c1O	162868411	CWUIJCRDWVLVMG-SNVBAGLBSA-N	223.316	1.809	10	20	BDCD	
CCOc1cccc(CN[C@H](C)CN)c1O	841059664	JYCGMTQGPCZUOA-SECBINFHSA-N	224.304	1.228	10	20	BDCD	
CC1(NC(=S)NCc2ccccc2O)CC1	789214181	YAZUGSMJNIJTPV-UHFFFAOYSA-N	236.340	1.909	10	20	BDCD	
[N-]=[N+]=NCCN1CCc2c(CO)cccc21	409432079	KTOLAGALVZJZCJ-UHFFFAOYSA-N	218.260	1.852	10	20	BDCD	
CC[C@@H](OC(=O)c1cc(O)cs1)C(=O)O	1589579514	TXNJNDZMDXTPPB-ZCFIWIBFSA-N	230.241	1.474	10	20	BDCD	
Cc1cccc(CNC2(CO)CCC2)c1O	162976320	DHUSROPXCDSDHE-UHFFFAOYSA-N	221.300	1.705	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)C1CC1	37080341	CFJVIWHVDKMHFS-UHFFFAOYSA-N	204.273	1.432	10	20	BDCD	
CCCNC(=O)CN[C@@H]1CCc2cccc(O)c21	295856492	GJXLFHLHXOSABU-LLVKDONJSA-N	248.326	1.495	10	20	BDCD	
COc1ccc(N(C)CC[S@@](C)=O)cc1	844356738	WOTQECRFCWFGFI-OAHLLOKOSA-N	227.329	1.510	10	20	BDCD	
CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O	134909900	PSCAYKCELQPJHZ-ZETCQYMHSA-N	210.233	1.971	10	20	BDCD	
Oc1ccccc1CNCCC1(O)CCC1	283815709	CCPZJRVEJFAUPH-UHFFFAOYSA-N	221.300	1.787	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)CCN1	224462404	VEYJWFBZRTVNSX-JTQLQIEISA-N	205.305	1.063	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H]3CNC[C@H]3C2)c1	90320619	RFQOEOYBWYALQB-RYUDHWBXSA-N	248.326	1.052	10	20	BDCD	
CCN(CCCO)C(=O)c1cc(O)cs1	831224581	LUVXBBHSUOLZIX-UHFFFAOYSA-N	229.301	1.298	10	20	BDCD	
C[C@H](CCN)NCc1cccc(Cl)c1O	841052679	VVINBLGSRHCNNJ-MRVPVSSYSA-N	228.723	1.873	10	20	BDCD	
CC(C)C[C@@H](N)C(=O)NCCc1ccc(N)cc1	841847650	FFOUXXVBANSGHB-CYBMUJFWSA-N	249.358	1.301	10	20	BDCD	
C[C@@H](CCCN)NCc1cccc(F)c1O	841081255	RXTFYWRIODOXQX-VIFPVBQESA-N	226.295	1.748	10	20	BDCD	
COC/C(C)=C/C(=O)NCc1cc(C)ccc1O	862755134	OKAUJBXMOVSOEN-YRNVUSSQSA-N	249.310	1.910	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@H]1CCC=CO1	778927882	VSCDMLJNPBPOQE-GFCCVEGCSA-N	249.266	1.407	10	20	BDCD	
Cc1ccc(CNCC2(O)CCC2)c(O)c1	877039769	PTZHRHVPWOZLLI-UHFFFAOYSA-N	221.300	1.705	10	20	BDCD	
C[C@H]1CCC(=O)CN1C(=O)c1cc(O)cs1	885079612	ZBALNFXBTVSBNQ-ZETCQYMHSA-N	239.296	1.647	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@@H]1CCOC[C@H]1O)CC2	706726495	BSQITMFZXUSZIA-NQBHXWOUSA-N	249.310	1.119	10	20	BDCD	
CCN1CCCc2cc(CNCC(=O)O)ccc21	1776876088	ULJFFRICSFLUSJ-UHFFFAOYSA-N	248.326	1.633	10	20	BDCD	
C[C@H](CNC(=O)Cc1ccc(N)cc1)C1CC1	156887491	FTLKJRZOABSVDK-SNVBAGLBSA-N	232.327	1.974	10	20	BDCD	
CCc1noc(Cc2ccc(N)cc2)n1	20005535	OYFUBVQNGFQYKP-UHFFFAOYSA-N	203.245	1.805	10	20	BDCD	in-vitro
Cc1ccc(CN[C@H]2COC[C@@H]2C)c(O)c1	896733136	NCEAHIMOJWIHPD-JQWIXIFHSA-N	221.300	1.825	10	20	BDCD	
CO[C@H]1COC[C@@H]1NCc1cccc(F)c1O	290892873	LKOYPCHSKVXEIF-QWRGUYRKSA-N	241.262	1.035	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)C[C@H]1CO	700439453	SRCMMJHNKODLHX-YPMHNXCESA-N	234.343	1.719	10	20	BDCD	
C[C@@H](CNCc1cc(F)cc(F)c1O)N(C)C	708481109	OGZGCFVJOUUTII-QMMMGPOBSA-N	244.285	1.710	10	20	BDCD	
CC(C)C[C@@H](N)C(=O)Nc1ccc(N)cc1	213967572	UTEQTJKBUJFORV-LLVKDONJSA-N	221.304	1.581	10	20	BDCD	
CNC(=O)[C@H](C)N[C@@H](C)c1cc(C)ccc1O	42561416	UPCQXQGLOBJMJO-UWVGGRQHSA-N	236.315	1.486	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@H](CO)C2)c1	271732849	NMWQQESXPPMKTA-JTQLQIEISA-N	237.299	1.215	10	20	BDCD	
CCN1CCN(Cc2ccccc2O)[C@H](C)C1	289199507	BHKRAAXJNKGRJT-GFCCVEGCSA-N	234.343	1.918	10	20	BDCD	
C[C@@H](NC/C=C\CO)c1cc(F)ccc1O	717573894	AIIHKDDQBHZAPC-PKRMOACSSA-N	225.263	1.730	10	20	BDCD	
CC1=NO[C@H](C(=O)N(C)Cc2ccccc2O)C1	830140976	LEVYGUJEEJODNK-LBPRGKRZSA-N	248.282	1.515	10	20	BDCD	
CC[C@H](C(=O)O)C(=O)NCc1ccccc1O	911332179	XKRMSWRMRPGOFP-VIFPVBQESA-N	237.255	1.119	10	20	BDCD	
O=C(NCc1ccccc1O)C1=CCCCO1	767925273	BHQAMOWXRWGWRG-UHFFFAOYSA-N	233.267	1.703	10	20	BDCD	
COC[C@H]1CN(C(=O)CN=[N+]=[N-])C[C@H]1C	409434037	NYFJDOPLAUFQQR-HTQZYQBOSA-N	212.253	1.038	10	20	BDCD	
CN1C[C@H](CSc2nccs2)OC1=O	1330310877	QCRDBFQJFPJXDO-ZCFIWIBFSA-N	230.314	1.686	10	20	BDCD	
C[C@H]1COC[C@@H]1NC(=O)NCc1ccc(N)cc1	1336978818	VXSUZKAQTHRSOB-CABZTGNLSA-N	249.314	1.103	10	20	BDCD	
CC(C)C[C@@H](N)C(=O)NCc1ccc(N)cc1	1346209409	ISHBSEHRHSZKFD-GFCCVEGCSA-N	235.331	1.258	10	20	BDCD	
C[C@@H](CCO)CN[C@H]1CCc2cccc(O)c21	297529343	DLRNSVXYGKQESH-JQWIXIFHSA-N	235.327	1.988	10	20	BDCD	
Cc1ccc([C@@H](C)NCCO)c(O)c1C	134911040	KUYMPOPFDIGABL-SNVBAGLBSA-N	209.289	1.652	10	20	BDCD	
Cc1cccc(CN2CCOCC2)c1O	32237037	LHZHGLFYRJEUPF-UHFFFAOYSA-N	207.273	1.533	10	20	BDCD	
CCNC(=O)[C@@H](C)NCc1ccc2c(c1)CCO2	37363100	HXXFCZWSUXMNHM-SNVBAGLBSA-N	248.326	1.236	10	20	BDCD	
COc1cccc(CN2CCO[C@H](C)C2)c1O	131952112	JKARMGCLPXXGNV-SNVBAGLBSA-N	237.299	1.622	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1cccc(OC)c1O	294666759	AGKDHZDCNUULQL-NSHDSACASA-N	239.315	1.604	10	20	BDCD	
CC(=O)C(=O)CN(C#N)c1ccccc1	808024859	SLMBKGXEURKLDM-UHFFFAOYSA-N	202.213	1.132	10	20	BDCD	
Oc1cccc2c1[C@@H](NCC[C@H]1CCNC1)CC2	817954820	KUFBECSPYBDVDQ-YPMHNXCESA-N	246.354	1.969	10	20	BDCD	
Cc1cccc(CN(C)[C@@H]2CCNC2)c1O	843049926	YVNSBGLASAPAQX-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
CCC[C@H](O)CC(=O)NCc1ccccc1O	750422812	ARVJJNZVKCTPEX-NSHDSACASA-N	237.299	1.560	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCN(C2CC2)C1	44684079	CIMNARQAPXWVFM-LBPRGKRZSA-N	232.327	1.719	10	20	BDCD	
CCN(CC(=O)OC)Cc1c(C)cccc1O	876686303	USDOCBMFXXNPEX-UHFFFAOYSA-N	237.299	1.696	10	20	BDCD	
NC[C@@H]1CCN(Cc2ccc(N)cc2)C1	1336287254	ZLXCWXROESTOCC-NSHDSACASA-N	205.305	1.049	10	20	BDCD	
CC(C)C[C@H](N)CC(=O)N(C)c1ccc(N)cc1	1522219082	XFAVDHNLPBZUDQ-LBPRGKRZSA-N	249.358	1.995	10	20	BDCD	
COC(=O)CN(C)c1ccc(OC)cc1OC	131606864	HLWDNUYHYJTPAS-UHFFFAOYSA-N	239.271	1.313	10	20	BDCD	
COC(=O)NCc1ccc2c(c1)CCCN2C	169807063	NEKGGTNQIOWZDP-UHFFFAOYSA-N	234.299	1.925	10	20	BDCD	
CN(Cc1ccccc1O)c1nc(C(=O)O)co1	1777076928	VZTBVSOJZDXGNY-UHFFFAOYSA-N	248.238	1.715	10	20	BDCD	
COC[C@H]1CC(F)(F)CN1CCN=[N+]=[N-]	409435076	SFPLYMUCAXRHCJ-SSDOTTSWSA-N	220.223	1.653	10	20	BDCD	
C[C@H](CCO)N[C@H](C)c1ccc(F)cc1O	132564920	FVXYZVVNJUXEBA-RKDXNWHRSA-N	227.279	1.953	10	20	BDCD	
COCCN[C@H]1CCc2cccc(O)c21	379915200	BKZDMIBKDLLAMJ-JTQLQIEISA-N	207.273	1.616	10	20	BDCD	
COc1ccc(O)c(CN(C)C[C@H](C)N)c1	380690639	IPDXWRWKPHKHHS-VIFPVBQESA-N	224.304	1.180	10	20	BDCD	
CNCCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21	817952585	RULDXIWTMGXGDA-PSASIEDQSA-N	238.306	1.889	10	20	BDCD	
C[C@@H](NC[C@@H]1CCN1C)c1ccccc1O	712537137	AMQNDKUIEYUIMF-MNOVXSKESA-N	220.316	1.747	10	20	BDCD	
CS(C)(=O)=NC(=O)c1cc(O)cs1	913640951	APHZOMXLRSJZCT-UHFFFAOYSA-N	219.287	1.322	10	20	BDCD	
C[C@H]1C[C@H](O)CN1Cc1ccccc1O	788268586	GKHCDJNANZDBNI-ONGXEEELSA-N	207.273	1.347	10	20	BDCD	
C[C@H](Nc1cnn(CCO)c1)c1ccccc1O	783527954	KCWWQWYDMQCSGL-JTQLQIEISA-N	247.298	1.754	10	20	BDCD	
CC1(C)CNC(=O)[C@H]1NCc1ccccc1O	895317467	OWOXWLMULGCIJQ-LLVKDONJSA-N	234.299	1.006	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1C[C@H](CO)C1	923006431	CKTCTHUHIJKBLH-MGCOHNPYSA-N	237.299	1.261	10	20	BDCD	
C[C@@H](CN[C@@H](C)c1c(O)cccc1F)C(=O)O	1589067340	JFHPWHRKFCAMCY-YUMQZZPRSA-N	241.262	1.903	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1CO[C@H](C)C1	877607924	OBFIIFDQGUOLJU-GHMZBOCLSA-N	221.300	1.968	10	20	BDCD	
CNC(=O)CN[C@H](C)c1ccc(N(C)C)cc1	37253992	KTOWZTVAZJBOAY-SNVBAGLBSA-N	235.331	1.149	10	20	BDCD	
Oc1ccc(F)cc1CNCC[C@H](O)C1CC1	898204102	OBGNLPWPBDUVMZ-ZDUSSCGKSA-N	239.290	1.782	10	20	BDCD	
CC[C@H](CO)N[C@@H](C)c1cc(OC)ccc1O	20195333	MBOKSNBRCAFLER-VHSXEESVSA-N	239.315	1.822	10	20	BDCD	
CN(CC[C@H]1CCOC1=O)Cc1ccccc1O	120532859	YEHMZRZVOOADNG-NSHDSACASA-N	249.310	1.777	10	20	BDCD	
C[C@@H](c1nnnn1C)N(C)Cc1ccccc1O	189663412	NDQDJBBAFXEJKK-VIFPVBQESA-N	247.302	1.109	10	20	BDCD	
CCN1CC(=O)N[C@H]1c1cccc(Cl)c1O	189862652	SFODHKDZNPTIOC-LLVKDONJSA-N	240.690	1.496	10	20	BDCD	
COC(=O)CN(C)c1ccc2c(c1)OCO2	82713182	HQKIJQILFGGVDE-UHFFFAOYSA-N	223.228	1.025	10	20	BDCD	
CCOc1ccc(O)c(CN(C)CCOC)c1	271046501	QXSVHSFZAFCXOZ-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
CCOCC1(C(=O)NCc2ccc(N)cc2)CC1	297181506	LDGGABFHZHRPPE-UHFFFAOYSA-N	248.326	1.702	10	20	BDCD	
CNCCN[C@@H](C)c1ccc(C)cc1O	817952434	PSKYLHVBYOGTSZ-JTQLQIEISA-N	208.305	1.571	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCC2CNC2)c1	817965389	PWCHNBBLLQLKIZ-SNVBAGLBSA-N	220.316	1.571	10	20	BDCD	
Cc1cccc(CN2CCc3nn[nH]c3C2)c1O	827885393	ZVXIFXHOESUQHG-UHFFFAOYSA-N	244.298	1.377	10	20	BDCD	
COc1cccc(O)c1CNC(CF)CF	824555096	PWAOELBHWDYTNE-UHFFFAOYSA-N	231.242	1.798	10	20	BDCD	
CN1CC[C@H](CNC(=O)c2cc(O)cs2)C1	735688505	XBIIOIHGBROAEY-MRVPVSSYSA-N	240.328	1.135	10	20	BDCD	
C[C@@H](CN)NCc1cc(Cl)cc(F)c1O	841063129	IGXYQTMGCDUSSK-LURJTMIESA-N	232.686	1.622	10	20	BDCD	
CN(C)c1ccc(CN2CC(C)(O)C2)cc1	877581015	KULUWRRQJRONCT-UHFFFAOYSA-N	220.316	1.319	10	20	BDCD	
C[C@H](NCCCCO)c1c(O)cccc1F	886601108	JZEJGFWCZOWVEP-VIFPVBQESA-N	227.279	1.954	10	20	BDCD	
O=C(Nc1ccccn1)c1c(F)ccc(O)c1O	790070208	LKLPMQSEYNPIGT-UHFFFAOYSA-N	248.213	1.884	10	20	BDCD	
C[C@H](N)[C@@H]1CCN(Cc2ccc(N)cc2)C1	1334753479	FFHYEKMCJBSBQH-CMPLNLGQSA-N	219.332	1.438	10	20	BDCD	
Cc1ccc(CN(CC(N)=O)C(C)C)c(O)c1	876539848	RAGNNESGULCSSU-UHFFFAOYSA-N	236.315	1.396	10	20	BDCD	
Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCN	37712541	UNBOJUXYLHSOOU-NXEZZACHSA-N	220.316	1.797	10	20	BDCD	
CO[C@@H](C(=O)N(C)Cc1ccccc1O)C1CC1	280384992	MVYZCUQTBRFYIX-CYBMUJFWSA-N	249.310	1.776	10	20	BDCD	
C[C@H](N[C@H](C)CCO)c1ccccc1O	132432979	HATLBZPDAXAMOR-ZJUUUORDSA-N	209.289	1.814	10	20	BDCD	
COC[C@H](NCc1ccccc1O)C1CC1	133141243	IGVWSLUFJWDLJM-LBPRGKRZSA-N	221.300	1.907	10	20	BDCD	
CC[C@@H](C(=O)OCC(=O)C(C)=O)c1ccccc1	808487298	ZNZBYLPATRGPQC-GFCCVEGCSA-N	248.278	1.882	10	20	BDCD	
CC(C)[C@H](N)CN[C@@H]1CCc2cccc(O)c21	817959137	PODWISYSHDBUES-VXGBXAGGSA-N	234.343	1.952	10	20	BDCD	
CNCCCN[C@H](C)c1cc(F)ccc1O	817940876	ONYIQMLIRZGBDR-SECBINFHSA-N	226.295	1.791	10	20	BDCD	
Cc1cc(O)c(CNC[C@@H](C)O)cc1Cl	825378643	CQRBNXJOESQWQA-MRVPVSSYSA-N	229.707	1.824	10	20	BDCD	
CCOC(=O)CN(C)C(=O)c1cc(O)cs1	732279765	OTAOLKLLAJHZFF-UHFFFAOYSA-N	243.284	1.089	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](N)C2CC2)c1	841048928	GWACTEOHJBZDMK-LBPRGKRZSA-N	220.316	1.528	10	20	BDCD	
C[C@H]1C[C@@H](NCc2cccc(F)c2O)CCN1	841061167	FRFTWNBXPGAIAV-ONGXEEELSA-N	238.306	1.761	10	20	BDCD	
CCc1cccc(CN[C@@H](CC)CO)c1O	691466265	MRKVUKCGOSLPHG-LBPRGKRZSA-N	223.316	1.815	10	20	BDCD	
NCc1ccc2c(c1)CCCN2[C@@H]1CCOC1=O	700926514	QOKZOCBRTKHTMY-CYBMUJFWSA-N	246.310	1.213	10	20	BDCD	
COCCOC(=O)N(C)Cc1ccccc1O	383691215	FFWGVBBYQUZHQA-UHFFFAOYSA-N	239.271	1.607	10	20	BDCD	
CSCCC(=O)Nc1ccc(N)cc1	38063579	DYSRYXKVESVLIQ-UHFFFAOYSA-N	210.302	1.960	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2CCCNCC2)cc1	370016829	CQXNPOWUGNVYBN-ZDUSSCGKSA-N	247.342	1.070	10	20	BDCD	
Cc1cc(C(=O)NCc2ccccc2O)no1	77613755	HWOGWTRGBBPCGU-UHFFFAOYSA-N	232.239	1.619	10	20	BDCD	
CNC(=O)CCNCc1ccc(OC)c(C)c1	44990160	DXVUHRQWNDWSMG-UHFFFAOYSA-N	236.315	1.229	10	20	BDCD	
CC[C@@H](O)CNCc1ccc(OC)c(C)c1	229969011	FLDRMTRCODXQPP-GFCCVEGCSA-N	223.316	1.864	10	20	BDCD	
C[C@@H](O)CNCc1c(O)cccc1Cl	83551130	ONWIJCDMVUKNTL-SSDOTTSWSA-N	215.680	1.516	10	20	BDCD	
C[C@@H](N)CN[C@H](C)c1ccc(F)cc1O	817972233	KLTCAIXGKILTEB-HTQZYQBOSA-N	212.268	1.529	10	20	BDCD	
CC(=O)C(=O)CSc1nc2c([nH]1)CCC2	813582566	PSVXQVWAPVZFST-UHFFFAOYSA-N	224.285	1.149	10	20	BDCD	
C[C@H](CSc1nccs1)S(C)(=O)=O	829100362	QMMKIZJGYZXPFI-ZCFIWIBFSA-N	237.371	1.668	10	20	BDCD	
NC1(CNCc2cc(Cl)ccc2O)CC1	904448624	ANEDOZLMEAYVPR-UHFFFAOYSA-N	226.707	1.627	10	20	BDCD	
CCNC(=S)N(C)Cc1ccccc1O	917581642	MBWYXNVRDRTECB-UHFFFAOYSA-N	224.329	1.718	10	20	BDCD	
CCNCCNCc1cccc(OCC)c1O	841034585	AEVZNDNTLYQRQI-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
C[C@@]1(CN)CCN(Cc2cccc(F)c2O)C1	843116309	KIPXASARFMCLMW-ZDUSSCGKSA-N	238.306	1.702	10	20	BDCD	
CC[C@@H](O)CNCc1cc([N+](=O)[O-])ccc1O	850374033	UFVSPXGBFBURLK-SNVBAGLBSA-N	240.259	1.161	10	20	BDCD	
CCOc1ccc(N(C)Cc2ncnn2C)cc1	750047143	JFMBWYYBRJGTMO-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
COCCNCc1ccc(OC)c(OC)c1O	892429897	UGBGLKAYLYUPJX-UHFFFAOYSA-N	241.287	1.145	10	20	BDCD	
CCOC(=O)C[C@@H]1CNc2ccccc2N1	34453102	RJOAMELXRNIPRB-SECBINFHSA-N	220.272	1.846	10	20	BDCD	
COC(=O)CCN[C@H](C)c1ccccc1O	36891782	RUMIMTIWHAQXGU-SECBINFHSA-N	223.272	1.606	10	20	BDCD	
N#Cc1ccc(=NCc2ccccc2O)[nH]n1	396947639	NEAQWEXVGWGGDG-UHFFFAOYSA-N	226.239	1.088	10	20	BDCD	
COc1cccc(CNc2nnc(C)o2)c1O	287960588	QXUGAKSKESUEKW-UHFFFAOYSA-N	235.243	1.704	10	20	BDCD	
C[C@@H]1C[C@H](NCCc2ccc(N)cc2)CCO1	817956435	YYPPZWLLNXKDNF-BXUZGUMPSA-N	234.343	1.968	10	20	BDCD	
C[C@H](CNCc1cc(F)ccc1O)C(=O)O	848638861	WZPOWTOVFDQEDL-SSDOTTSWSA-N	227.235	1.342	10	20	BDCD	
CO[C@H](C)c1nc(Cc2ccc(N)cc2)no1	843159181	MBJYNFRVAJVIKU-MRVPVSSYSA-N	233.271	1.950	10	20	BDCD	
C[C@@H]1C[C@@H]1C(=O)NCc1ccc(O)cc1O	910957808	NPMDRDDCTZBCSB-XCBNKYQSSA-N	221.256	1.370	10	20	BDCD	
C[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)C1	841956486	FTDIDEVLDZUFIO-NSHDSACASA-N	247.342	1.863	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCCN2C)C(=O)O	50286861	QVKDQAPNPPGMPI-JTQLQIEISA-N	248.326	1.632	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCC[C@@H]1N	85369288	DZEDWCYIEFSKNI-NEPJUHHUSA-N	248.326	1.478	10	20	BDCD	
COc1ccc(CNC(=O)C2=COCC2)c(O)c1	794390380	IZYZDXAATIEUMP-UHFFFAOYSA-N	249.266	1.321	10	20	BDCD	
C[C@@H](O)CN[C@H](C)c1ccc(F)c(F)c1O	187813786	ONJAIXBLYYSIQM-RNFRBKRXSA-N	231.242	1.702	10	20	BDCD	
C[C@]1(C(=O)NCc2ccccc2O)CCCNC1	166202776	FZNFDBSJFSWLJW-AWEZNQCLSA-N	248.326	1.398	10	20	BDCD	
Nc1ccc(CN2CCC[C@@H](CO)C2)cc1	36205779	PRZDDEKNIZYWLX-GFCCVEGCSA-N	220.316	1.473	10	20	BDCD	
CCN1C[C@@H](NCc2cc(C)ccc2O)CC1=O	391601110	JSXTZGQZPLYNTE-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
OC[C@H]1CCCN(Cc2ccccc2O)C1	124984806	VWOKGBNPRSQDFQ-NSHDSACASA-N	221.300	1.597	10	20	BDCD	
CN(CCn1cccn1)Cc1ccc(N)cc1	49314791	LHOHMZRWAFAIDS-UHFFFAOYSA-N	230.315	1.597	10	20	BDCD	
CCCn1ncnc1CN(C)c1ccc(N)cc1	88595627	FIJOAQPZPJBZTI-UHFFFAOYSA-N	245.330	1.907	10	20	BDCD	
CCOC[C@H](C)NCc1cc(OC)ccc1O	44690563	LKLRNRVPMMIZBX-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
CCOc1cccc(CN(CC)CCO)c1O	270986580	GHDNMUFNGFHNTH-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
C[C@@H]1CCNC[C@@H]1NCCc1ccc(N)cc1	817957617	NGHUBLSRBYLLIF-RISCZKNCSA-N	233.359	1.399	10	20	BDCD	
NC(=O)CCNCc1ccc(N2CC=CC2)cc1	819095767	TZNPNUOGPYXZBV-UHFFFAOYSA-N	245.326	1.028	10	20	BDCD	
N[C@H](CN[C@@H]1CCc2cccc(O)c21)C1CC1	817964769	HJHGBZGWEIIBHN-VXGBXAGGSA-N	232.327	1.706	10	20	BDCD	
CC[C@@H](O)CNCc1ccc(N2CC=CC2)cc1	819096274	LMDPSAHBUUYTPJ-OAHLLOKOSA-N	246.354	1.923	10	20	BDCD	
C[C@@H]1OCC[C@H]1C(=O)N[C@H](C)c1ccccc1O	827940334	AWBVTEWEMKHXSR-JFGNBEQYSA-N	249.310	1.994	10	20	BDCD	
C[C@H](N)C[C@@H](C)NCc1cc(F)ccc1O	843127422	DGHDTVQYNBBWRQ-DTWKUNHWSA-N	226.295	1.747	10	20	BDCD	
Nc1ccc(Cc2nc([C@H]3CCCN3)no2)cc1	842644275	UMDVFIUNBUWNPY-LLVKDONJSA-N	244.298	1.667	10	20	BDCD	
C[C@@H](N)CN(C)Cc1ccc(N(C)C)c(F)c1	863653556	NDDMIJJOBOUQCC-SNVBAGLBSA-N	239.338	1.671	10	20	BDCD	
C[C@@H]1OCCN(C(=O)c2cc(O)cs2)[C@H]1C	768258306	OAUGQKPDNDRFKY-YUMQZZPRSA-N	241.312	1.703	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@H]2C[C@H]2C1	862558311	LPQORGGHVMINQT-KNVOCYPGSA-N	209.270	1.546	10	20	BDCD	
C[C@H](NC[C@H]1C[C@H](N)C1)c1ccccc1O	873257993	WNBKXIXRKZEJIZ-DCAQKATOSA-N	220.316	1.780	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2cncc(F)c2)C1	409423855	QOSSWUKVHKSRKE-UHFFFAOYSA-N	221.195	1.355	10	20	BDCD	
Nc1ccc(CNCCCn2ccnc2)cc1	83357552	KJJNWOWHOCQFNJ-UHFFFAOYSA-N	230.315	1.645	10	20	BDCD	
NCc1ccc2c(c1)CCCN2CCF	700923646	LUQCFFCXGHXCGL-UHFFFAOYSA-N	208.280	1.867	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1=CCCC1	1347542667	PQPQLWJLKRDPGU-UHFFFAOYSA-N	233.267	1.824	10	20	BDCD	
CC(C)(NC(=O)c1cc(O)cs1)C(=O)O	1602952072	OQXBNDOKXJECQG-UHFFFAOYSA-N	229.257	1.047	10	20	BDCD	
C[C@H](N)[C@@H](C)C(=O)N(C)Cc1ccccc1O	156655140	AONQCUZCVVNYFQ-ZJUUUORDSA-N	236.315	1.334	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@@H](O)C2)c1O	294846638	NALOOAHEUMJXII-PHIMTYICSA-N	207.273	1.314	10	20	BDCD	
Oc1ccccc1CN[C@H]1C[C@H]2CC[C@H]1NC2	530245699	CDCFCGLVSUQDDH-RTXFEEFZSA-N	232.327	1.622	10	20	BDCD	
CC[C@@H](CO)NCc1cccc(OC)c1O	20195049	VCRWLFYNVIOENQ-JTQLQIEISA-N	225.288	1.261	10	20	BDCD	
COc1cccc(CNC(=O)C(C)C)c1O	68488768	CNOVQCPGQLSUMH-UHFFFAOYSA-N	223.272	1.673	10	20	BDCD	
Cc1ccc(O)c(CNCC2(CO)CC2)c1	118906770	AVTDHBGLNVEFFV-UHFFFAOYSA-N	221.300	1.563	10	20	BDCD	
Cc1ccc(C(=O)NCC2CC2)c(O)c1O	177668156	AOFZHWMEGLEHKM-UHFFFAOYSA-N	221.256	1.546	10	20	BDCD	
COC[C@H](C)CNC(=O)c1cccc(O)c1O	126366422	RTPRUBKXIYCSBI-MRVPVSSYSA-N	239.271	1.110	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H]2CCNC2)c1	817944712	KCWUSYLFTCGDRP-UWVGGRQHSA-N	236.315	1.413	10	20	BDCD	
CC(C)CCNC(=O)C(=O)Nc1ccc(N)cc1	840999917	NPXVNMSOWSLEJQ-UHFFFAOYSA-N	249.314	1.370	10	20	BDCD	
C[C@@H]1CCCN1C(=O)C(=O)Nc1ccc(N)cc1	841055431	VLOYTKIVTLFDHO-SECBINFHSA-N	247.298	1.218	10	20	BDCD	
C[C@H](CCO)CNC(=O)c1cc(O)cs1	760178632	UTYKRQVDQQGSKS-SSDOTTSWSA-N	229.301	1.202	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC[C@@H](CF)C1	881669329	UDDFBHWLMKXXJX-ZETCQYMHSA-N	229.276	1.885	10	20	BDCD	
OC[C@@H](CCF)NCc1cc(F)cc(F)c1O	883158559	KRHDVRKFHIVIAH-SECBINFHSA-N	249.232	1.481	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@H]2CCC(F)(F)[C@@H]2C1	409426070	HLEPWQXJXGSQGM-RNFRBKRXSA-N	230.218	1.800	10	20	BDCD	
C[C@H](O)CCCOC(=O)c1cccc(O)c1O	795595979	XYALWSAXCNZBGV-QMMMGPOBSA-N	240.255	1.416	10	20	BDCD	
C[C@H](Sc1ncc([N+](=O)[O-])s1)[C@@H](C)O	194946410	JCKJOVBYYNPLFS-UHNVWZDZSA-N	234.302	1.913	10	20	BDCD	
Cc1cnc(NCCc2ccc(O)c(O)c2)nc1	758169463	QEBLSJJFLAXPHE-UHFFFAOYSA-N	245.282	1.851	10	20	BDCD	
C[C@H](NCc1ccccc1O)C1(CO)CC1	696035640	WTCWSEOIAFIWET-JTQLQIEISA-N	221.300	1.643	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C2(CO)CC2)c1	696064924	XSVHOHWKKJXLQT-NSHDSACASA-N	235.327	1.951	10	20	BDCD	
COc1cccc(O)c1CNCCC[C@@H](C)O	788524829	VQPLOHZJKRAACG-SNVBAGLBSA-N	239.315	1.651	10	20	BDCD	
C[C@@H](NCc1cc(Cl)c(F)cc1O)C(=O)O	1261661101	GEPXAOQPVYAVBQ-RXMQYKEDSA-N	247.653	1.747	10	20	BDCD	
COC(=O)c1cnc(SCC(=O)O)s1	1599009729	UXMYRYJNRISIAJ-UHFFFAOYSA-N	233.270	1.106	10	20	BDCD	
COc1ccc(CNCC(=O)NC2CC2)cc1C	35257367	BEDMBMONNIPUNA-UHFFFAOYSA-N	248.326	1.372	10	20	BDCD	
COc1ccc(N(C)CC(=O)N2CCC2)cc1	844353265	JQLYCCZZKSDAIU-UHFFFAOYSA-N	234.299	1.364	10	20	BDCD	
COCC(COC)N(C)Cc1ccccc1O	702105708	ABJIGTOXECCNCT-UHFFFAOYSA-N	239.315	1.485	10	20	BDCD	
CC(C)(CN)CC(=O)NCc1ccccc1O	721206120	WSDXVJLMSFNLDM-UHFFFAOYSA-N	236.315	1.383	10	20	BDCD	
Oc1ccccc1CNC[C@@H]1CCOC1	37738031	AUFJXIPUDALONE-JTQLQIEISA-N	207.273	1.518	10	20	BDCD	
Cc1ccc([C@@H](C)NCc2ncn(C)n2)c(O)c1	186214535	QFLBBUNOBHICRC-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
C[C@H](NCCF)c1cc([N+](=O)[O-])ccc1O	280873984	AJPZRDWMSPVGCV-ZETCQYMHSA-N	228.223	1.921	10	20	BDCD	
C[C@@H](CNCc1cc(F)ccc1O)N(C)C	226619571	DJMXUNIXBOLXHS-VIFPVBQESA-N	226.295	1.571	10	20	BDCD	
FCCn1ncnc1CSc1nccs1	281461956	MRQQPNHZNWDYDE-UHFFFAOYSA-N	244.320	1.996	10	20	BDCD	
Oc1c(F)cc(F)cc1CNCCF	708557838	CCGZNIWEISAKQW-UHFFFAOYSA-N	205.179	1.730	10	20	BDCD	
CS/C=C\C(=O)NCCc1ccc(N)cc1	818545214	PIZXWKTVXONMEO-CLFYSBASSA-N	236.340	1.804	10	20	BDCD	
C[C@@H](NC[C@H]1CCN1C)c1ccccc1O	712537136	AMQNDKUIEYUIMF-GHMZBOCLSA-N	220.316	1.747	10	20	BDCD	
Cc1cc(O)c(CN2CCC[C@@H](N)C2)cc1C	843043843	KYSYDQWGRCJGLV-CYBMUJFWSA-N	234.343	1.932	10	20	BDCD	
CC(C)(CCO)CNC(=O)c1cc(O)cs1	746290441	LLJBJWQIUTWBON-UHFFFAOYSA-N	243.328	1.592	10	20	BDCD	
C[C@@H](CCO)CNC(=O)c1cc(O)cs1	760178634	UTYKRQVDQQGSKS-ZETCQYMHSA-N	229.301	1.202	10	20	BDCD	
C[C@H](N[C@@H]1CCOC1)c1c(O)cccc1F	886554747	BICCFANHUVTQOJ-DTWKUNHWSA-N	225.263	1.971	10	20	BDCD	
C[C@H](CO)NCc1cc(F)cc(F)c1O	708389561	LTAFLWBOIUDUQJ-ZCFIWIBFSA-N	217.215	1.141	10	20	BDCD	
CCN(C[C@@H](C)O)c1ccc(OC)c(OC)c1	799129865	XQXHFAWLWXSWPE-SNVBAGLBSA-N	239.315	1.911	10	20	BDCD	
C/C(=C\CNC(=O)c1cc(O)cs1)C(=O)O	1602971813	HELZCGHLTQJGIZ-QHHAFSJGSA-N	241.268	1.214	10	20	BDCD	
CC[C@@H](C(=O)O)N(C)Cc1ccc(C)cc1O	1589443479	JTJKMAZRUXVLMT-NSHDSACASA-N	237.299	1.996	10	20	BDCD	
Cc1ccc(CNCCC(=O)N(C)C)c(O)c1	876989808	GPGWQMZJSUPBNK-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
Oc1ccc(I)cc1O	96102508	GEQUYGQAOAAGGO-UHFFFAOYSA-N	236.008	1.702	10	20	BDCD	
C[C@H]1C[C@@H](N)CN1Cc1ccc(N(C)C)cc1	702668275	JJOZGPLCTDLMAC-WCQYABFASA-N	233.359	1.674	10	20	BDCD	
CC(C)(CN)C(=O)Nc1ccc(N)cc1	381552996	NIMKPRFWEFDOJL-UHFFFAOYSA-N	207.277	1.192	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](CO)C2CC2)c1	776176981	HDTFAGCSZVLGJJ-LBPRGKRZSA-N	237.299	1.261	10	20	BDCD	
Cc1cccc(O)c1CNC1CSC1	877633940	AUCRHOWZCGBAIW-UHFFFAOYSA-N	209.314	1.906	10	20	BDCD	
CCN(CCN)Cc1cc(OC)ccc1O	300832958	PBYXWSMQKOCCQH-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
Cc1cc(O)c(CN(C)C[C@H](C)O)cc1C	130759256	XJLJNKCEEOKFAX-NSHDSACASA-N	223.316	1.822	10	20	BDCD	
O=C(CC1CCOCC1)NCc1ccccc1O	265365875	UUBKQXLCIBGMIY-UHFFFAOYSA-N	249.310	1.825	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@H]1C[C@@H](O)C1)CC2	296013471	RHOLVERVFLHICK-AXFHLTTASA-N	219.284	1.492	10	20	BDCD	
CC[C@H](CO)N(C)Cc1cccc(OC)c1O	294666755	AGKDHZDCNUULQL-LLVKDONJSA-N	239.315	1.604	10	20	BDCD	
O=C(CO)NCc1ccc(N2CCCCC2)cc1	822818974	LSNSFENRTGOXFY-UHFFFAOYSA-N	248.326	1.285	10	20	BDCD	
C[C@H]1CCCN1C(=O)C(=O)Nc1ccc(N)cc1	841055432	VLOYTKIVTLFDHO-VIFPVBQESA-N	247.298	1.218	10	20	BDCD	
Nc1ccc(NC[C@]23CNC[C@H]2C3)cc1	853246859	VIAKOCKKIUMRLO-SKDRFNHKSA-N	203.289	1.290	10	20	BDCD	
CC[C@H](O)CCCNC(=O)c1cc(O)cs1	761570760	BDPRNRXLSFPWBV-QMMMGPOBSA-N	243.328	1.735	10	20	BDCD	
CCOc1ccc(O)c(CNC2(C)COC2)c1	877691563	RKNPYXLPUULOSU-UHFFFAOYSA-N	237.299	1.669	10	20	BDCD	
CCc1cccc(CN2C[C@H](C)[C@H](O)C2)c1O	897680529	SGAMOMRIGLTCBV-GXFFZTMASA-N	235.327	1.767	10	20	BDCD	
CCn1nc2c(c1CCN=[N+]=[N-])COCC2	409437753	IKKBPBMHHTYANH-UHFFFAOYSA-N	221.264	1.829	10	20	BDCD	
C[C@H]1OCC[C@H]1C(=O)N(C)Cc1ccccc1O	92500822	PVVWFDUAWMGQHE-ZYHUDNBSSA-N	249.310	1.776	10	20	BDCD	
NC[C@@H]1CCCN(Cc2ccc(N)cc2)C1	1335285334	NPOJPRKLPHKIQG-LBPRGKRZSA-N	219.332	1.440	10	20	BDCD	
CCO[C@H](C)C(=O)NCc1cccc(O)c1O	1347530425	BCTDSDMSKCJZHW-MRVPVSSYSA-N	239.271	1.139	10	20	BDCD	
CCN1CCc2cc(CN[C@H](C)C(=O)O)ccc21	1776877623	JKSKTWFBAJAPBR-SNVBAGLBSA-N	248.326	1.632	10	20	BDCD	
CCN1CCc2cc(CN[C@@H](C)C(=O)O)ccc21	1776877719	JKSKTWFBAJAPBR-JTQLQIEISA-N	248.326	1.632	10	20	BDCD	
COc1ccc(N(C)CCN)cc1OC	20239324	GXCSEAUYAFVZSI-UHFFFAOYSA-N	210.277	1.099	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)CC(N)=O	877094856	UWNYBMFZFJVICU-SECBINFHSA-N	222.288	1.054	10	20	BDCD	
COC[C@](C)(O)CNCc1cc(F)ccc1O	382583596	ZBIZPCYYYCKFAN-GFCCVEGCSA-N	243.278	1.018	10	20	BDCD	
COc1cccc(CNC2([C@@H](C)O)CC2)c1O	827579945	MOIAUYWMGKSNME-SECBINFHSA-N	237.299	1.404	10	20	BDCD	
COC(=O)[C@@H]1C[C@@H]1C(=O)Nc1ccc(N)cc1	832249935	GOASNSJDWREBBV-VHSXEESVSA-N	234.255	1.016	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCCOC2)cc1	62192578	MYVQBBZNGRWRTK-VIFPVBQESA-N	220.272	1.634	10	20	BDCD	
COC[C@H](C)NCc1ccc(C)cc1O	83345898	JFVPBQSRTLPTTJ-JTQLQIEISA-N	209.289	1.825	10	20	BDCD	
Cc1cccc(CN2CC(=O)N[C@@H](C)C2)c1O	295091657	TXNVJZTUBNYNCH-JTQLQIEISA-N	234.299	1.021	10	20	BDCD	
C[C@@H]1[C@H](C(=O)NCc2ccccc2O)CCN1C	825658051	AVHPYKHBICOPQU-ZYHUDNBSSA-N	248.326	1.349	10	20	BDCD	
NC1(CNCc2cc(F)ccc2O)CC1	904449573	KTWRFPKSRGLWHK-UHFFFAOYSA-N	210.252	1.112	10	20	BDCD	
CN(C)c1ccc(CN2CCn3ccnc32)cc1	931519917	IOMMYAZGCYFGKD-UHFFFAOYSA-N	242.326	1.969	10	20	BDCD	
Cc1cccc(O)c1CN(C)CCCO	877499179	MBNQDTFPOIJNBO-UHFFFAOYSA-N	209.289	1.515	10	20	BDCD	
Cc1cccc(O)c1CNCC[C@@H](O)C1CC1	898198237	OZBMFTIOWMKYOF-CYBMUJFWSA-N	235.327	1.951	10	20	BDCD	
CCN1C[C@@H](N[C@H](C)c2ccccc2O)CC1=O	391595232	HINVPNHIUZEKSQ-MNOVXSKESA-N	248.326	1.664	10	20	BDCD	
CC[C@H](CO)NCc1cc(OC)ccc1O	20196167	GWSXSDQVXBPGMQ-SNVBAGLBSA-N	225.288	1.261	10	20	BDCD	
Cc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1O	183374432	BBTFGSMVRPAYQQ-GFCCVEGCSA-N	248.326	1.398	10	20	BDCD	
C[C@@H](C(=O)O)N(C)Cc1c(O)cccc1Cl	128815890	GLKBRMHMDGBSRV-ZETCQYMHSA-N	243.690	1.951	10	20	BDCD	
C[C@@H](NCCn1ccnc1)c1ccccc1O	41119234	HZFUMHDAWLPZMN-LLVKDONJSA-N	231.299	1.940	10	20	BDCD	
CN(CCC(=O)O)Cc1cc(Cl)ccc1O	83410126	UHMXPIORVHXACZ-UHFFFAOYSA-N	243.690	1.952	10	20	BDCD	
C[C@H](NCCN(C)C)c1cc(F)ccc1O	87111295	YZYDETNOFAPVGI-VIFPVBQESA-N	226.295	1.744	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](C)[C@H](CO)C2)c1	191721889	LOQXAIQCHNDMTO-YPMHNXCESA-N	235.327	1.761	10	20	BDCD	
Cc1cccc(CN(C)[C@H](C)CO)c1O	289488547	RJAXZRIMQPSCPA-SNVBAGLBSA-N	209.289	1.513	10	20	BDCD	
CC(C)(C)[C@@H](CN)NC(=O)Cc1ccc(N)cc1	841854893	BRFJEMBAFOEUIL-GFCCVEGCSA-N	249.358	1.301	10	20	BDCD	
COc1cccc(CN2C[C@H]3C[C@@H]3C2)c1O	862439956	CINGKJBOMQNAFS-GHMZBOCLSA-N	219.284	1.853	10	20	BDCD	
CCN(CCC(=O)O)Cc1ccc(C)cc1O	1605442983	KHLFAHURTSMZQH-UHFFFAOYSA-N	237.299	1.997	10	20	BDCD	
CN(CCF)C(=O)c1cccc(O)c1O	293796891	DARMEPUAWWNNJF-UHFFFAOYSA-N	213.208	1.139	10	20	BDCD	
CC[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(N)=O	379212071	FJHDJWYREYHCFS-GWCFXTLKSA-N	249.358	1.667	10	20	BDCD	
CCc1n[nH]c(NC(=O)c2cccc(O)c2O)n1	193135702	FNNMYDGPSXDRDR-UHFFFAOYSA-N	248.242	1.031	10	20	BDCD	
CC[C@H](C)[C@H](N)C(=O)NCc1ccc(N)cc1	83362626	RVLJXOCVKMIDBW-CABZTGNLSA-N	235.331	1.258	10	20	BDCD	
CC[C@@H](N[C@H](C)CO)c1ccc(F)cc1O	285960520	GPDUZKMPVIDDQG-LDYMZIIASA-N	227.279	1.953	10	20	BDCD	
C[C@H](C(=O)NCCc1ccc(N)cc1)C1CC1	148759626	OSXSUIMCEFTKTB-JTQLQIEISA-N	232.327	1.974	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2N)cc1	294643784	BKNBPBCUFFCEJY-VDUILEQBSA-N	245.326	1.581	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCC[N+](=O)[O-]	905121297	CJMGBMBNSGDROA-UHFFFAOYSA-N	237.303	1.427	10	20	BDCD	
NC1(CNCc2c(O)cccc2Cl)CC1	904449882	MMOVWTDOHQDACO-UHFFFAOYSA-N	226.707	1.627	10	20	BDCD	
Cc1cc(CN2C[C@@H](N)[C@H](C)C2)ccc1N(C)C	923366136	JUERLLQJZJKZRZ-TZMCWYRMSA-N	247.386	1.840	10	20	BDCD	
C[C@H](NC(N)=O)c1ccc(N2CCOCC2)cc1	920867163	OHVGJSGYQBBPLM-JTQLQIEISA-N	249.314	1.253	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H]2C[C@]2(CO)C1	783735430	QEODIIAWHJBMJX-IINYFYTJSA-N	249.310	1.215	10	20	BDCD	
CN(C)c1ccc(CN(C)[C@H]2CCNC2)cc1	71309447	QMCQQNNGSVMTRU-AWEZNQCLSA-N	233.359	1.546	10	20	BDCD	
CCNC(=O)CSc1nccs1	71970633	IMCFAMPRTHKEIJ-UHFFFAOYSA-N	202.304	1.371	10	20	BDCD	
CCN1CCN(Cc2ccccc2O)[C@@H](C)C1	289199509	BHKRAAXJNKGRJT-LBPRGKRZSA-N	234.343	1.918	10	20	BDCD	
Oc1ccccc1CN1CC[C@H]2CC[C@@H](C1)N2	132222051	RRIDUCTXKCYAPD-OLZOCXBDSA-N	232.327	1.719	10	20	BDCD	
CN1CCC(CNCc2ccccc2O)CC1	44515429	BEDWZADRMIUJRB-UHFFFAOYSA-N	234.343	1.824	10	20	BDCD	
CCOC1CC(C(=O)NCc2ccccc2O)C1	287254397	GMESVGSHMLBSFP-UHFFFAOYSA-N	249.310	1.824	10	20	BDCD	
C[C@H](N[C@H](CO)CCF)c1ccccc1O	846207675	BCJSORLFVRDVDB-UWVGGRQHSA-N	227.279	1.763	10	20	BDCD	
CN(C)c1ccc(CNC(=N)N2CCC2)cc1	848982333	HVIIJJZJNLMOPE-UHFFFAOYSA-N	232.331	1.483	10	20	BDCD	
CC(C)OC(=O)COC(=O)c1cc(O)cs1	1116023115	DJKLRMYPDWTOLU-UHFFFAOYSA-N	244.268	1.562	10	20	BDCD	
N=C(NCc1ccccc1O)NC1CCCC1	66245225	ZMRUZBRZMLOJAJ-UHFFFAOYSA-N	233.315	1.949	10	20	BDCD	
C[C@H](NCCCCN)c1ccc(F)cc1O	62747664	YGKWSIMZICHLIR-VIFPVBQESA-N	226.295	1.921	10	20	BDCD	
Nc1ccc(CCNC(=O)C[C@H]2CCCO2)cc1	87206664	YNAIJIRQOMXWDG-CYBMUJFWSA-N	248.326	1.497	10	20	BDCD	
COC[C@H](C)N1CCCc2cc(CN)ccc21	700879618	OJKQPAWWOHWKSY-NSHDSACASA-N	234.343	1.933	10	20	BDCD	
C[C@@H](CO)NCc1c(O)ccc(Cl)c1F	191224791	MDFZEDNZDMQQOY-LURJTMIESA-N	233.670	1.655	10	20	BDCD	
Cc1ccc(CN(C)CCCC(=O)O)c(O)c1	1605273295	YLGVIBDOQFSLLE-UHFFFAOYSA-N	237.299	1.997	10	20	BDCD	
CN[C@@H](C)CCNCc1ccccc1O	1327414736	DPXIYZJAGGVZDG-JTQLQIEISA-N	208.305	1.480	10	20	BDCD	
CN(C)CC1(C(=O)NCc2ccc(N)cc2)CC1	1341924565	XQVOLGAZQFSWBX-UHFFFAOYSA-N	247.342	1.227	10	20	BDCD	
Cc1cccc(CNC(C)(C)CCO)c1O	162644296	YXGVVBJWWJVZDK-UHFFFAOYSA-N	223.316	1.951	10	20	BDCD	
CC(C)OCCNC(=O)Nc1ccc(N)cc1	160591294	YDTZQZVIOCBACB-UHFFFAOYSA-N	237.303	1.815	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CC[C@H]1N	832736872	FIQGNKIABHFZIO-ZWNOBZJWSA-N	247.342	1.007	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H]1CCCO1	876890189	WVACMIWOMZWSEF-NSHDSACASA-N	221.300	1.969	10	20	BDCD	
CC[S@](=O)CCNCc1ccc(C)cc1O	877041835	PIGYRAFWOYOVIW-INIZCTEOSA-N	241.356	1.559	10	20	BDCD	
CC[C@@H](NCc1c(C)cccc1O)[C@H](C)O	877569076	ZJOJPWFWQPXVHP-CMPLNLGQSA-N	223.316	1.950	10	20	BDCD	
CCNC(=O)[C@@H](C)N[C@@H]1CCc2cccc(O)c21	295778208	ARVMKWNVMYQGMP-MWLCHTKSSA-N	248.326	1.494	10	20	BDCD	
CCCN1CC[C@@H](NCc2ccccc2O)C1	328527888	VNHPPVJJUIVGEQ-CYBMUJFWSA-N	234.343	1.966	10	20	BDCD	
CC1(CNCc2cc(F)ccc2O)COC1	226608272	OQYMGYSKCMPEHJ-UHFFFAOYSA-N	225.263	1.657	10	20	BDCD	
Cc1cccc(CN(C)CC(C)(C)O)c1O	271875392	SZBCRUCVDNVFHD-UHFFFAOYSA-N	223.316	1.903	10	20	BDCD	
C[C@H](NC[C@@H]1CCN1C)c1ccccc1O	712537139	AMQNDKUIEYUIMF-QWRGUYRKSA-N	220.316	1.747	10	20	BDCD	
CC1=NO[C@@H](C(=O)N[C@H](C)c2ccccc2O)C1	827952068	FNSDGPYNVXWEON-BXKDBHETSA-N	248.282	1.734	10	20	BDCD	
CCc1cccc(CN2CC[C@H](CO)C2)c1O	848886136	TWAVOVCSVUHBQF-NSHDSACASA-N	235.327	1.769	10	20	BDCD	
C[C@H](O)CCN(C)Cc1cc(F)cc(F)c1O	894033276	FVYAGUFHOPCPAA-QMMMGPOBSA-N	245.269	1.873	10	20	BDCD	
CC(C)(C)[C@H](NCc1ccccc1O)C(=O)O	395664336	FMVSEIYDPZOWEB-LLVKDONJSA-N	237.299	1.981	10	20	BDCD	
OCC1(CCNCc2ccccc2O)CC1	395787899	CEBOLZNKDNRHNO-UHFFFAOYSA-N	221.300	1.644	10	20	BDCD	
COC/C=C\C(=O)N(C)Cc1ccccc1O	791384674	CLHAFDOXXCYFFO-YVMONPNESA-N	235.283	1.553	10	20	BDCD	
CC(=O)Nc1c(Cl)ccc2nonc12	1323415837	BHYRSSVBCYPCOW-UHFFFAOYSA-N	211.608	1.835	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1ccc(Cl)cc1O	1599886138	CBIPBPBYIQQPBQ-SSDOTTSWSA-N	243.690	1.951	10	20	BDCD	
COc1cccc(CNCC[C@@H](C)OC)c1O	263831258	VINWYZUYBITWRJ-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
CC[C@@H](CNCc1cccc(OC)c1O)OC	289926691	VTYQZGNYRCPMLM-NSHDSACASA-N	239.315	1.915	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](N)[C@@H](C)C2)c1	227054728	OAVBSIDBEVAXJY-WCQYABFASA-N	234.343	1.870	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](C)C(=O)O)c1	1346531840	RVURVEPUXQQXNT-QMMMGPOBSA-N	239.271	1.211	10	20	BDCD	
CCN(CC(=O)OC)Cc1ccc(N)cc1	35361331	MXXPJDNYXDZHOI-UHFFFAOYSA-N	222.288	1.264	10	20	BDCD	
C[C@H]1CN(c2ccc(N)cc2)CC[C@H]1O	253203832	VLDZSYJUOOYEJH-JOYOIKCWSA-N	206.289	1.476	10	20	BDCD	
CO[C@@H]1CCCN(c2ccc(N)cc2)C1	230219980	OXXGGOPASQGSDZ-GFCCVEGCSA-N	206.289	1.884	10	20	BDCD	
c1cn(CCNCc2ccc3c(c2)CCO3)cn1	41066156	BGHABWHHVWTGSZ-UHFFFAOYSA-N	243.310	1.608	10	20	BDCD	
C[C@@H](Cn1cccn1)NCc1cc(F)ccc1O	226584449	HIOGFBIBMFTSDS-JTQLQIEISA-N	249.289	1.906	10	20	BDCD	
Cc1cccc(CN2CC[C@H](CO)C2)c1O	132498533	IHBUAVIEQVTPEP-NSHDSACASA-N	221.300	1.515	10	20	BDCD	
C[C@@H](NCC(C)(C)N)c1ccccc1O	139130677	QPJXFTPYOACMNH-SECBINFHSA-N	208.305	1.780	10	20	BDCD	
NCCNCc1ccc(Br)cc1O	700973543	IUYXBLNXGGLNQK-UHFFFAOYSA-N	245.120	1.203	10	20	BDCD	
Cc1ccc([C@@H](C)NC/C=C\CO)c(O)c1	717531292	DPJUROGCWZQKRK-DLRQAJBASA-N	221.300	1.900	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@@H](C)CN)c1	817970034	JXHWLARLVXZPLP-IUCAKERBSA-N	224.304	1.399	10	20	BDCD	
Cc1cc(C)c([C@@H](C)NCCCON)c(O)c1	902424166	JRQNQIOPCVSJNK-LLVKDONJSA-N	238.331	1.940	10	20	BDCD	
CC1(C)CN(Cc2cc3c(cc2O)OCO3)C1	877717631	NAAGPNCSENOBCR-UHFFFAOYSA-N	235.283	1.963	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1ccnn1C	132692180	UFRWPAUCKLUYTM-UHFFFAOYSA-N	245.282	1.398	10	20	BDCD	
COC[C@@H](O)CCNCc1c(C)cccc1O	877123844	PRAWLXJUTGXBPG-NSHDSACASA-N	239.315	1.188	10	20	BDCD	
N[C@H]1CCN(Cc2cccc(F)c2O)C1	309559481	NYCQOIBPNHCUNS-VIFPVBQESA-N	210.252	1.064	10	20	BDCD	
C[C@@H]1COCCN(C(=O)Nc2ccc(N)cc2)C1	399134161	VMTSEIFQEPBOHQ-JTQLQIEISA-N	249.314	1.769	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@@H](F)C1	824570266	ABOCJQPLMIVCDV-SECBINFHSA-N	225.263	1.945	10	20	BDCD	
COCCCNCc1c(C)cccc1O	876887293	QXMDCMXDUXTUOU-UHFFFAOYSA-N	209.289	1.827	10	20	BDCD	
O=C(CSc1nccs1)[C@@H]1CCOC1	134169350	UNOFUJPTSKNQOQ-SSDOTTSWSA-N	229.326	1.841	10	20	BDCD	
COCCNCc1ccc(N(C)C)cc1C	62734875	RQJRLJXLMCJFGW-UHFFFAOYSA-N	222.332	1.797	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCCOCCO)c1	35628944	QKBYOPMNURIXRA-NSHDSACASA-N	239.315	1.360	10	20	BDCD	
Oc1ccc(F)cc1CNCc1cc[nH]n1	226583802	OUVXSAFRZZPQBH-UHFFFAOYSA-N	221.235	1.544	10	20	BDCD	
C[C@@H](CO)N[C@@H](C)c1cc(F)ccc1O	87111363	KYKZMGFKYQAOSP-YUMQZZPRSA-N	213.252	1.563	10	20	BDCD	
COc1cccc(CNCc2ccon2)c1O	93305803	FFOJAKIDMYDMLJ-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
C[C@@H](O)C(=O)NCc1c(O)ccc2c1CCCC2	276364017	MUPGOOOCPTWTIS-SECBINFHSA-N	249.310	1.268	10	20	BDCD	
CC1(C)NCC[C@@H]1NCc1cc(F)ccc1O	841086078	LTIUWEVYQAPQQJ-LBPRGKRZSA-N	238.306	1.761	10	20	BDCD	
Oc1cccc(Cl)c1CNC[C@H]1COCO1	894873982	UQAZLSUMFZIKIP-QMMMGPOBSA-N	243.690	1.508	10	20	BDCD	
[N-]=[N+]=NC1CN(CC(=O)Nc2ccccc2)C1	409423640	PUZOUICLDDXTPX-UHFFFAOYSA-N	231.259	1.620	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@@H](O)[C@H](CC2CC2)C1	409435672	WCXFHVGHUYOPOK-GHMZBOCLSA-N	224.308	1.780	10	20	BDCD	
Cc1cc(O)c(CN[C@H](CF)C(=O)O)cc1C	1600286616	SBZOURKTQPOIGV-SNVBAGLBSA-N	241.262	1.521	10	20	BDCD	
Oc1cccc(F)c1CN[C@H]1CCCNC1	1574440556	XDOIBUYKMXSZEP-VIFPVBQESA-N	224.279	1.373	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C[C@H](C)N)c(O)c1	1579696843	IXJCAONCNZXVGJ-QWRGUYRKSA-N	222.332	1.916	10	20	BDCD	
CC[C@@H](O)CSc1ncc(C(=O)O)s1	1595331676	IOZVFBXAPMLQKM-RXMQYKEDSA-N	233.314	1.704	10	20	BDCD	
CCc1cccc(CN(C)[C@H](C)C(=O)O)c1O	1597586828	LQKJIIBHJAJKOX-SECBINFHSA-N	237.299	1.860	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C[S@@](C)=O)c(O)c1	877311335	VUJHZZQRXFOGIF-MGPLVRAMSA-N	241.356	1.557	10	20	BDCD	
COCC[C@@](C)(O)CNCc1ccccc1O	172071657	XIOIXXWZDCFNRQ-CYBMUJFWSA-N	239.315	1.269	10	20	BDCD	
CC[C@@H](O)CCNC(=O)Cc1ccc(N)cc1	154935306	MJSUONXWTYYNQE-GFCCVEGCSA-N	236.315	1.089	10	20	BDCD	
C[C@@H]1C[C@H]1C(=O)NCCc1ccc(N)cc1	40675582	MVYOQRARGBVRBZ-BXKDBHETSA-N	218.300	1.584	10	20	BDCD	
Cc1nccn1CCNCc1ccccc1O	134231894	XTQKAOBCFUWZHQ-UHFFFAOYSA-N	231.299	1.687	10	20	BDCD	
CC(=O)C(=O)CSc1nnc(C2CC2)s1	289729927	SPGRPDSVOQZEHB-UHFFFAOYSA-N	242.325	1.666	10	20	BDCD	
CC(=O)C(=O)Cn1cnc2cc(C)c(C)cc21	289561559	HCMJIKXHFLISRX-UHFFFAOYSA-N	230.267	1.811	10	20	BDCD	
OC[C@]1(F)CCN(Cc2cc(F)ccc2O)C1	802660581	PPUVQTZCFVJHLU-LBPRGKRZSA-N	243.253	1.438	10	20	BDCD	
Cc1cc(CN2C[C@H](C)[C@H](O)C2)ccc1N(C)C	815081056	QOCRTPYXGBSYBA-SWLSCSKDSA-N	248.370	1.874	10	20	BDCD	
Cn1ccsc1=NC(=O)c1cc(O)cs1	731867543	MBUIFMDSIOFLCT-UHFFFAOYSA-N	240.309	1.595	10	20	BDCD	
Nc1ccc(-n2cc(CN3CCCC3)nn2)cc1	849134625	JIEYPHFXITTZEE-UHFFFAOYSA-N	243.314	1.445	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)[C@H](C)O	840949032	OPSMMOOGILMMSE-NEPJUHHUSA-N	236.359	1.920	10	20	BDCD	
O=C(NC1CSC1)c1cc(O)cs1	880735893	XWNDCIFOVMZGDF-UHFFFAOYSA-N	215.299	1.299	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)[C@H](C)CN1C	775987318	VKSQXHBMKHJWEF-VXGBXAGGSA-N	234.343	1.917	10	20	BDCD	
C[C@@H](CCO)NCc1c(O)cccc1Cl	96811524	XVGYUIATYKSJEB-QMMMGPOBSA-N	229.707	1.906	10	20	BDCD	
Nc1ccc(NC(=O)C2CCNCC2)cc1	143358990	KQIWJRSJNXKRKT-UHFFFAOYSA-N	219.288	1.207	10	20	BDCD	
Cc1cccc(O)c1CNCC1(C)COC1	877029566	HEATUNANTAZKNR-UHFFFAOYSA-N	221.300	1.827	10	20	BDCD	
C[S@](=O)C1(CNCc2ccccc2O)CC1	309882317	WEXNUAAALPCRNL-INIZCTEOSA-N	239.340	1.393	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@H]1COCCO1)CC2	386534198	PRSZTEAAHPQUPJ-RYUDHWBXSA-N	249.310	1.385	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CC[C@H]1C(=O)O	397084297	IIVJHNFJRSVHLV-VHSXEESVSA-N	249.266	1.119	10	20	BDCD	
CCN(CC)c1ccc([C@@H](N)CO)cc1	72198073	IACKUZRDXAIBBW-LBPRGKRZSA-N	208.305	1.525	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](C)CO)c1	83215477	LAIUGMKDMMIOLV-SECBINFHSA-N	225.288	1.119	10	20	BDCD	
C[C@H](NC(=O)c1cc(O)cs1)C1CC1	732258546	UAJPGLYTZUEYJB-LURJTMIESA-N	211.286	1.982	10	20	BDCD	
CC(C)(C)[C@@H](O)C(=O)NCc1ccccc1O	735855407	CDRKSLLPZCANEB-NSHDSACASA-N	237.299	1.415	10	20	BDCD	
COCCNC(=O)NCc1cc(C)ccc1O	864395736	BBRQRFJRTBGZOD-UHFFFAOYSA-N	238.287	1.146	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)NCC(F)F	879762891	HDANJKRBBXAOSU-UHFFFAOYSA-N	244.241	1.799	10	20	BDCD	
CNCCN(C)Cc1cc(C)ccc1O	69801214	AUTRVXKMYDVJJI-UHFFFAOYSA-N	208.305	1.352	10	20	BDCD	
O=C(NOCC1CC1)c1cc(O)cs1	1331185440	BMNCVSODRIKCEJ-UHFFFAOYSA-N	213.258	1.525	10	20	BDCD	
CCCN[C@@H](C)C(=O)NCc1ccc(N)cc1	1263303836	KQACLIRPVLCDML-JTQLQIEISA-N	235.331	1.273	10	20	BDCD	
C[C@@H](C[S@](C)=O)N[C@@H](C)c1ccccc1O	164490198	LAYSUMWEBRFCOO-XQJJYNOISA-N	241.356	1.810	10	20	BDCD	
COc1ccc(N(C)C[C@@H]2CCC(=O)N2)cc1	844354385	CEGGUVZCYUTMSU-JTQLQIEISA-N	234.299	1.410	10	20	BDCD	
CO[C@@H](C)[C@H](C)NCc1ccccc1O	133140002	UDNXNDAMHZTKIO-UWVGGRQHSA-N	209.289	1.905	10	20	BDCD	
C[C@H](O)CCN[C@H](C)c1ccccc1O	82992612	QNIYSYGPAIQBHS-VHSXEESVSA-N	209.289	1.814	10	20	BDCD	
O=C1CCCN1CCSc1nccs1	299061845	UMUWEUAKXNLWTH-UHFFFAOYSA-N	228.342	1.858	10	20	BDCD	
Oc1ccccc1CN1CCn2cncc2C1	291443715	CBBPUJAFRJJLLT-UHFFFAOYSA-N	229.283	1.605	10	20	BDCD	
C[C@H](NC[C@@H](C)N)c1cc(F)cc(F)c1O	817971848	HTTHQUSQVAMYDZ-RQJHMYQMSA-N	230.258	1.668	10	20	BDCD	
C[C@H]1CN(Cc2cccc(F)c2O)[C@@H](C)CN1	843120083	VJHDWKKQDMBRSF-UWVGGRQHSA-N	238.306	1.714	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2NC3)cc1	841846218	LNTXCJFXZHUGEU-JIMOISOXSA-N	245.326	1.595	10	20	BDCD	
CC(C)NCCC(=O)N(C)c1ccc(N)cc1	877079054	OLFRUJQWQWKDPG-UHFFFAOYSA-N	235.331	1.620	10	20	BDCD	
NCCCCNCc1cc(Cl)ccc1O	37714923	WKNUUNHJOUVNNQ-UHFFFAOYSA-N	228.723	1.874	10	20	BDCD	
Nc1ccc(CNC(=O)CCNCC2CC2)cc1	1341924029	QLLWHDPPBYKZOH-UHFFFAOYSA-N	247.342	1.275	10	20	BDCD	
COCCN[C@@H](C)c1cc(OC)ccc1O	19881557	BGZSZAZEECOFOQ-VIFPVBQESA-N	225.288	1.698	10	20	BDCD	
CCC[C@@H](O)CNC(=O)Nc1ccc(N)cc1	841299364	BECPLVGSUYXYNU-LLVKDONJSA-N	237.303	1.551	10	20	BDCD	
CC(=O)NCCCNCc1c(C)cccc1O	876911905	AHFKXEGLGIIYRG-UHFFFAOYSA-N	236.315	1.316	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](O)C1)c1ccccc1O	295972589	NZAITOBZQDNQSU-BBBLOLIVSA-N	207.273	1.566	10	20	BDCD	
COC1CC(C(=O)NCc2ccccc2O)C1	703332443	GXPFLUPJBJAKAO-UHFFFAOYSA-N	235.283	1.433	10	20	BDCD	
COCCN[C@@H](C)c1ccc(C)cc1O	20085589	YARDXGAUZIHGPV-JTQLQIEISA-N	209.289	1.998	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NCCCF	181220952	YVQOGTGDJFYUBI-HWKANZROSA-N	239.246	1.587	10	20	BDCD	
CCN(CC)c1ccc(CNC(=N)N)cc1	195522594	ZLBOWAXEGURINZ-UHFFFAOYSA-N	220.320	1.516	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)CC[C@H]1O	249958458	JKRKDOHPOANPPD-ZYHUDNBSSA-N	221.300	1.595	10	20	BDCD	
COc1c([N+](=O)[O-])ccc(CNCCF)c1O	280665628	LNWHMSKQGLLESW-UHFFFAOYSA-N	244.222	1.368	10	20	BDCD	
C[C@@H](NC/C=C\CO)c1ccc(F)cc1O	717573925	ARGBCTVUMZFPOI-PKRMOACSSA-N	225.263	1.730	10	20	BDCD	
NC1(CN[C@H]2CCc3cccc(O)c32)CCC1	817965616	YHUSPAYQXXMOHX-NSHDSACASA-N	232.327	1.851	10	20	BDCD	
C[C@H](CN)N[C@H](C)c1cc(F)ccc1O	817966282	KHDXHVNKKFDADO-HTQZYQBOSA-N	212.268	1.529	10	20	BDCD	
CC[C@@H](N[C@H](C)CN)c1ccccc1O	817966343	LUGZHJJYHNTOLY-MWLCHTKSSA-N	208.305	1.780	10	20	BDCD	
CC(C)(CCCN)NC(=O)Cc1ccc(N)cc1	843481699	NEIWTVNBMAAKMB-UHFFFAOYSA-N	249.358	1.445	10	20	BDCD	
CC(C)[C@@H](N)CNCc1ccccc1O	841028438	FSFVBNFTKMMQAK-NSHDSACASA-N	208.305	1.465	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)N1C[C@@H]2C[C@H]2C1	862557484	XGCCGEZMUSAFOK-MTCWXPTMSA-N	245.278	1.589	10	20	BDCD	
CNC[C@H](C)CNCc1ccc(N)cc1	1120371033	NGIMHKQWVIGYKQ-JTQLQIEISA-N	207.321	1.214	10	20	BDCD	
Nc1ccc(CNC[C@@H](N)C2CC2)cc1	1262487992	MOBCVKWFKYKPCY-GFCCVEGCSA-N	205.305	1.096	10	20	BDCD	
Cc1cc(O)c(CNC2CNC2)c(Cl)c1	1574144395	QDCKFAXDUZYUNO-UHFFFAOYSA-N	226.707	1.415	10	20	BDCD	
N[C@H]1C[C@@H](NCc2ccc(Cl)cc2O)C1	1580423378	YHWPWJPLVNNTFY-AOOOYVTPSA-N	226.707	1.625	10	20	BDCD	
CC[C@@H](CCO)NCc1ccc(C)cc1O	877054947	LWMYHYBLRGJRSZ-LBPRGKRZSA-N	223.316	1.951	10	20	BDCD	
CC[C@H](OC)C(=O)N(C)Cc1ccccc1O	66046903	FZPJIRHRLWMEPH-LBPRGKRZSA-N	237.299	1.776	10	20	BDCD	
C[C@@H](NC[C@@H]1CNC(=O)C1)c1ccccc1O	398363910	YXXMYUUUDVFAQI-NXEZZACHSA-N	234.299	1.179	10	20	BDCD	
CCC[C@](C)(N)C(=O)NCc1ccc(N)cc1	1343472467	HQLBDCPCZMXPRG-ZDUSSCGKSA-N	235.331	1.403	10	20	BDCD	
CCNCc1ccc(N2CCN(C)CC2)cc1	34823189	OOWUBMFCXVPXAQ-UHFFFAOYSA-N	233.359	1.548	10	20	BDCD	
COC[C@@H](C)N(C)Cc1cccc(OC)c1O	132679499	WLKJJYKWRFEXJY-SNVBAGLBSA-N	239.315	1.868	10	20	BDCD	
Oc1ccccc1CNC[C@@H]1C[C@H](F)CN1	841077574	BUPQASIIFIKBSG-QWRGUYRKSA-N	224.279	1.182	10	20	BDCD	
O=C(NOCC(F)F)c1cc(O)cs1	760457988	CETTXRQTZLTRLY-UHFFFAOYSA-N	223.200	1.380	10	20	BDCD	
O=C1OCC[C@@H]1NCc1cccc(Cl)c1O	895801061	FGTIMICJQZDCBQ-VIFPVBQESA-N	241.674	1.451	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2ccccc2O)CCN1	709372059	SYVZTLIIAKYDFZ-PWSUYJOCSA-N	220.316	1.622	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@H]1CCOC1	127352334	QMNATUYHAHDHJL-QMMMGPOBSA-N	227.691	1.924	10	20	BDCD	
O=C(C[C@H]1CCOC1)NCc1ccccc1O	401379431	NXOXUUAKQQNFPN-SNVBAGLBSA-N	235.283	1.435	10	20	BDCD	
C[C@@H]1C[C@H](N)CN1Cc1ccc(N(C)C)cc1	702668276	JJOZGPLCTDLMAC-YPMHNXCESA-N	233.359	1.674	10	20	BDCD	
C[C@H](N[C@H](C)CO)c1ccc(F)cc1O	62745817	PNPUWQFNRGTZNU-SFYZADRCSA-N	213.252	1.563	10	20	BDCD	
CC[C@@H]1CN(Cc2ccccc2O)CC[C@@H]1N	122246210	WXJLLGPQUSDMTL-YPMHNXCESA-N	234.343	1.951	10	20	BDCD	
CN(Cc1csnn1)c1ccc2c(c1)OCO2	180759525	NVMLXMOQCJZYHR-UHFFFAOYSA-N	249.295	1.903	10	20	BDCD	
COC[C@@H](O)CN[C@@H](C)c1cc(C)ccc1O	71265161	LBIKVFCCIAOASP-QWRGUYRKSA-N	239.315	1.359	10	20	BDCD	
CCCN(Cc1ccccc1O)[C@@H]1CCNC1	71314716	CNQSVLXFNOKJTI-CYBMUJFWSA-N	234.343	1.966	10	20	BDCD	
NOCCCNCc1c(O)cccc1Cl	904455715	AKHORJQMDCBPOA-UHFFFAOYSA-N	230.695	1.416	10	20	BDCD	
CC[C@@H](NCCCON)c1ccc(F)cc1O	902415223	LMTFZTZISYJCGM-LLVKDONJSA-N	242.294	1.852	10	20	BDCD	
C[C@@H]1CCN(C(=O)c2cc(O)cs2)[C@@H]1CO	832761513	ZIDIODOZCHJSTO-VXNVDRBHSA-N	241.312	1.297	10	20	BDCD	
NCC[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	1341123534	PNDATPNLDCCVMU-LBPRGKRZSA-N	247.342	1.009	10	20	BDCD	
COCCNCc1cc(F)c(N(C)C)cc1F	858087010	QZIWIAQYYYGTSW-UHFFFAOYSA-N	244.285	1.767	10	20	BDCD	
COC[C@@H](O)CNCc1cccc(Cl)c1O	162865777	LMRDFGHXEAVURD-VIFPVBQESA-N	245.706	1.143	10	20	BDCD	
C[C@H](O)CN(C)Cc1cc(Cl)cc(F)c1O	776521805	UNNVBAISOWFRPL-ZETCQYMHSA-N	247.697	1.997	10	20	BDCD	
CC[C@H](NCc1nnn(C)n1)c1ccccc1O	398086528	QBAJLFACMNUVRV-JTQLQIEISA-N	247.302	1.157	10	20	BDCD	
CN(C)C[C@@H]1CCN(Cc2ccc(N)cc2)C1	708476695	LMDZYFVWWIKZRY-ZDUSSCGKSA-N	233.359	1.652	10	20	BDCD	
C[C@@H]1CCN(C(=O)NCc2ccc(N)cc2)C1	1338793771	VCMIYBXBCNSPMK-SNVBAGLBSA-N	233.315	1.820	10	20	BDCD	
Cc1cccc(CNC[C@@H](O)C(C)C)c1O	162628464	IFBBMFPZSMCWQU-GFCCVEGCSA-N	223.316	1.807	10	20	BDCD	
Oc1c(F)cc(F)cc1CN[C@H]1C[C@H](O)C1	883182213	WJPLZQDAZIGSER-KYZUINATSA-N	229.226	1.283	10	20	BDCD	
C[C@H](NC[C@@H](C)N(C)C)c1ccccc1O	38088821	MDKUBGOFDWNOJN-MNOVXSKESA-N	222.332	1.993	10	20	BDCD	
COc1cccc(CN[C@H]2CO[C@@H](C)C2)c1O	402031061	ILITWIHOKCJPOM-GXSJLCMTSA-N	237.299	1.668	10	20	BDCD	
CC[C@H](CO)N[C@@H](C)c1ccccc1O	20194905	PFCWRTFIVYPSDM-VHSXEESVSA-N	209.289	1.814	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCCOC2)c1	71012510	DBHNPCUBFZHHNG-GFCCVEGCSA-N	221.300	1.969	10	20	BDCD	
C[C@@H](Cc1ccc(O)c(O)c1)Nc1ncccn1	184146533	FTYYNUPOUJFYCL-VIFPVBQESA-N	245.282	1.931	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(Cl)cc1	808488787	PAUYPHQTAUCLFD-UHFFFAOYSA-N	240.642	1.655	10	20	BDCD	
CCC(=O)COC(=O)c1cc(O)cs1	732354126	DUEKWUJOGSWOPE-UHFFFAOYSA-N	214.242	1.590	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCN[C@@H](C)C2)c1	841061402	IHTIKOBEDZSVDH-AAEUAGOBSA-N	234.343	1.931	10	20	BDCD	
CNC[C@@H](C)NCc1cc(Cl)ccc1O	853250083	ZSZFOWNBKWUQTA-MRVPVSSYSA-N	228.723	1.743	10	20	BDCD	
CC(=O)C(=O)COc1cccc(C(C)=O)c1F	871717139	UQUKPHLPNURATL-UHFFFAOYSA-N	238.214	1.565	10	20	BDCD	
CN(C(=O)C[C@@H]1CCCN1)c1ccc(N)cc1	877079262	WJPLKULLJPATAW-NSHDSACASA-N	233.315	1.374	10	20	BDCD	
C[C@@H](CCO)N[C@@H](C)c1c(O)cccc1F	886530090	CUFFGJFBAVBWRI-IUCAKERBSA-N	227.279	1.953	10	20	BDCD	
CC[C@@H](CNCc1c(O)cccc1OC)OC	810175678	AZOWBLQQJVVTEN-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
CC(C)NC(=S)NCc1cccn1C	231647859	LDPNKGYZRIFIGL-UHFFFAOYSA-N	211.334	1.398	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](O)C1)c1cc(F)ccc1O	850578285	IYUCEQYNSRSHPF-SZEHBUNVSA-N	225.263	1.705	10	20	BDCD	
CC[C@@H](NCc1cc(Cl)ccc1O)C(=O)O	818316720	GGUIOSZPTNEKSY-SECBINFHSA-N	243.690	1.998	10	20	BDCD	
CN(C)C(=O)[C@@H]1CCCN1Cc1ccccc1O	179554744	WGESFGIBZGPZGY-LBPRGKRZSA-N	248.326	1.445	10	20	BDCD	
C[C@@H](O)C1(NCc2ccc(N(C)C)cc2)CC1	827579543	FWHZSSUCAGHZJP-LLVKDONJSA-N	234.343	1.756	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCCCNC2=O)c1	71407442	AMBMKQXXHNFUFY-GFCCVEGCSA-N	248.326	1.459	10	20	BDCD	
C[C@H](CCO)NCc1ccc2c(c1)CCCN2C	132443420	HQCGUVWHCJSTJV-GFCCVEGCSA-N	248.370	1.930	10	20	BDCD	
CN1CC[C@@H]2CCN(Cc3ccccc3O)[C@H]2C1	272698314	YGCJJBYKJFOWPC-OCCSQVGLSA-N	246.354	1.918	10	20	BDCD	
C[C@H](NCCN(C)C)c1cc(F)cc(F)c1O	806171654	QTTWISVUTBSEMY-QMMMGPOBSA-N	244.285	1.883	10	20	BDCD	
CC(=O)C(=O)COC(=O)C[C@H](C)c1ccccc1	808484168	LNJAYUGXCJYQDV-JTQLQIEISA-N	248.278	1.882	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c1	817978155	XJKCRGBUGYGNOD-PQFRYHKHSA-N	232.327	1.569	10	20	BDCD	
CN(Cc1cccc(F)c1O)C1CCNCC1	843046454	WPMJJZFVJRRPBA-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
CCN(C)c1ccc(CN2CC[C@H]2CO)cc1	934013194	GFOZJSOVUIJEJE-AWEZNQCLSA-N	234.343	1.709	10	20	BDCD	
CCOC[C@H]1CN(CCN=[N+]=[N-])C[C@H]1C	409429891	HYUXHBQDFBDADH-NXEZZACHSA-N	212.297	1.901	10	20	BDCD	
CN(Cc1cc(F)cc(F)c1O)C1(CO)CC1	895354827	SNYSRWGOFFIRPW-UHFFFAOYSA-N	243.253	1.627	10	20	BDCD	
CCCCN(C)C(=O)c1cccc(O)c1O	163268581	XPOVCRIBDVGZIT-UHFFFAOYSA-N	223.272	1.970	10	20	BDCD	
CCOc1ccc(N(C)CC(=O)NC)cc1	157315302	RXYFZHMGMDCRFM-UHFFFAOYSA-N	222.288	1.268	10	20	BDCD	
C[C@](CN)(NC(=O)Cc1ccc(N)cc1)C1CC1	843343948	DOOGRSUJZALLQE-CQSZACIVSA-N	247.342	1.055	10	20	BDCD	
CCc1nc(CNCc2ccc(C)cc2O)n[nH]1	877555048	SFWJTJWWEUEESS-UHFFFAOYSA-N	246.314	1.671	10	20	BDCD	
CCCN(CC(=O)OC)Cc1ccc(N)cc1	35364792	UXBDCFOCJMSEPK-UHFFFAOYSA-N	236.315	1.654	10	20	BDCD	
CC[C@H](N[C@@H](C)CC(N)=O)c1ccccc1O	136100932	XFJLXWAYNKYDFC-ONGXEEELSA-N	236.315	1.697	10	20	BDCD	
OCCOCCSc1nccs1	40677100	AQBHRYAYJMONQX-UHFFFAOYSA-N	205.304	1.244	10	20	BDCD	
COC(=O)CN(Cc1cc(C)ccc1O)C1CC1	271271235	NJARTOUQOGNYJH-UHFFFAOYSA-N	249.310	1.838	10	20	BDCD	
C[C@@H](N[C@H]1CCNC1)c1ccc(N(C)C)cc1	817944414	BHAQGXOCSNXNLP-YPMHNXCESA-N	233.359	1.765	10	20	BDCD	
C[C@H](NCC1(N)CC1)c1cc(F)cc(F)c1O	902408630	ZSASWMKLYRTFCK-ZETCQYMHSA-N	242.269	1.812	10	20	BDCD	
CCOc1ccc(CN[C@@H](C)C(=O)O)c(O)c1	739508710	XLXRFXRGQGBRSU-QMMMGPOBSA-N	239.271	1.354	10	20	BDCD	
CCC[C@H](C)NC(=O)C(=O)Nc1ccc(N)cc1	840999759	OZJJHIPUNUQSJP-VIFPVBQESA-N	249.314	1.512	10	20	BDCD	
CC(C)[C@H](O)COC(=O)c1cc(O)cs1	849728462	SMQLDQONRKGAAR-MRVPVSSYSA-N	230.285	1.627	10	20	BDCD	
CC[C@H](NCc1cccc(C)c1O)C(=O)NC	697915089	GJZZCMKIMGAHAZ-NSHDSACASA-N	236.315	1.315	10	20	BDCD	
O=C(Cc1ccco1)NCc1ccccc1O	769366386	YMQRGDVTYOOWEZ-UHFFFAOYSA-N	231.251	1.844	10	20	BDCD	
CN(CCO)Cc1cc(F)c(N(C)C)cc1F	862211015	AIACTLNDUNHYHW-UHFFFAOYSA-N	244.285	1.455	10	20	BDCD	
Cc1cc(O)c(CN2CC(C)(O)C2)cc1Cl	877580689	GWRDRCLEOYBTSX-UHFFFAOYSA-N	241.718	1.921	10	20	BDCD	
CC[C@H]1CN(Cc2c(C)cccc2O)C[C@@H]1O	876815174	NMDXWJLVJMEFJM-FZMZJTMJSA-N	235.327	1.903	10	20	BDCD	
CNC[C@H](C)CNCc1cc(C)ccc1O	1328676216	ACUPVBGOBKEZEZ-NSHDSACASA-N	222.332	1.646	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C[C@@H](C)N)c(O)c1	1579696842	IXJCAONCNZXVGJ-MNOVXSKESA-N	222.332	1.916	10	20	BDCD	
Cn1ncc(CNCc2ccc3c(c2)CCO3)n1	389819322	XWMATSWMRDJJJA-UHFFFAOYSA-N	244.298	1.040	10	20	BDCD	
C[C@@H](NCc1cc(Cl)ccc1O)C(N)=O	35793330	TVIQPGWROOPWOT-ZCFIWIBFSA-N	228.679	1.009	10	20	BDCD	
N[C@@H](CO)c1c(O)ccc2ccccc12	72197946	SCCQMKSVLGCKOO-JTQLQIEISA-N	203.241	1.538	10	20	BDCD	
CO[C@@H](C)CNCc1ccc2c(c1)CCO2	191202123	VSRIFYVAPMRJBL-JTQLQIEISA-N	221.300	1.746	10	20	BDCD	
C[C@H](CO)CCCNCc1ccccc1O	230161387	KHWLMAUGZHFKHA-NSHDSACASA-N	223.316	1.890	10	20	BDCD	
C[C@H](NCCCO)c1cc([N+](=O)[O-])ccc1O	273441747	YSAMYZGQCMVLFH-QMMMGPOBSA-N	240.259	1.333	10	20	BDCD	
CC[C@H](NCCN)c1ccc(F)cc1O	817937322	WQQAGTCTODLWPA-JTQLQIEISA-N	212.268	1.531	10	20	BDCD	
O=C(OCCn1cccn1)c1cccc(O)c1O	776280365	PVQVLBHEDHWHSC-UHFFFAOYSA-N	248.238	1.151	10	20	BDCD	
COc1ccc(O)c(CN2CCN[C@@H](C)C2)c1	88058611	BGMDXLOXSRZUPK-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
C[C@@H](NCc1ccc(Cl)cc1O)C(=O)O	1594206744	XQLIQIFXYKAYID-ZCFIWIBFSA-N	229.663	1.608	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCC(=O)O)c1	36723053	NUNCLHQRLMFIMK-SSDOTTSWSA-N	225.244	1.136	10	20	BDCD	
COc1ccc(O)c(CNCC23CC(CO2)C3)c1	529662502	LQIVKWNTKGVFPG-UHFFFAOYSA-N	249.310	1.669	10	20	BDCD	
Nc1ccc(CNC(=O)CC[C@@H]2CCCO2)cc1	87206443	QOAMBHSCHRSLOZ-ZDUSSCGKSA-N	248.326	1.844	10	20	BDCD	
CCN(CCC(=O)O)Cc1cc(C)ccc1O	86754562	YEPRWACBGLRGJW-UHFFFAOYSA-N	237.299	1.997	10	20	BDCD	
COC[C@H](O)CN[C@H](C)c1cc(F)ccc1O	94618278	SEPVVXWBBRPPTM-PSASIEDQSA-N	243.278	1.189	10	20	BDCD	
O=C(OCCC1(O)CCC1)c1cc(O)cs1	840229078	VYJHDXZIMUSUND-UHFFFAOYSA-N	242.296	1.916	10	20	BDCD	
COc1cccc(O)c1CN(C)CC(C)(C)O	769425831	XAIFPWPKALYMKJ-UHFFFAOYSA-N	239.315	1.604	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@H](O)[C@H](CC2CC2)C1	409435132	SMRNRWQBUDHJHO-ZJUUUORDSA-N	238.291	1.306	10	20	BDCD	
Nc1ccc(CN2CC[C@]3(CCNC3)C2)cc1	1336287050	WHFJEMSSIGDEKV-AWEZNQCLSA-N	231.343	1.454	10	20	BDCD	
Cc1ccc(CNC(C)(C)CCO)c(O)c1	877042802	XKFXCLVHPOMRFO-UHFFFAOYSA-N	223.316	1.951	10	20	BDCD	
Cc1cccc(O)c1CNCc1cocn1	877046443	LWBRDIJYICJPOU-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H](O)C(C)C	877037436	QUGMCFQKSJATEJ-ZDUSSCGKSA-N	223.316	1.807	10	20	BDCD	
CCN(CC)c1ccc(CNC(N)=O)cc1F	109031137	PDTRUAYWQXBWQW-UHFFFAOYSA-N	239.294	1.840	10	20	BDCD	
CC(C)(C)NCC(=O)NCc1ccccc1O	133750187	ZLQBFBIMTOCGBA-UHFFFAOYSA-N	236.315	1.397	10	20	BDCD	
C[C@@H](O)CN[C@H]1CCc2cccc(O)c21	295809565	CRYGRDVUZQCENP-SCZZXKLOSA-N	207.273	1.350	10	20	BDCD	
COc1ccc(O)c(CN2CCOCC23CC3)c1	802659222	WSBQEPQTDUHLGL-UHFFFAOYSA-N	249.310	1.766	10	20	BDCD	
CC[C@@H](NC(=O)c1cc(O)cs1)C(=O)O	818299040	IRLSCZPLTJUHRI-ZCFIWIBFSA-N	229.257	1.047	10	20	BDCD	
C[C@@H](N)[C@H]1CCN(Cc2cccc(F)c2O)C1	843058757	XNTFKSGCMNVVJB-ZJUUUORDSA-N	238.306	1.700	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)C1=COCC1	767780310	VCNBFDAMWMPXAC-UHFFFAOYSA-N	249.266	1.061	10	20	BDCD	
Oc1cc2c(cc1CN1CCCC1)[C@H](O)CO2	768437775	GNZPHTSQAHFVRJ-GFCCVEGCSA-N	235.283	1.414	10	20	BDCD	
COC[C@H](C)NC(=O)c1c(F)ccc(O)c1O	789940508	BELBZAAJRFRYRM-LURJTMIESA-N	243.234	1.002	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccccc2O)CCCOC1	272973308	ZNKYBCFGNOLDCL-CQSZACIVSA-N	249.310	1.825	10	20	BDCD	
CNC1CC(C(=O)NCc2ccccc2O)C1	703536434	WDCMUODZJBNDNS-UHFFFAOYSA-N	234.299	1.006	10	20	BDCD	
CNCCN(C)Cc1ccc(N2CCCC2)cc1	1326232948	UOMTZLXZGUSGLZ-UHFFFAOYSA-N	247.386	1.938	10	20	BDCD	
CC1=NO[C@@](C)(C(=O)NCc2ccccc2O)C1	1335853937	AAUNNEHPPOQDKW-CYBMUJFWSA-N	248.282	1.563	10	20	BDCD	
CCO[C@@H](C)C(=O)NCc1cccc(O)c1O	1347530426	BCTDSDMSKCJZHW-QMMMGPOBSA-N	239.271	1.139	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@H]2C(N)=O)cc1	160305067	ZXVDSCCMKHVKGG-ZDUSSCGKSA-N	247.342	1.202	10	20	BDCD	
CC[C@H](N)CNCc1ccc2c(c1)CCCO2	904355319	PWMMLADVCAATTH-ZDUSSCGKSA-N	234.343	1.839	10	20	BDCD	
C[C@H](NCC1(C)OCCO1)c1ccccc1O	183634963	UGZXZNAWYNRMJK-JTQLQIEISA-N	237.299	1.806	10	20	BDCD	
C[C@@H](NCc1ncc[nH]1)c1ccccc1O	70646334	WLPPRYWPTTXOAR-SECBINFHSA-N	217.272	1.966	10	20	BDCD	
COC[C@H](CCO)N[C@@H](C)c1ccccc1O	228793919	SPWVTWJNSOXVAH-QWRGUYRKSA-N	239.315	1.440	10	20	BDCD	
CC(C)NC(=O)NCCc1ccc(N)cc1	40675744	GHXALBAPTOZXPZ-UHFFFAOYSA-N	221.304	1.519	10	20	BDCD	
CCCOCC(=O)N(C)Cc1ccccc1O	225593012	HARGAGQACWMZCM-UHFFFAOYSA-N	237.299	1.777	10	20	BDCD	
O=C(NCc1ccccc1O)c1cccnc1F	236563028	NLZVALVCYBXCML-UHFFFAOYSA-N	246.241	1.856	10	20	BDCD	
COc1ccc(SCC(=O)C(C)=O)cc1	288281732	AZEMSIJVUCNOGF-UHFFFAOYSA-N	224.281	1.945	10	20	BDCD	
C[C@@H](O)C(=O)OCCCSc1nccs1	283140121	UMFQOKGLJLDNJW-SSDOTTSWSA-N	247.341	1.549	10	20	BDCD	
COCCCCOC(=O)c1cccc(O)c1O	803440118	JDRPVJWBUXQFJY-UHFFFAOYSA-N	240.255	1.681	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC[C@@H](C)CN)c1	817961608	ANJGINWLVUVUOV-VHSXEESVSA-N	238.331	1.646	10	20	BDCD	
CNCCNCc1c(O)cccc1Cl	841036092	OKOVFDYVXNJIFG-UHFFFAOYSA-N	214.696	1.355	10	20	BDCD	
CNC[C@@H](C)N[C@@H]1CCc2cccc(O)c21	854232471	QUBXYVCTTFBWAG-MWLCHTKSSA-N	220.316	1.577	10	20	BDCD	
CCCC(=O)c1cn(-c2ccc(N)cc2)nn1	864619583	GLMQPWQHUFDKDM-UHFFFAOYSA-N	230.271	1.832	10	20	BDCD	
COC(=O)[C@H](NCc1ccc(C)cc1O)C1CC1	877471475	TUPORNNIZYKZNN-CYBMUJFWSA-N	249.310	1.742	10	20	BDCD	
CC(C)(F)C(=O)NCc1cccc(O)c1O	1123977956	MYYVYIPNKVEVQU-UHFFFAOYSA-N	227.235	1.462	10	20	BDCD	
CN=c1ccnc(Nc2ccc(N)cc2)[nH]1	409427043	HHZBMZLMSGCLHF-UHFFFAOYSA-N	215.260	1.266	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2C[C@@H](CO)C2)c1	707527928	FGFMMKMJCVQKKO-JGZJWPJOSA-N	237.299	1.261	10	20	BDCD	
CC[C@](C)(CCO)NCc1ccc(N)cc1	1262487789	GEOMNLLKBADHOM-CYBMUJFWSA-N	222.332	1.910	10	20	BDCD	
Cc1nonc1CNCc1ccc(N(C)C)cc1	809744194	ZRLBORCVQMUPIU-UHFFFAOYSA-N	246.314	1.734	10	20	BDCD	
C[C@@H]1CNCCN1Cc1cc(F)c(F)cc1O	1576857234	ZVCBLQZLGSMRDF-MRVPVSSYSA-N	242.269	1.464	10	20	BDCD	
Cn1cccc1CNC(=S)NC1CC1	231647837	AXMYVHSNNGZTNQ-UHFFFAOYSA-N	209.318	1.152	10	20	BDCD	
CC(C)(CNCc1ccccc1O)C(=O)O	162953725	RHYMECGVZQHIKP-UHFFFAOYSA-N	223.272	1.593	10	20	BDCD	
C/C=C(\C)C(=O)NCc1cccc(OC)c1O	155549161	PHGHVLVXOILIDC-RUDMXATFSA-N	235.283	1.983	10	20	BDCD	
Cc1ccc(CN2C[C@H]3CNC[C@@H]3C2)c(O)c1	876817506	IWENZNGTNGQQTM-CHWSQXEVSA-N	232.327	1.352	10	20	BDCD	
CC[C@H](NCc1c(C)cccc1O)[C@H](C)O	877569077	ZJOJPWFWQPXVHP-JQWIXIFHSA-N	223.316	1.950	10	20	BDCD	
C[C@@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)CO1	402046775	NPJIFKLIIYINPZ-BXKDBHETSA-N	234.299	1.105	10	20	BDCD	
COCCNCc1ccc(N(C)C)c(F)c1	62734861	YFCNBJXLAZYCGR-UHFFFAOYSA-N	226.295	1.628	10	20	BDCD	
CN(CCCN)c1ccc2c(c1)OCO2	20239949	SWDXMTAZLFMFNM-UHFFFAOYSA-N	208.261	1.200	10	20	BDCD	
CCOc1cccc(CN[C@H](C)CO)c1O	35603283	PSOQUSGHYPBGOA-SECBINFHSA-N	225.288	1.261	10	20	BDCD	
CCCS(=O)(=O)NCc1ccc(N)cc1	32015609	NMSBYWGUYDDGFA-UHFFFAOYSA-N	228.317	1.098	10	20	BDCD	
O=C(O)CSc1ncc(Cl)s1	85352510	DRFMITYROKBUET-UHFFFAOYSA-N	209.679	1.973	10	20	BDCD	
Cc1ccc(CNC[C@@H]2CCCO2)c(O)c1	83351375	VWPMPZYUZZIETO-LBPRGKRZSA-N	221.300	1.969	10	20	BDCD	
CN(Cc1ccccc1O)Cc1ncnn1C	177154054	RDPJJSPNXLMDMS-UHFFFAOYSA-N	232.287	1.153	10	20	BDCD	
CCO[C@H]1C[C@H]1C(=O)N(C)Cc1ccccc1O	298765975	ANKANIQZSAZICQ-YPMHNXCESA-N	249.310	1.776	10	20	BDCD	
CC(C)(O)CNCc1cc(F)ccc1O	180737917	YPHFPNKEGGJZGK-UHFFFAOYSA-N	213.252	1.392	10	20	BDCD	
Cc1cccc(CN(C)C[C@H](O)C2CC2)c1O	809753137	ZTMOTTLEOGNJLE-ZDUSSCGKSA-N	235.327	1.903	10	20	BDCD	
NC[C@H]1CCCC[C@@H]1NCCc1ccc(N)cc1	817958164	SQJQIEPUJHZVRD-HIFRSBDPSA-N	247.386	1.918	10	20	BDCD	
CN[C@@H](C)CCN[C@H]1CCc2cccc(O)c21	1118057217	BVRFYQBVIYTMPC-JQWIXIFHSA-N	234.343	1.967	10	20	BDCD	
CCCN(Cc1ccc(N)cc1)[C@H]1CCNC1	1236325079	YORSDGPKSFXHCR-AWEZNQCLSA-N	233.359	1.843	10	20	BDCD	
CNC[C@@H](C)CNCc1ccc(N(C)C)cc1	1261370683	QTDIDKLQTFDMLL-GFCCVEGCSA-N	235.375	1.698	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1=CCOCC1	1354071854	LIFBAKVINWSNRE-UHFFFAOYSA-N	249.266	1.061	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)N1CC2(CC2)C1	1354220180	HIRNGJMGCRXTGF-RQOWECAXSA-N	245.278	1.733	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](O)C1)c1ccc(F)cc1O	850579586	ZLLODQRRYLWLAD-HGNGGELXSA-N	225.263	1.705	10	20	BDCD	
CNC(=O)[C@@]1(C)CCN(Cc2ccc(N)cc2)C1	230893545	NWDLXUVMSAMZKD-AWEZNQCLSA-N	247.342	1.227	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)[C@H](C)CN1	841849471	WHRDXWPTDQCMCG-WDEREUQCSA-N	247.342	1.020	10	20	BDCD	
C[C@@H](Cn1ccnc1)NCc1ccccc1O	37157232	HBINXFCYFXHCDT-NSHDSACASA-N	231.299	1.767	10	20	BDCD	
COc1ccc(O)c(CNCc2ncc[nH]2)c1	70992039	DHSVVETUDJPEHK-UHFFFAOYSA-N	233.271	1.414	10	20	BDCD	
Cc1cc(O)c(CNCC(F)(F)CO)cc1C	183874289	PLBLFVCBDKSHSU-UHFFFAOYSA-N	245.269	1.726	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)C(=O)CNC	37807411	KJKCZTCZATVMNU-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
OCc1ccc(CNCc2ccccc2O)o1	135171010	XULHAMNVCOPNSO-UHFFFAOYSA-N	233.267	1.767	10	20	BDCD	
Oc1ccc(F)cc1CN1CCOCC12CC2	802658675	MDVIIDDJEMQMDH-UHFFFAOYSA-N	237.274	1.896	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@H](N)C2)c1O	906516734	JFPYPOSWKUFDIP-XYPYZODXSA-N	206.289	1.280	10	20	BDCD	
Cn1ccc(NC(=O)c2cc(O)cs2)n1	732259687	VYYYBRUFVCNVOE-UHFFFAOYSA-N	223.257	1.440	10	20	BDCD	
CC(C)C1(O)CN(Cc2cc(F)ccc2O)C1	839132936	HWOFCZVLLHDHIR-UHFFFAOYSA-N	239.290	1.734	10	20	BDCD	
COc1cccc(CN[C@@H](C)C[C@@H](C)N)c1O	843129822	RPBWINLHBNCPQD-ZJUUUORDSA-N	238.331	1.616	10	20	BDCD	
Cc1ccc(CN2C[C@H]3CCN(C)[C@H]3C2)c(O)c1	877567676	ORZHUYCIAYCUFR-OCCSQVGLSA-N	246.354	1.837	10	20	BDCD	
CNC[C@H](C)C(=O)N(C)c1ccc(N)cc1	877079321	XNUKTTXWEIFNPB-VIFPVBQESA-N	221.304	1.087	10	20	BDCD	
Nc1ccc(CN[C@@]23COC[C@@H]2C3)cc1	718017988	OHWTVGRZWSSERA-JQWIXIFHSA-N	204.273	1.147	10	20	BDCD	
CC1(CO)CCN(Cc2ccc(N)cc2)CC1	402918735	MIACYPXXZHCOHM-UHFFFAOYSA-N	234.343	1.863	10	20	BDCD	
CNC(=O)NCc1ccc(N(C)C)c(F)c1	58482945	FVAROKUKSDHQJB-UHFFFAOYSA-N	225.267	1.321	10	20	BDCD	
Nc1ccc(NC(=O)Cn2cccn2)cc1	22174309	LBKXFRWTFATISU-UHFFFAOYSA-N	216.244	1.104	10	20	BDCD	
O=C(Nc1ccc(O)nc1)c1cccc(O)c1O	311170028	SDUVHHHYQXJSOV-UHFFFAOYSA-N	246.222	1.451	10	20	BDCD	
CCN(CC)C(=O)CN(C)c1ccc(N)cc1	20374436	UBYPVALPULLZSB-UHFFFAOYSA-N	235.331	1.573	10	20	BDCD	
C[C@H]1CN(CCSc2nccs2)CCO1	188301864	UQZFLIUHNPCBSL-VIFPVBQESA-N	244.385	1.956	10	20	BDCD	
C[C@H](O)C(=O)OCCCSc1nccs1	283140124	UMFQOKGLJLDNJW-ZETCQYMHSA-N	247.341	1.549	10	20	BDCD	
CC1(C)CN[C@H]1C(=O)Nc1ccc(N)cc1	818556488	VGCAZAAFDWBBAC-JTQLQIEISA-N	219.288	1.205	10	20	BDCD	
CC[C@](C)(O)C(=O)N[C@H](C)c1ccccc1O	828538881	CTFHKLXNPOWURT-RNCFNFMXSA-N	237.299	1.730	10	20	BDCD	
Cc1cccc(CN2C[C@@H](C)NC[C@@H]2C)c1O	843120111	XVAXHMUNUWWCIZ-NEPJUHHUSA-N	234.343	1.883	10	20	BDCD	
CC[C@]1(O)CCN(Cc2ccccc2O)C1	779217662	UMDMSWPZWBHDRR-ZDUSSCGKSA-N	221.300	1.739	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H](CO)C1	876660526	UVSHJKDLXDFSOZ-LLVKDONJSA-N	221.300	1.515	10	20	BDCD	
C[C@H](O)CCN[C@H](C)c1c(O)cccc1F	886528368	KYTYRYSAZGNXQB-DTWKUNHWSA-N	227.279	1.953	10	20	BDCD	
C[C@@H](O)[C@@H]1CCN(C(=O)c2cc(O)cs2)C1	780803147	IPTYAFWLGCEAAZ-HTQZYQBOSA-N	241.312	1.297	10	20	BDCD	
CC(C)C[C@H](CO)NC(=O)c1cc(O)cs1	782122587	ARUIYYFUJNULOY-MRVPVSSYSA-N	243.328	1.591	10	20	BDCD	
CO[C@@H]1CN(Cc2cc(C)ccc2O)CCO1	895968220	KCEVEPMBSQCIAA-ZDUSSCGKSA-N	237.299	1.505	10	20	BDCD	
C[C@H](NCC[C@@H](C)O)c1ccccc1O	82992610	QNIYSYGPAIQBHS-ZJUUUORDSA-N	209.289	1.814	10	20	BDCD	
COc1cccc(O)c1CNC[C@@H](C)OC	390661152	SFVGKMOXWWMZQS-SECBINFHSA-N	225.288	1.525	10	20	BDCD	
Oc1c(F)cc(F)cc1CN1CCC[C@@H](O)C1	893871215	IEWKJBODAPFRBX-SNVBAGLBSA-N	243.253	1.627	10	20	BDCD	
Nc1ccc(CN2CCC[C@@H](N)C2)cc1	1334774502	KQTVDHCFPRDPIF-GFCCVEGCSA-N	205.305	1.192	10	20	BDCD	
C[C@H](CCN(C)C)NCc1cc(F)ccc1O	226588596	PNRNHKHQDXNWTK-SNVBAGLBSA-N	240.322	1.961	10	20	BDCD	
Oc1ccc(F)cc1CNCCn1cccn1	226585929	JNRRMBXIFPAQIS-UHFFFAOYSA-N	235.262	1.518	10	20	BDCD	
O=[N+]([O-])c1cnc(NCc2ccccc2O)nc1	169068551	CECJTJFMXONFNZ-UHFFFAOYSA-N	246.226	1.703	10	20	BDCD	
C[C@@](CN)(NC(=O)Cc1ccc(N)cc1)C1CC1	843343947	DOOGRSUJZALLQE-AWEZNQCLSA-N	247.342	1.055	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)C1(CO)CC1	877625578	PQWRTMSDRPCAEX-LLVKDONJSA-N	235.327	1.951	10	20	BDCD	
CON1CCC(NCc2ccccc2O)CC1	323122723	LZBHQNGBUWTWCE-UHFFFAOYSA-N	236.315	1.508	10	20	BDCD	
CN(Cc1cnn(C)c1)Cc1ccccc1O	111235163	DFQOQQMVQOVKRU-UHFFFAOYSA-N	231.299	1.758	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@H]1CC12CCC2	1263894573	MLPMMUFTZBIUJH-SNVBAGLBSA-N	247.294	1.904	10	20	BDCD	
CC[C@@H](C)C(=O)NCCc1ccc(N)cc1	40675596	BJHGDJGHWVZDQC-SNVBAGLBSA-N	220.316	1.974	10	20	BDCD	
CCONC(=O)NCc1ccccc1O	265491900	BFKCUPOUPNJRPA-UHFFFAOYSA-N	210.233	1.143	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1CC2(CC2)C1	910943016	KEZFXKNXCQGFIM-UHFFFAOYSA-N	247.294	1.904	10	20	BDCD	
C[C@H](CN)CNCc1cc(F)ccc1O	841047981	FMWXMZJTYYFNGR-MRVPVSSYSA-N	212.268	1.216	10	20	BDCD	
O=C(NCCN1CCCC1)c1cc(O)cs1	854299119	LOFAKDMWBUACLL-UHFFFAOYSA-N	240.328	1.279	10	20	BDCD	
CN(C)CCCCNC(=O)Cc1ccc(N)cc1	45660861	HLDMRBPCNKENHU-UHFFFAOYSA-N	249.358	1.269	10	20	BDCD	
CN(C(=O)CCNCC1CC1)c1ccc(N)cc1	877075356	AHTRTZHJIOPFOK-UHFFFAOYSA-N	247.342	1.621	10	20	BDCD	
CC1(C)CN(Cc2ccc(N)cc2)C[C@@H]1O	387663665	HMSYEIWAFMGBQW-LBPRGKRZSA-N	220.316	1.472	10	20	BDCD	
CC[C@H](NCc1cccc(OC)c1O)C(=O)O	1326187090	FWWZCAIYLYXGEM-VIFPVBQESA-N	239.271	1.354	10	20	BDCD	
Nc1ccc(CN2C[C@@H]3CCCN[C@@H]3C2)cc1	1336116982	JUMNJHFEPAIIIC-GXTWGEPZSA-N	231.343	1.453	10	20	BDCD	
Cc1ccc(C(=O)OCC[C@H](C)O)c(O)c1O	1346728995	ZVDLQFJNPBLWGV-QMMMGPOBSA-N	240.255	1.334	10	20	BDCD	
C[C@H](N)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1	1574073381	CPHXHNJCISDMEI-UWVGGRQHSA-N	235.331	1.277	10	20	BDCD	
Nc1ccc(CNC(=O)c2ncccc2N)cc1	1580445609	MCOCOXWKGPDNBL-UHFFFAOYSA-N	242.282	1.176	10	20	BDCD	
COc1ccc(CN[C@@H]2CO[C@H](C)C2)c(O)c1	402008145	AHVRCDDEPMPJDJ-KOLCDFICSA-N	237.299	1.668	10	20	BDCD	
NC(=O)CCSc1ncc(Cl)s1	849998727	ITUNKFIQSIMBLW-UHFFFAOYSA-N	222.722	1.764	10	20	BDCD	
COCCCNCc1ccc2c(c1)CCO2	37362849	AMYWHUYYLWINFG-UHFFFAOYSA-N	221.300	1.748	10	20	BDCD	
COC[C@H](C)N(C)Cc1cc(OC)ccc1O	132677504	JYUNMHOYPDMNQM-JTQLQIEISA-N	239.315	1.868	10	20	BDCD	
C[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1	272530477	WTIKVFIOPQZJBT-GFAPAMAISA-N	247.294	1.979	10	20	BDCD	
O=C(OCc1cn[nH]c1)c1cc(O)cs1	803346129	MOFOBUHGRGUOON-UHFFFAOYSA-N	224.241	1.534	10	20	BDCD	
CCOC1CN(Cc2cccc(OC)c2O)C1	839132328	MWBVRTMWJSYKTJ-UHFFFAOYSA-N	237.299	1.622	10	20	BDCD	
CN(C)C(=N)NCc1cc(Cl)ccc1O	849048281	GGFKCQXDPONBTC-UHFFFAOYSA-N	227.695	1.632	10	20	BDCD	
C[C@@H](CN)NC(=O)N[C@H](C)c1ccccc1O	892089667	VSRCXCPRGJAOOB-DTWKUNHWSA-N	237.303	1.100	10	20	BDCD	
C[C@H](CO)Sc1ncc([N+](=O)[O-])s1	189691178	PAKVADWNLZQGMF-SCSAIBSYSA-N	220.275	1.524	10	20	BDCD	
Oc1c(F)cc(F)cc1CN[C@H]1CCOC1	708393830	JTCQNNMTIWZBTK-VIFPVBQESA-N	229.226	1.549	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCCCN1)c1ccccc1O	877255860	IQADWPAXNVLLBC-ZYHUDNBSSA-N	248.326	1.712	10	20	BDCD	
Cc1ncncc1C(=O)NCc1ccccc1O	1318095403	RXNMGJWSLSIULM-UHFFFAOYSA-N	243.266	1.421	10	20	BDCD	
CCN(OC)C(=O)/C=C\c1ccc(O)c(O)c1	1529028160	OXSPWRDXAJBHEY-ALCCZGGFSA-N	237.255	1.521	10	20	BDCD	
C[C@H](N[C@H](C)CC(N)=O)c1ccc(F)cc1O	168828131	WALTZGSTMGJHEM-SFYZADRCSA-N	240.278	1.446	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CCC(=O)O	37835657	JVHKTGUBLHZBDV-UHFFFAOYSA-N	237.255	1.215	10	20	BDCD	
FCCNCc1ccc(N2CCOCC2)cc1	310196889	ZHKOIVANOWOZSU-UHFFFAOYSA-N	238.306	1.582	10	20	BDCD	
CCOCCC(=O)N(C)Cc1ccccc1O	76964441	MSZLKCLJYHBDEZ-UHFFFAOYSA-N	237.299	1.777	10	20	BDCD	
COc1cccc(CNCc2ccn(C)n2)c1O	20352691	QRNQPFMABUIEJR-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
COc1cccc(CNC[C@H](O)C2CC2)c1O	71299566	LWABOBRPCLWZKV-NSHDSACASA-N	237.299	1.261	10	20	BDCD	
CN1CCC(NCc2ccccc2O)CC1	37267169	OUHXWXWLOYLUOO-UHFFFAOYSA-N	220.316	1.576	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)NC1CC1	42933259	JTRVLPOSEXVOFY-UHFFFAOYSA-N	220.272	1.696	10	20	BDCD	
CNC(=O)CN(C)Cc1c(O)cccc1Cl	132593998	NWRBJRCLLVPQQH-UHFFFAOYSA-N	242.706	1.223	10	20	BDCD	
CC[C@H](O)CN[C@H]1CCc2cccc(O)c21	297357655	PQBATQJHLFZQES-QWRGUYRKSA-N	221.300	1.740	10	20	BDCD	
CC(C)N(CCO)Cc1cc(F)ccc1O	272262565	KHOPYPWQLMBTIX-UHFFFAOYSA-N	227.279	1.734	10	20	BDCD	
COCC1(NC(=O)c2cc(O)cs2)CCC1	839800345	RYNLBRIVYRXQHC-UHFFFAOYSA-N	241.312	1.753	10	20	BDCD	
CC(C)C[C@@H](CN)NCc1cccc(F)c1O	841037552	AMIMARMOGUGEJD-NSHDSACASA-N	240.322	1.994	10	20	BDCD	
CC[C@@H](N)CNCc1cc(C)c(C)cc1O	841073576	ZZFNVUUHVMCYRV-GFCCVEGCSA-N	222.332	1.836	10	20	BDCD	
CCNCCNCc1cc(Cl)cc(F)c1O	841037661	RLNWZAUONDMMOX-UHFFFAOYSA-N	246.713	1.884	10	20	BDCD	
O=C(O)c1cnc(SCn2cccn2)s1	1602534767	KUEJPYCPOPABCI-UHFFFAOYSA-N	241.297	1.788	10	20	BDCD	
C[C@@]1(NCc2cc(F)c(F)cc2O)CCNC1	1573627303	ZCEAUSTWDIWKQN-GFCCVEGCSA-N	242.269	1.512	10	20	BDCD	
C[C@@H](NCc1ccccc1O)[C@@H](O)C(F)(F)F	865711765	QIGBYQYMOODXPY-GMSGAONNSA-N	249.232	1.794	10	20	BDCD	
C[C@@H](CN[C@H]1CCc2cccc(O)c21)N(C)C	297659971	KNFDAHVBAAOXCB-JQWIXIFHSA-N	234.343	1.919	10	20	BDCD	
C[C@]1(CNCc2ccccc2O)CCOC1	309824821	XCXHKFQJVGZECH-CYBMUJFWSA-N	221.300	1.908	10	20	BDCD	
C[C@@H](NC[C@H]1CCN1C)c1cc(F)ccc1O	712596584	VCFOZTXVDYJMFZ-MWLCHTKSSA-N	238.306	1.886	10	20	BDCD	
CO[C@H](C)C(=O)NCc1ccccc1O	136333816	BZMINBDNKSGFSD-MRVPVSSYSA-N	209.245	1.043	10	20	BDCD	
CC1(C(=O)NCCc2ccc(N)cc2)CC1	261568922	FZEMCSFIWSILCF-UHFFFAOYSA-N	218.300	1.728	10	20	BDCD	
COc1ccc(N2CCCN(C(N)=O)CC2)cc1	78937269	YSYDUCSJQCOWBU-UHFFFAOYSA-N	249.314	1.286	10	20	BDCD	
CN(CC(=O)O)Cc1c(O)cccc1Cl	133835056	JPOAUXKMSFXROM-UHFFFAOYSA-N	229.663	1.562	10	20	BDCD	
C[C@@H](CO)NCc1cccc(Cl)c1O	133440092	BWKNZHFROXTGFD-ZETCQYMHSA-N	215.680	1.516	10	20	BDCD	
C[C@@H]1C[C@@H](N)CCN1C(=O)Cc1ccc(N)cc1	237478511	QYYKDHPTONFRNY-MFKMUULPSA-N	247.342	1.150	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H]2CCCCN2)cc1	234264963	XNOSVTBWTYTYCK-AWEZNQCLSA-N	247.386	1.984	10	20	BDCD	
C[C@H](CF)NC(=O)NCc1ccccc1O	287609589	ROYBQYGKCNQGGB-MRVPVSSYSA-N	226.251	1.549	10	20	BDCD	
CNCCCN[C@H](C)c1ccc(C)cc1O	817940390	MHLJUZLYOGWMBC-LLVKDONJSA-N	222.332	1.961	10	20	BDCD	
CC[C@H](N)CN[C@@H](C)c1ccccc1O	817979265	JFSCAKVVELTULP-UWVGGRQHSA-N	208.305	1.780	10	20	BDCD	
COc1cccc(CN(C)C2(CO)CC2)c1O	827904242	XRGQWTDCIXLDIV-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
CC(C)N(CC(=O)O)C(=O)c1cc(O)cs1	820004085	GBLODKRPYNGHFI-UHFFFAOYSA-N	243.284	1.389	10	20	BDCD	
N[C@@]12CCC[C@@H]1CN(Cc1ccccc1O)C2	857226543	QUCPGBJOYHLZPH-TZMCWYRMSA-N	232.327	1.705	10	20	BDCD	
Cc1cccc(CN2CC(=O)N(C)C[C@H]2C)c1O	783734887	WOKDURPMLMDKDE-LLVKDONJSA-N	248.326	1.363	10	20	BDCD	
CCCN(C)C(=O)Cc1ccc(N)cc1	37097699	ZOIOAAMPJXSGKO-UHFFFAOYSA-N	206.289	1.680	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NCCF	798060397	NOYCKNPWLOFGTA-DUXPYHPUSA-N	225.219	1.197	10	20	BDCD	
O=C(NC[C@@H]1C=CCC1)c1cccc(O)c1O	711703385	KWOLIAXQOFVEJW-SECBINFHSA-N	233.267	1.794	10	20	BDCD	
CNCCN(C)Cc1cccc(Cl)c1O	379421761	AQIJNLRDNVAIAO-UHFFFAOYSA-N	228.723	1.697	10	20	BDCD	
CC[C@H]1CN(C(=O)Nc2ccc(N)cc2)CCO1	36770596	ARIWTPUKCGNTAM-LBPRGKRZSA-N	249.314	1.912	10	20	BDCD	
COC(=O)[C@H](C)NCc1cc(OC)ccc1O	37073664	PDQYPGGMMFCVSV-QMMMGPOBSA-N	239.271	1.052	10	20	BDCD	
CC(=O)N[C@@H]1CCN(Cc2cc(C)ccc2O)C1	228356032	SMCRVUWEJIXKIS-CYBMUJFWSA-N	248.326	1.411	10	20	BDCD	
CC[C@H](O)CNc1ccccc1OCCOC	819423422	BIPRTQFHCQSKPO-NSHDSACASA-N	239.315	1.895	10	20	BDCD	
CC[C@@H](CNCc1ccccc1O)OC	289984255	ZZAYYBAPPFUZAN-NSHDSACASA-N	209.289	1.907	10	20	BDCD	
Cc1cc(O)c(CNC[C@H](C)CN)cc1C	841049161	NSYAIFODCBSVCW-SECBINFHSA-N	222.332	1.693	10	20	BDCD	
CCc1ccccc1N1N=C(C(C)=O)CC1=O	871944123	YLMMNTGQNKRMNU-UHFFFAOYSA-N	230.267	1.931	10	20	BDCD	
COC[C@H](O)CN[C@H](C)c1c(O)cccc1F	886607307	OZQMYZNOVADCFP-RKDXNWHRSA-N	243.278	1.189	10	20	BDCD	
C/C(=C/CNC(=O)c1cc(O)cs1)C(=O)O	1602971812	HELZCGHLTQJGIZ-KXFIGUGUSA-N	241.268	1.214	10	20	BDCD	
CCCNCCNCc1ccccc1O	841046737	MDRTWODYPBQNJQ-UHFFFAOYSA-N	208.305	1.481	10	20	BDCD	
CNC[C@H](C)C(=O)N[C@H](C)c1ccccc1O	870988583	UBEJNCBHEGKNCP-VHSXEESVSA-N	236.315	1.425	10	20	BDCD	
CC(=O)N1CCOc2cc(N(C)C)ccc21	173194356	LBPKEZOMEZEFKZ-UHFFFAOYSA-N	220.272	1.498	10	20	BDCD	
C[C@H](CSc1nccs1)C(=O)O	40676375	JVSUBDYHIZYBRM-RXMQYKEDSA-N	203.288	1.956	10	20	BDCD	
CC(C)C[C@H](N)C(=O)NCc1ccccc1O	83363469	CXMIGFCGNWRZPK-NSHDSACASA-N	236.315	1.382	10	20	BDCD	
CN1CC[C@H]2CCN(Cc3ccccc3O)[C@@H]2C1	272698310	YGCJJBYKJFOWPC-GXTWGEPZSA-N	246.354	1.918	10	20	BDCD	
CC(=O)C(=O)COc1c(C)ccnc1Cl	289767359	VZSUOSBHJGNNRY-UHFFFAOYSA-N	227.647	1.580	10	20	BDCD	
Cc1cc(O)c(CN(C)CCC(=O)O)cc1C	821046125	RYRCUBPKHDISLP-UHFFFAOYSA-N	237.299	1.916	10	20	BDCD	
C[C@@H](NC(=O)COCC1CC1)c1ccccc1O	827930845	SBHSVKBQSULBLN-SNVBAGLBSA-N	249.310	1.996	10	20	BDCD	
CCOc1ccc(CNCC(C)(C)O)c(O)c1	732229575	KMKFBJYKTNEWSL-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
COC1CN(Cc2cc(C)cc(C)c2O)C1	754742716	XZHMVUDKQVDWIF-UHFFFAOYSA-N	221.300	1.840	10	20	BDCD	
C[C@@H](C[C@@H](C)O)NCc1ccccc1O	164460696	HSAHIEWZJYYFIA-VHSXEESVSA-N	209.289	1.641	10	20	BDCD	
C[C@H](O)[C@@H](N)c1cccc(Br)c1O	95664607	AAFUDAAVJMVDRI-YLWLKBPMSA-N	246.104	1.535	10	20	BDCD	
CC[C@@H](NC)C(=O)NCc1ccccc1O	692021571	NBPSQGSMVDRXKS-SNVBAGLBSA-N	222.288	1.006	10	20	BDCD	
C[C@@H](CCCN)NCc1ccc(N)cc1	1334753499	GDIAXSZMPGUDOX-JTQLQIEISA-N	207.321	1.486	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@@H]1C[C@@H]2C[C@@H]2C1	1521851277	JFWIUOACJJMHBA-URLYPYJESA-N	247.294	1.760	10	20	BDCD	
Cc1ccc(CN[C@@H](CF)C(=O)O)c(O)c1	1607783115	QEGOFOLZOVNGRQ-VIFPVBQESA-N	227.235	1.213	10	20	BDCD	
NC[C@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2	841028536	BEPXDNDAURPTBT-KGLIPLIRSA-N	246.354	1.839	10	20	BDCD	
CCN1C[C@H](NCc2c(C)cccc2O)CC1=O	877567535	NWDIFXVPPYNSOM-LLVKDONJSA-N	248.326	1.411	10	20	BDCD	
NCCC(=O)NCCCSc1nccs1	237857522	YUTYMIBHCZCDJM-UHFFFAOYSA-N	245.373	1.090	10	20	BDCD	
C[C@H](C(=O)NC1CC1)N(C)Cc1ccccc1O	109773588	JTSYZOGFPJUQEV-SNVBAGLBSA-N	248.326	1.491	10	20	BDCD	
CCN(CCOC)C(=O)c1cccc(O)c1O	126291697	YQJJIPTWYFAOQT-UHFFFAOYSA-N	239.271	1.206	10	20	BDCD	
CO[C@H](C(=O)N(C)Cc1ccccc1O)C1CC1	280384996	MVYZCUQTBRFYIX-ZDUSSCGKSA-N	249.310	1.776	10	20	BDCD	
CN(C)C(=O)CCNCc1cc(F)ccc1O	226588152	NIFGXCAUNJEUJH-UHFFFAOYSA-N	240.278	1.099	10	20	BDCD	
CCN(CC(=O)N(C)C)c1ccc(OC)cc1	299376292	MDINMPWVIAKYLX-UHFFFAOYSA-N	236.315	1.610	10	20	BDCD	
OC/C=C\CNCc1cc(F)ccc1O	717524648	HGYJGYREWRPNIP-UPHRSURJSA-N	211.236	1.169	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@@H](C)C(=O)O)cc1C	818849175	BMASBOYEXBGFGK-JTQLQIEISA-N	237.299	1.914	10	20	BDCD	
C[C@H](N)C[C@H](C)NCc1ccc(N(C)C)cc1	817894124	BTJNRLBMZOIQPS-RYUDHWBXSA-N	235.375	1.968	10	20	BDCD	
O=C(OCc1ccno1)c1cc(O)cs1	732354901	VVGINUYDJGEALV-UHFFFAOYSA-N	225.225	1.799	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)CCN)c1	841051403	OKGNPHDKSNQBRV-SNVBAGLBSA-N	208.305	1.528	10	20	BDCD	
CN(C)c1ccc(CNCC(C)(C)N)cc1F	841031005	NRPAIQHTPCJKTQ-UHFFFAOYSA-N	239.338	1.719	10	20	BDCD	
CC(C)(C)[C@@H](CN)NCc1ccccc1O	841087650	PGUYILTZGPVZMU-GFCCVEGCSA-N	222.332	1.855	10	20	BDCD	
CCO[C@H]1C[C@H]1C(=O)NCc1cc(C)ccc1O	862758913	QHXXGNAFQRXZBU-YPMHNXCESA-N	249.310	1.742	10	20	BDCD	
Cc1cccc(O)c1CN(C)[C@H](C)CCO	877614610	FRRYHKXSPRQMCP-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
CCNCCNCc1ccc(N2CCCC2)cc1	1117953478	IBYIFCIEHMJNDA-UHFFFAOYSA-N	247.386	1.986	10	20	BDCD	
C[C@@H]1CN(C(=O)c2cc(O)cs2)CC[C@@H]1O	779462837	VYIVQOKOTYPAQJ-APPZFPTMSA-N	241.312	1.297	10	20	BDCD	
[N-]=[N+]=NC1CN(CC(=O)N2CCCCCC2)C1	409422243	CDOIVJCVOMIDAK-UHFFFAOYSA-N	237.307	1.384	10	20	BDCD	
COc1ccc(CN[C@@H]2CCCNC2)cc1C	84529863	WSRUNZXHQQNQOR-CYBMUJFWSA-N	234.343	1.845	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@@H](O)C1)c1ccc(F)cc1O	720907390	LHYPEMZTFMPBCY-KKZNHRDASA-N	239.290	1.953	10	20	BDCD	
CN(Cc1ccccc1O)CC1(C)COC1	744401640	FRUSOTDWGWGTTP-UHFFFAOYSA-N	221.300	1.861	10	20	BDCD	
CNC[C@@H](C)CNCc1c(O)cccc1Cl	1331420369	WWENSANGUXGZBQ-SECBINFHSA-N	242.750	1.991	10	20	BDCD	
CC[C@H](F)C(=O)NCCc1ccc(N)cc1	1353003920	HDDRURNODZRJNB-NSHDSACASA-N	224.279	1.676	10	20	BDCD	
C[C@@H](N)[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	834460320	GMUMQLUXXLRPIH-PWSUYJOCSA-N	247.342	1.007	10	20	BDCD	
Cc1ccc(CN[C@H]2CCCCNC2=O)c(O)c1	876926450	VIEFZVUQHHASES-LBPRGKRZSA-N	248.326	1.459	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)C(C)(C)O)c1	393977320	SPNMWBWESZYDED-VIFPVBQESA-N	239.315	1.650	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC(N)=O)c1	171409134	STLDXCBUSCGRKH-LURJTMIESA-N	210.233	1.130	10	20	BDCD	
C[C@@H]1COCCN1Cc1ccc(N(C)C)cc1	128522173	NETLLESPOXMQHK-GFCCVEGCSA-N	234.343	1.973	10	20	BDCD	
C[C@H](NCC(F)(F)CO)c1cc(F)ccc1O	184712898	JMPURMLBWYHDOE-ZETCQYMHSA-N	249.232	1.810	10	20	BDCD	
CC(C)(O)CC(=O)NCc1ccccc1O	281600201	OLIKXGMKODNJPJ-UHFFFAOYSA-N	223.272	1.169	10	20	BDCD	
CCOc1cccc(CNCC(C)(C)O)c1O	96480959	SZABLGAPVIMSCG-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
CC[C@H](OC)C(=O)NCc1ccc(O)c(O)c1	272262167	BUXKCSJSHRWUDT-NSHDSACASA-N	239.271	1.139	10	20	BDCD	
CC(C)NC(=O)NCCSc1nccs1	842548480	WTBNOAHAFHORCQ-UHFFFAOYSA-N	245.373	1.943	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NC(=O)c1cc(O)cs1	856269386	SFZQFBMHUSQCCP-SCZZXKLOSA-N	227.285	1.361	10	20	BDCD	
COc1ccc(N(C)CC(C)(C)N)cc1OC	84536558	DSPFOCDFAOZILM-UHFFFAOYSA-N	238.331	1.877	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](C)CCO)c1	85126297	CSWJMSMLCLLTOX-NSHDSACASA-N	223.316	1.809	10	20	BDCD	
CN(C)c1ccc(CN2C[C@@H]3C[C@]3(CO)C2)cc1	783740114	JDLWQTDMQBYNBL-DZGCQCFKSA-N	246.354	1.567	10	20	BDCD	
O=C1C(=O)c2c(nc3ncccn23)-c2ccccc21	98178770	GKTWMKZOHJRQNH-UHFFFAOYSA-N	249.229	1.775	10	20	BDCD	
CC1(O)CN(Cc2cc(F)cc(F)c2O)C1	894976637	MORGQEHGGBINJB-UHFFFAOYSA-N	229.226	1.237	10	20	BDCD	
CCO[C@H]1CN(c2ccc(N)cc2)C[C@@H]1OC	409432749	LTYRVCWUHFJDOP-STQMWFEESA-N	236.315	1.509	10	20	BDCD	
COc1ccc(O)c(CNCCSC)c1	68994319	NYMSGCQIUMAPAI-UHFFFAOYSA-N	227.329	1.853	10	20	BDCD	
C[C@@H]1OCCN(C(=O)Cc2ccc(N)cc2)[C@H]1C	125311884	FYBNZDQISKLHNY-QWRGUYRKSA-N	248.326	1.447	10	20	BDCD	
CC1(C)[C@H](N)C[C@H]1NC(=O)Cc1ccc(N)cc1	884348439	ZFIGXWRVXIIBTA-VXGBXAGGSA-N	247.342	1.053	10	20	BDCD	
COc1ccc(CNCC[C@H](C)O)cc1C	78781460	KRZRFUSESYPUOQ-NSHDSACASA-N	223.316	1.864	10	20	BDCD	
Cc1ccc(C(=O)N2CCCCO2)c(O)c1O	189644428	LPNVOOVBXGVWTE-UHFFFAOYSA-N	237.255	1.574	10	20	BDCD	
COC[C@H](CNCc1ccccc1O)OC	227706659	OXOIFNUHIRDKTR-NSHDSACASA-N	225.288	1.143	10	20	BDCD	
NC1(C(=O)NCc2ccccc2O)CCCC1	228423606	HQYJDPZUAWXDMD-UHFFFAOYSA-N	234.299	1.280	10	20	BDCD	
CC[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H]1O	272355104	DQWGERXUKJTDKS-NOZJJQNGSA-N	239.290	1.734	10	20	BDCD	
CNCCN[C@@H](C)c1cc(C)ccc1O	817951218	BRYAWAJVQSXNMS-JTQLQIEISA-N	208.305	1.571	10	20	BDCD	
CN[C@H](C)Cc1noc(Cc2ccc(N)cc2)n1	842621742	DBADWBBFVQFGAL-SECBINFHSA-N	246.314	1.393	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H]1CCCN1	841036982	WSJXDDVLCGUSGD-NSHDSACASA-N	224.279	1.373	10	20	BDCD	
Cc1cccc(O)c1CN(C)C[C@@H](O)C1CC1	877527729	OFYHAAKNGPOFOY-CQSZACIVSA-N	235.327	1.903	10	20	BDCD	
CCOC[C@@H]1CN(C(=O)CN=[N+]=[N-])CC1(C)C	409433527	MWVGGXUMKSUCGN-VIFPVBQESA-N	240.307	1.818	10	20	BDCD	
Cc1nc(CN2CC(N=[N+]=[N-])C2)cs1	409424404	UYSJFQVFCNKHNP-UHFFFAOYSA-N	209.278	1.946	10	20	BDCD	
CN(CCO)Cc1cc(F)cc(F)c1O	893870750	GEGOBDGKJMSYSP-UHFFFAOYSA-N	217.215	1.095	10	20	BDCD	
CCOC(=O)/C=C/CN(C)Cc1ccccc1O	929973196	XZYYQFCNCNMORC-RMKNXTFCSA-N	249.310	1.943	10	20	BDCD	
CCOc1cccc(CNCCCOC)c1O	20142375	BIUVCAYKMDKWBP-UHFFFAOYSA-N	239.315	1.917	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C[C@H]2CCC[C@@H]2C1	126505195	DILCPHXNVLVRLD-NXEZZACHSA-N	247.294	1.970	10	20	BDCD	
O=C(O)[C@@H](NCc1ccccc1O)C1CC1	83407736	RQWLJDVMMWLDEF-NSHDSACASA-N	221.256	1.345	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](C)NC[C@H]2C)c1	251169875	PRPHOYXHQQRYFY-NWDGAFQWSA-N	234.343	1.883	10	20	BDCD	
CCN(CCCO)Cc1cccc(C)c1O	271868755	RSKSQYQYCUTWLU-UHFFFAOYSA-N	223.316	1.905	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](C(=O)O)C2)c1O	821111941	CANWAXXWLMCYTK-LLVKDONJSA-N	235.283	1.607	10	20	BDCD	
NCCN1CCCc2cc(OC(F)F)ccc21	842471850	DBWVVXUPZZDSJF-UHFFFAOYSA-N	242.269	1.999	10	20	BDCD	
CC[C@H](OC)C(=O)NCc1ccc(O)cc1O	910954198	JPXWEGSDAASCIW-NSHDSACASA-N	239.271	1.139	10	20	BDCD	
COc1ccc(CN[C@H](CO)CCF)cc1C	846097498	PZSVDPZGSDKKHN-LBPRGKRZSA-N	241.306	1.814	10	20	BDCD	
COCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O	756339204	CJDXCMDCRLDQFL-MRVPVSSYSA-N	240.259	1.597	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCCN1C)c1ccccc1O	827936827	DARVTNUONIKZOJ-PWSUYJOCSA-N	248.326	1.664	10	20	BDCD	
COC[C@@H]1CCCN1C(=O)c1cc(O)cs1	752821486	VADCQDGGGMBREF-QMMMGPOBSA-N	241.312	1.705	10	20	BDCD	
CC[C@H](OC(=O)c1cc(O)cs1)C(=O)OC	762821809	IYDLUOIFKBXSAS-ZETCQYMHSA-N	244.268	1.562	10	20	BDCD	
Cc1cccc(CN2C[C@@H](O)C[C@@H]2C)c1O	788266740	BIEMVSZAHQVWEI-JQWIXIFHSA-N	221.300	1.656	10	20	BDCD	
CC[C@@H](N[C@@H]1CC(=O)N(C)C1)c1ccccc1O	274859957	CQOUTCQKYXWLAW-ZYHUDNBSSA-N	248.326	1.664	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccccc2O)CCCCO1	837481040	MWWZBBHAFCZNQL-AWEZNQCLSA-N	249.310	1.968	10	20	BDCD	
Cc1ccc(CN[C@H](C)c2ncn(C)n2)c(O)c1	877459434	JKHOOOUUYMSGSI-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
Cc1ccc(CNCCC[C@@H](C)O)c(O)c1	877484903	SKEYAEQMCHZWFE-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
COc1ccc(O)c(CN2CCC(N)CC2)c1	37093705	KDFTUZIZDCSULG-UHFFFAOYSA-N	236.315	1.324	10	20	BDCD	
Cc1nc([C@@H](C)NCc2c(C)cccc2O)n[nH]1	894778862	TUXGVSCNGXXTAV-SECBINFHSA-N	246.314	1.978	10	20	BDCD	
COCCN(C)Cc1c(C)cccc1O	876564199	JQNMNLNRBPPFNT-UHFFFAOYSA-N	209.289	1.779	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCCOC2)cc1	62192913	NNNYXWYFJCJTLK-NSHDSACASA-N	234.299	1.312	10	20	BDCD	
COC(=O)[C@H](C)NCc1cc(Cl)ccc1O	37074059	KQNGMFZWOAKCAQ-ZETCQYMHSA-N	243.690	1.697	10	20	BDCD	
C[C@@]1(C(=O)Nc2ccc(N)cc2)CCCCN1	180895606	LJVSZEVUZQHMNY-ZDUSSCGKSA-N	233.315	1.740	10	20	BDCD	
CC[C@@H](CO)NCc1c(O)cccc1Cl	83551242	YXIPEHFLIILDIW-QMMMGPOBSA-N	229.707	1.906	10	20	BDCD	
Cc1ccc(O)c(CNc2ncn(C)n2)c1	292453716	OEDNHEBNAPQGGL-UHFFFAOYSA-N	218.260	1.441	10	20	BDCD	
CCN(CC(=O)NCc1ccccc1O)C1CC1	269713319	VKXKKQVMYQLMAB-UHFFFAOYSA-N	248.326	1.493	10	20	BDCD	
COc1ccc(O)c(CNC(CF)CF)c1	824554667	KEIOVALISWBCBZ-UHFFFAOYSA-N	231.242	1.798	10	20	BDCD	
O=[N+]([O-])CCNCCCSc1nccs1	905109219	CWHFLFLLYWFMMN-UHFFFAOYSA-N	247.345	1.492	10	20	BDCD	
CCOc1ccc(O)c(CN[C@@H](C)C(=O)O)c1	739503083	BEIPTDOCZNHRFM-QMMMGPOBSA-N	239.271	1.354	10	20	BDCD	
O=C(O)[C@H]1CCN(C(=O)c2cc(O)cs2)C1	739594368	HHLDAZTWTBZSDZ-LURJTMIESA-N	241.268	1.000	10	20	BDCD	
NCCCN1CCCc2cc(CN)ccc21	843058412	RRSXWQXOHNPRPA-UHFFFAOYSA-N	219.332	1.247	10	20	BDCD	
CCc1cccc(CN2CCNC(=O)[C@H]2C)c1O	848886531	WWZUXEDEEYYCMK-SNVBAGLBSA-N	248.326	1.275	10	20	BDCD	
O=C(O)[C@H]1C[C@H](NCc2cc(F)ccc2O)C1	874055585	ZQWMGHIWUHJQCN-GVJMRKKJSA-N	239.246	1.484	10	20	BDCD	
CN(C)c1ccc(CN[C@H](C(=O)O)C2CC2)cc1	86757899	GDROOQFXWFDUBS-ZDUSSCGKSA-N	248.326	1.705	10	20	BDCD	
CC(C)C[C@H](CN)NCc1ccc(N)cc1	1334754243	MSOWUDXMPLRXJC-CYBMUJFWSA-N	221.348	1.732	10	20	BDCD	
Cc1cccc(CN[C@@H](C)CCCN)c1O	841079496	JDHWTYDVHMJPCA-NSHDSACASA-N	222.332	1.918	10	20	BDCD	
COc1ccc(CN[C@H](C)CN)cc1C	841060392	XXQRAPJQXZJGCP-SNVBAGLBSA-N	208.305	1.440	10	20	BDCD	
C[C@@H](NCCOCCO)c1cc(F)ccc1O	94616990	GYJUOJDNJIMMKP-SECBINFHSA-N	243.278	1.191	10	20	BDCD	
OC[C@@H](CCF)NCc1cccc(Cl)c1O	846102201	YXMLKAYHJIXNDX-SECBINFHSA-N	247.697	1.856	10	20	BDCD	
CCN(C)c1ccc(OCC(=O)O)cc1	846279417	CYDKMANHLODIBW-UHFFFAOYSA-N	209.245	1.606	10	20	BDCD	
Nc1ccc(N[C@H]2CCC[C@H](N)C2)cc1	848715186	PSWZBZUJYRCSDI-JQWIXIFHSA-N	205.305	1.951	10	20	BDCD	
Cc1ccc(CN2CCc3c[nH]nc3C2)c(O)c1	876760259	PIEPERCVXJKVHB-UHFFFAOYSA-N	243.310	1.982	10	20	BDCD	
NCCC1CCN(Cc2ccc(N)cc2)CC1	1335287754	APTQPRVNXIOAMF-UHFFFAOYSA-N	233.359	1.830	10	20	BDCD	
C[C@@H](N[C@H](CN)C1CC1)c1ccccc1O	817959434	FYNNPADIMNHZSS-BXKDBHETSA-N	220.316	1.780	10	20	BDCD	
CC(C)(NCc1cccc(Cl)c1O)C(=O)O	1590872745	PTXHEZQNPXYDIV-UHFFFAOYSA-N	243.690	1.998	10	20	BDCD	
CC(C)(C)CNC(=O)c1cccc(O)c1O	163272459	AKWNIRDYUOUGIX-UHFFFAOYSA-N	223.272	1.874	10	20	BDCD	
Cc1ccc(C(=O)N[C@H](C)C2CC2)c(O)c1O	179414017	AFFQTZYRMKZWBM-MRVPVSSYSA-N	235.283	1.935	10	20	BDCD	
Cc1ccc(O)c(CN2CCO[C@@H](C)C2)c1	132474354	IBXBRVKJTCOOEO-NSHDSACASA-N	221.300	1.921	10	20	BDCD	
CO[C@H]1CCN(Cc2cc(C)ccc2O)C1	234887092	SPGDHDXYOKFEFO-LBPRGKRZSA-N	221.300	1.921	10	20	BDCD	
C[C@@H](NCCN)c1cc(F)cc(F)c1O	817934053	AZWOYPLNDVNFLV-ZCFIWIBFSA-N	216.231	1.280	10	20	BDCD	
CN(Cc1cccc(F)c1O)C1CC(N)C1	843125620	ZASJWVLEHBPITQ-UHFFFAOYSA-N	224.279	1.453	10	20	BDCD	
C[C@@H](O)CN(C(=O)c1cc(O)cs1)C1CC1	848391582	BFOVGBGTMGELEZ-SSDOTTSWSA-N	241.312	1.439	10	20	BDCD	
C[C@@H](NC(=O)CN(C)C)c1ccc(N(C)C)cc1	776270079	PIWHOGOYCLIERJ-LLVKDONJSA-N	249.358	1.491	10	20	BDCD	
CCOC[C@@H]1CCN(C(=O)CN=[N+]=[N-])C1	409429607	OWVCQQKXWZYCPP-MRVPVSSYSA-N	212.253	1.182	10	20	BDCD	
C[C@H]1CN(c2ccc(N)cc2)C[C@H]1CO	409433731	ZBTSKTOTORIABK-UWVGGRQHSA-N	206.289	1.333	10	20	BDCD	
COc1ccc(CNC(=O)C(C)(C)F)c(O)c1	794386928	BJWGAZKGGPBYLT-UHFFFAOYSA-N	241.262	1.765	10	20	BDCD	
C[C@H]1OCC[C@@H]1C(=O)N(C)Cc1ccccc1O	92500824	PVVWFDUAWMGQHE-PWSUYJOCSA-N	249.310	1.776	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](C)C[C@@H](C)O	782977467	FXFSVXNQGGFYMZ-VHSXEESVSA-N	239.315	1.650	10	20	BDCD	
C[C@H](N)CN[C@H](C)c1cc(C(=O)O)ccc1O	1604260758	YRZSNSJWUZYLEF-JGVFFNPUSA-N	238.287	1.088	10	20	BDCD	
CC[C@H](O)CN[C@@H](C)c1cc(OC)ccc1O	163988801	SGYYXRHVLZMHHR-UWVGGRQHSA-N	239.315	1.822	10	20	BDCD	
COCCNCc1cccc(Cl)c1O	157754964	KLWJOGPQQYHVLA-UHFFFAOYSA-N	215.680	1.782	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C(=O)CCCN	37801162	UAOWCHVCNIOTJE-UHFFFAOYSA-N	249.358	1.450	10	20	BDCD	
O=C1OC[C@H]2CN(Cc3ccccc3O)CCN12	361054146	UDLMJAZLARUOAW-LLVKDONJSA-N	248.282	1.029	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)CCO1	194157315	CZKUHPQWGQPNTD-LBPRGKRZSA-N	234.343	1.973	10	20	BDCD	
COc1ccc(CN[C@@H]2CC(=O)N(C)C2)cc1C	263706517	HEQXRXNKNSZQLS-GFCCVEGCSA-N	248.326	1.324	10	20	BDCD	
C[C@H](NC1CNC1)c1ccc(N(C)C)cc1	817955523	XXLLXMBYNHQYOQ-JTQLQIEISA-N	219.332	1.375	10	20	BDCD	
Cn1cc(COC(=O)c2cc(O)cs2)cn1	732354518	ORIPRHMRHLKLSJ-UHFFFAOYSA-N	238.268	1.544	10	20	BDCD	
Cc1cc(O)c(CNC2CC(N)C2)cc1C	906509243	BYUJQBCWVIBMPJ-UHFFFAOYSA-N	220.316	1.588	10	20	BDCD	
Nc1ccc(NC(=O)CCNC2CC2)cc1	848392889	JLZUMKWOMXQVIL-UHFFFAOYSA-N	219.288	1.349	10	20	BDCD	
C[C@@H]1C[C@H]1NC(=O)Cc1ccc(N)cc1	52268074	KNJSDBRWBOHMPQ-LDYMZIIASA-N	204.273	1.336	10	20	BDCD	
CC(C)C[C@@H]1CN(C(=O)CN=[N+]=[N-])CC[C@H]1O	409435399	UKIFTHBFHMVZFN-NXEZZACHSA-N	240.307	1.552	10	20	BDCD	
COc1ccc(CNC(=O)C2CC=CC2)c(O)c1	794378875	JNSHTRRIHUUJTL-UHFFFAOYSA-N	247.294	1.983	10	20	BDCD	
COC1(C)CN(C(=O)NCc2ccc(N)cc2)C1	1262603332	FNEGMXZYRIRNNS-UHFFFAOYSA-N	249.314	1.199	10	20	BDCD	
CC(C)(CC(=O)O)NC(=O)c1cc(O)cs1	1590642276	ZNNDTPJFCXCJHW-UHFFFAOYSA-N	243.284	1.437	10	20	BDCD	
OCCCNCc1ccc2c(c1)CCCO2	163270897	QKPWQLSFTVQBPJ-UHFFFAOYSA-N	221.300	1.484	10	20	BDCD	
CN(C)c1ccc(CNC2CC(C(=O)O)C2)cc1	871881890	NRKRWDHOQKLCFP-UHFFFAOYSA-N	248.326	1.705	10	20	BDCD	
Cc1cccc(O)c1CNCCC[C@H](C)O	877484823	PCCRGPNVXWSGCK-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
C[C@H](N[C@@H]1CCc2cccc(O)c21)C(=O)N(C)C	296485257	PHRCNGIOLKTTJG-GXSJLCMTSA-N	248.326	1.446	10	20	BDCD	
CCc1noc(CN(C)c2ccc(N)cc2)n1	702049781	QXTJOBQAVIDSQI-UHFFFAOYSA-N	232.287	1.851	10	20	BDCD	
Cc1cc(C(N)=O)c(C)n1-c1ccccn1	73744113	YYPMKXKWRANUJB-UHFFFAOYSA-N	215.256	1.588	10	20	BDCD	
C[C@@H](CC(N)=O)NCc1ccc(N(C)C)cc1	122783611	XFCSOBBTVUPZIU-JTQLQIEISA-N	235.331	1.106	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C(C)(C)N	40924076	GMAPGASHMLJJCV-UHFFFAOYSA-N	222.288	1.088	10	20	BDCD	
O=C(O)[C@H](NCc1ccccc1O)C1CC1	83407741	RQWLJDVMMWLDEF-LLVKDONJSA-N	221.256	1.345	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)CC[C@H]1N	251830935	PNNFQMRBBZTXKA-CMPLNLGQSA-N	220.316	1.561	10	20	BDCD	
CCN(C)C(=O)c1c(F)ccc(O)c1O	276559466	IVGOAGGRKKJNKB-UHFFFAOYSA-N	213.208	1.329	10	20	BDCD	
Cc1ccc(O)c(CNCCC(C)(C)N)c1	903938532	FHRNUXRRMXDMCN-UHFFFAOYSA-N	222.332	1.918	10	20	BDCD	
N=C(NCc1ccccc1O)N1CCC1	848984818	GLWMTNSKXRVVIU-UHFFFAOYSA-N	205.261	1.122	10	20	BDCD	
COc1cc(O)c(CN2C[C@@H]3C[C@H]3C2)cc1OC	862444169	YYHRCGDGOHDQCE-UWVGGRQHSA-N	249.310	1.861	10	20	BDCD	
COc1cccc(CNCC(C)(C)O)c1O	82687404	ZHZXIZMJEMBQAT-UHFFFAOYSA-N	225.288	1.261	10	20	BDCD	
CC1(C)NCC[C@H]1NCc1ccc(N)cc1	1335288432	FVNJPZYTAHVBET-GFCCVEGCSA-N	219.332	1.499	10	20	BDCD	
Oc1ccccc1CNCc1ccno1	230973001	ABXNAWVSTBSJQT-UHFFFAOYSA-N	204.229	1.670	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1ccco1	158992484	SGZDNQMEBJUTGW-UHFFFAOYSA-N	233.223	1.621	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1C[C@H]2CC[C@H]1O2	265000728	IMSVLRCSTZTZET-NQBHXWOUSA-N	247.294	1.576	10	20	BDCD	
CNC1(C(=O)N[C@H](C)c2ccccc2O)CCC1	1122192400	SUKXIRYJOVNSQN-SNVBAGLBSA-N	248.326	1.712	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCc2nncn2C)c1	38007768	NYOSPHVHQNXIFO-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
CN[C@@H]1CCCN(Cc2cc(F)ccc2O)C1	219862818	ZBDLGTPZNMLHKF-GFCCVEGCSA-N	238.306	1.715	10	20	BDCD	
C[C@@H](NCC(C)(C)O)c1ccc(F)cc1O	83461082	YQCOTEKADQZOKC-MRVPVSSYSA-N	227.279	1.953	10	20	BDCD	
C[C@]1(CNCc2ccc(N)cc2)CCCO1	87255712	RIOAHTUTTUMUNK-CYBMUJFWSA-N	220.316	1.928	10	20	BDCD	
CC[C@H](CO)N[C@@H]1CCc2cccc(O)c21	296224265	ZXIAQPFFUPNMQR-GHMZBOCLSA-N	221.300	1.740	10	20	BDCD	
COCCNCc1cc(Cl)c(F)cc1O	816528949	ZLGYXVPBZYOHOH-UHFFFAOYSA-N	233.670	1.921	10	20	BDCD	
CCOc1ccc(CN[C@H]2C[C@@H](O)C2)c(O)c1	825256777	GNAWYLWDUCHXAA-PHIMTYICSA-N	237.299	1.404	10	20	BDCD	
Cc1ccc(CN2CCCC[C@H]2C(N)=O)c(O)c1	876539520	JOISNHINMFTXJH-LBPRGKRZSA-N	248.326	1.540	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2[C@@H]3CCC(=O)[C@H]32)cc1	1122540972	YBKFUETWJVSJHP-KGYLQXTDSA-N	244.294	1.110	10	20	BDCD	
CO[C@H]1CCO[C@]2(CCN(CCN=[N+]=[N-])C2)C1	409434952	RLAKTJYPLLQEDG-WDEREUQCSA-N	240.307	1.567	10	20	BDCD	
C[C@H](NC(=O)c1cccc(O)c1O)C1CC1	163270851	YDKXEJDMNNVYFM-ZETCQYMHSA-N	221.256	1.626	10	20	BDCD	
N[C@H]1CCC[C@@H](NCc2ccc3c(c2)CCO3)C1	841055523	PCMNUMAKAJSOSP-UONOGXRCSA-N	246.354	1.981	10	20	BDCD	
CC[C@@H](OC)C(=O)Nc1ccc(N)cc1	269118708	IWBXICHHCBHXQA-SNVBAGLBSA-N	208.261	1.632	10	20	BDCD	
Cc1nc([C@@H](C)NCc2cccc(C)c2O)n[nH]1	392361918	CCYCOCHYUAFRDC-SECBINFHSA-N	246.314	1.978	10	20	BDCD	
CN(C)CC(C)(C)NCc1ccccc1O	308608439	MUYCRVALFYCURR-UHFFFAOYSA-N	222.332	1.822	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@H](N)C1	91545525	AKGMIZGFTKWHHO-JQWIXIFHSA-N	248.326	1.478	10	20	BDCD	
COc1ccc(N(C)CC(C)=O)cc1F	258972275	VGGSFPXQODJZKQ-UHFFFAOYSA-N	211.236	1.860	10	20	BDCD	
CC[C@@H](N)CN[C@@H]1CCc2cccc(O)c21	817980641	WFAXKQLJADDYJS-GHMZBOCLSA-N	220.316	1.706	10	20	BDCD	
CC1(C)CN(C(=O)c2c(F)ccc(O)c2O)C1	830812263	LJYRIPFONCBLJO-UHFFFAOYSA-N	239.246	1.719	10	20	BDCD	
Oc1ccc(Cl)c(F)c1CN[C@@H]1CCNC1	841045051	MHQWMMGABDFHOP-SSDOTTSWSA-N	244.697	1.636	10	20	BDCD	
CC(=O)CCC(=O)NCc1cc(C)ccc1O	862761091	CYOHKHORPOZNDE-UHFFFAOYSA-N	235.283	1.686	10	20	BDCD	
CN(C(=O)CC[C@@H]1CCCN1)c1ccc(N)cc1	877077584	NSDLAVHCHQLNGL-LBPRGKRZSA-N	247.342	1.764	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1O	785765154	SLHXKDRMSNCWFD-BXUZGUMPSA-N	234.343	1.565	10	20	BDCD	
Cc1cccc(CNCCCCCO)c1O	83352853	OUGPFEIEKIPHGU-UHFFFAOYSA-N	223.316	1.953	10	20	BDCD	
CC1(NC(=O)NCCc2ccc(N)cc2)CC1	1328726264	UREWVVQKLGTGPS-UHFFFAOYSA-N	233.315	1.663	10	20	BDCD	
CCNC(=O)[C@H](C)NCc1c(C)cccc1O	877143015	YRZRQZWHMIHFNA-JTQLQIEISA-N	236.315	1.315	10	20	BDCD	
CCN(CC)CC(=O)NCc1ccccc1O	299585290	RZGVWZOCCLODCL-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
CC[C@H]1NCC[C@H]1C(=O)NCc1ccccc1O	700654383	RLXHPQGFYKVQKE-VXGBXAGGSA-N	248.326	1.397	10	20	BDCD	
CCn1nccc1CNCc1ccc(N)cc1	1352789464	KDRCEUROLNZFRL-UHFFFAOYSA-N	230.315	1.775	10	20	BDCD	
C[C@H]1COCCN1Cc1ccc(N(C)C)cc1	128522380	NETLLESPOXMQHK-LBPRGKRZSA-N	234.343	1.973	10	20	BDCD	
O=C(O)[C@H]1CCCN(Cc2ccccc2O)C1	38539478	VKVUEAGKYJPBOW-NSHDSACASA-N	235.283	1.689	10	20	BDCD	
Cc1n[nH]c(=NCc2ccccc2O)o1	380204899	VZWSIYJKSSMWNR-UHFFFAOYSA-N	205.217	1.118	10	20	BDCD	
CNC[C@H](C)C(=O)NCc1ccc(N(C)C)cc1	92135704	BOMBDRPPTRBQTL-NSHDSACASA-N	249.358	1.224	10	20	BDCD	
COC(=O)[C@H](C)NCc1cc(F)ccc1O	234539447	ZNWUWPMQVKAEPN-ZETCQYMHSA-N	227.235	1.182	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@H](C)CN)c1	817966896	YBJFFPQBBAMXQT-NXEZZACHSA-N	208.305	1.698	10	20	BDCD	
O=C(O)[C@@H]1CC[C@@H](NCc2ccccc2O)C1	1601795566	CNSNRDZZSMMXHG-MWLCHTKSSA-N	235.283	1.735	10	20	BDCD	
CCN(Cc1ccc(C)cc1O)[C@H]1CCNC1=O	877499168	LZWBQOKAHWYDSC-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
COC[C@@](C)(O)CN[C@@H](C)c1ccccc1O	382548961	GWHJOWAVEJKDJA-GWCFXTLKSA-N	239.315	1.440	10	20	BDCD	
CC(=O)NC1CCN(Cc2ccc(N)cc2)CC1	133708517	RNXOLNUCGOLVNS-UHFFFAOYSA-N	247.342	1.369	10	20	BDCD	
C[C@H](O)CCNCc1c(O)cccc1Cl	83607998	BLEZNUCEFHSQSP-QMMMGPOBSA-N	229.707	1.906	10	20	BDCD	
C[C@@H]1CCCN(Cc2ccccc2O)[C@H]1CN	252219791	YSGNHAYMMQYRNB-YPMHNXCESA-N	234.343	1.951	10	20	BDCD	
COCC[C@@H](CO)NCc1cc(C)ccc1O	282355739	VVLPNMGWAJNMNJ-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
CNCCN[C@H](C)c1ccc(N(C)C)cc1	817953168	OAGOLQLPSXRSIJ-LLVKDONJSA-N	221.348	1.623	10	20	BDCD	
CC[C@@H](NC/C=C/CO)c1ccccc1O	717533781	ZNXRWDODVZPDFP-BTDICHCPSA-N	221.300	1.981	10	20	BDCD	
C[C@H]1C[C@H](C(=O)N[C@H](C)c2ccccc2O)CO1	827946510	KONAMBMXTCCMEZ-AXFHLTTASA-N	249.310	1.994	10	20	BDCD	
C[C@@H](NC(=O)C1(O)CCCC1)c1ccccc1O	827937018	ILELGFYLBFPKRR-SNVBAGLBSA-N	249.310	1.875	10	20	BDCD	
CO[C@H](C)COC(=O)c1cccc(O)c1O	758559917	GZRZMEQIMSXAQQ-SSDOTTSWSA-N	226.228	1.290	10	20	BDCD	
CSCCNCc1cc2c(cc1O)OCO2	68890384	VATPSYSUSFNAKJ-UHFFFAOYSA-N	241.312	1.574	10	20	BDCD	
Nc1ccc(N2CC[C@H]3COC[C@@H]3C2)cc1	409432404	VGPWAEKNWKIKCS-QWRGUYRKSA-N	218.300	1.742	10	20	BDCD	
CC1(C)CN[C@@H]1C(=O)NCc1ccccc1O	710039298	KJCJDIMDKYHEHQ-LLVKDONJSA-N	234.299	1.006	10	20	BDCD	
CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	5097784	JKWXVJGHRJHYCY-CQSZACIVSA-N	249.358	1.491	10	20	BDCD	
CN(C[C@H]1CCOC1)C(=O)Cc1ccc(N)cc1	237240363	MRYJZCWBPKTYLC-GFCCVEGCSA-N	248.326	1.306	10	20	BDCD	
CNC(=O)C[C@@H](C)NCc1cccc(C)c1O	322784276	LXMARSLATKRYHX-SNVBAGLBSA-N	236.315	1.315	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](CCN)C2)c1	723670186	QDTBUDCYPHZLBK-LBPRGKRZSA-N	234.343	1.871	10	20	BDCD	
C[C@H](O)CCNCc1cc(Cl)ccc1O	78780793	HFOMDRBSDDPXMV-QMMMGPOBSA-N	229.707	1.906	10	20	BDCD	
CO[C@H](C)CNCc1cc([N+](=O)[O-])ccc1O	191139759	CJAWQSUOMCJTND-MRVPVSSYSA-N	240.259	1.425	10	20	BDCD	
C[C@H]1C[C@H]1CNC(=O)NCc1ccccc1O	299495915	KRHDJKHXJSSWTK-ONGXEEELSA-N	234.299	1.847	10	20	BDCD	
NOCCCNCc1ccc2c(c1)CCCO2	904455878	ANENIFDZFBPPRL-UHFFFAOYSA-N	236.315	1.382	10	20	BDCD	
CCCCCNC(=O)C(=O)Nc1ccc(N)cc1	841000314	SGRSFBQVKOJFRX-UHFFFAOYSA-N	249.314	1.514	10	20	BDCD	
CC(C)(CN)CC(=O)NCCc1ccc(N)cc1	911781843	CCZDSPALOSUEFF-UHFFFAOYSA-N	249.358	1.303	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2C[C@H](O)C2)c1	720978912	WLKHEBILGAZMLB-UMSPYCQHSA-N	221.300	1.561	10	20	BDCD	
COc1cccc(CNC(=O)C(F)(F)F)c1O	105650433	LHSRBDDBHPIGOT-UHFFFAOYSA-N	249.188	1.579	10	20	BDCD	
C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)C	22220139	TWRGTZBGTDEYEI-QMMMGPOBSA-N	207.277	1.157	10	20	BDCD	
CNCCN(C)Cc1cc(Cl)c(F)cc1O	1578703833	CHTQJATVMSJJQD-UHFFFAOYSA-N	246.713	1.836	10	20	BDCD	
Oc1ccc(F)cc1CN1CCO[C@@H](CF)C1	840955752	YOVQOIQLSBYYLX-NSHDSACASA-N	243.253	1.702	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2cc(F)cc(F)c2O)CO1	708483514	DVXZMKNGTZZYSS-GMSGAONNSA-N	243.253	1.937	10	20	BDCD	
COCCCN(C)C(=O)Cc1ccc(N)cc1	62030132	IVYUZMOPSZZYHM-UHFFFAOYSA-N	236.315	1.306	10	20	BDCD	
NC(=O)[C@@H]1CCCCN1Cc1ccc(N)cc1	42403957	OLYIRYQYUDCCLM-LBPRGKRZSA-N	233.315	1.109	10	20	BDCD	
CO[C@@H](C)CN(C)Cc1ccccc1O	182334432	CNFQWZFFEYJTNV-JTQLQIEISA-N	209.289	1.859	10	20	BDCD	
CNC(=O)[C@H](C)N[C@H]1CCc2cccc(O)c21	297326840	NRWYJKSUEHFPML-WPRPVWTQSA-N	234.299	1.104	10	20	BDCD	
C[C@H](N)C[C@@H](C)NCc1ccc(N(C)C)cc1	817894123	BTJNRLBMZOIQPS-NWDGAFQWSA-N	235.375	1.968	10	20	BDCD	
C[C@H](NCC1(N)CC1)c1ccccc1O	902413456	LUNYUARXBGEEPQ-VIFPVBQESA-N	206.289	1.534	10	20	BDCD	
Cn1ccc(NC(=O)NCc2ccccc2O)n1	730423792	YVDXMLFRJCYRLA-UHFFFAOYSA-N	246.270	1.447	10	20	BDCD	
CN(C(=O)[C@H]1C[C@@H]1F)c1ccc(N)cc1	1522217980	QOMTVEASCOFOHQ-UWVGGRQHSA-N	208.236	1.590	10	20	BDCD	
COc1cc(C)cc(CNCc2cc[nH]n2)c1O	894165712	SELXGPIBVUNMSY-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
Cn1ccc([C@H]2CCCN(CCN=[N+]=[N-])C2)n1	409433040	XAXTVTGPJZGDHG-JTQLQIEISA-N	234.307	1.910	10	20	BDCD	
CCC[C@@H]1CN(C(=O)CN=[N+]=[N-])CC[C@H]1O	409434361	OUMXGGWRZNIASL-RKDXNWHRSA-N	226.280	1.306	10	20	BDCD	
C[C@@H](N[C@H]1CCCNC(=O)C1)c1ccccc1O	877755975	VUSGJEOELNAOQC-MNOVXSKESA-N	248.326	1.712	10	20	BDCD	
CCCN(Cc1nc[nH]n1)Cc1ccccc1O	1327511257	GCPOHBJUSPUZGZ-UHFFFAOYSA-N	246.314	1.923	10	20	BDCD	
C[C@H](C(=O)O)[C@@H](C)NCc1ccc2c(c1)CCO2	901443928	BRGRNHOYYKWIOT-VHSXEESVSA-N	249.310	1.820	10	20	BDCD	
N[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1	708480471	KLENQDVNABHKHQ-SNVBAGLBSA-N	242.269	1.594	10	20	BDCD	
COc1cccc(CN2CC[C@@H](CN)C2)c1O	50245089	HXPUGMXGIRKPQI-JTQLQIEISA-N	236.315	1.181	10	20	BDCD	
CCN(CCO)Cc1cc(F)ccc1O	179870431	AMLBDSIHBKISBQ-UHFFFAOYSA-N	213.252	1.346	10	20	BDCD	
COc1ccc(O)c(CNCC(C)(C)CO)c1	122060491	KXNPYKYOMNQTRV-UHFFFAOYSA-N	239.315	1.509	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@@H]2CC[C@H]2O)c(O)c1	378756480	YIHBNVSUWHXEJN-YUSALJHKSA-N	221.300	1.875	10	20	BDCD	
Cc1nnsc1C(=O)NCc1ccccc1O	228425059	WGDIIPNCCVPCMV-UHFFFAOYSA-N	249.295	1.482	10	20	BDCD	
C[C@H](N)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O	817972904	PJHRPWAXMIJZCF-JGVFFNPUSA-N	239.275	1.298	10	20	BDCD	
O=C(NCCOCC1CC1)c1cc(O)cs1	732290644	VMNBCAYJBZSWDQ-UHFFFAOYSA-N	241.312	1.610	10	20	BDCD	
Nc1ccc(NCC2CCNCC2)cc1	843125740	GWBSMPIZZLHBCF-UHFFFAOYSA-N	205.305	1.680	10	20	BDCD	
CC(C)C[C@H]1CN(C(=O)CN=[N+]=[N-])CC[C@@H]1O	409435400	UKIFTHBFHMVZFN-UWVGGRQHSA-N	240.307	1.552	10	20	BDCD	
CN(CCC(N)=O)Cc1ccc(N(C)C)cc1	274024406	BHFQHEDJEWWTMK-UHFFFAOYSA-N	235.331	1.060	10	20	BDCD	
Nc1ccc(CNC[C@@H]2CCCCN2)cc1	1345159464	HANWSTLJYODUGB-ZDUSSCGKSA-N	219.332	1.501	10	20	BDCD	
C[C@H](CO)NCc1cccc(Cl)c1O	157758930	BWKNZHFROXTGFD-SSDOTTSWSA-N	215.680	1.516	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCc2cc[nH]n2)c1	41014226	QIMWIHCWXSVIDB-SECBINFHSA-N	247.298	1.975	10	20	BDCD	
CCCNCCNCc1ccc(N(C)C)cc1	228719124	WGKHEZCCAGOQJT-UHFFFAOYSA-N	235.375	1.842	10	20	BDCD	
O=C(NCc1ccccc1O)c1cnns1	136334044	ZRQRYYFKMSYXBP-UHFFFAOYSA-N	235.268	1.174	10	20	BDCD	
CN(CC(=O)O)Cc1cc(F)ccc1O	229289341	BEXYUDHPSVIVAC-UHFFFAOYSA-N	213.208	1.048	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@H]1CCCN1	42170062	MALLYQMNNUCPJT-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1	253490097	HLRBVSOSUNDTBY-SSDOTTSWSA-N	209.245	1.165	10	20	BDCD	
OC[C@]1(F)CCN(Cc2ccccc2O)C1	802660976	BLBKWHHVDABBEJ-LBPRGKRZSA-N	225.263	1.299	10	20	BDCD	
CCOc1ccc(CN2CC[C@H](N)C2)c(O)c1	843047424	UXUVONKJKSFTFN-NSHDSACASA-N	236.315	1.324	10	20	BDCD	
CC(C)[C@H](N)CNCc1ccc2c(c1)CCO2	841028161	BWWRFULMKPIYOZ-CYBMUJFWSA-N	234.343	1.694	10	20	BDCD	
CC1(CNC(=O)NCc2ccccc2O)CC1	752019992	ONANOJSVKIJLQX-UHFFFAOYSA-N	234.299	1.992	10	20	BDCD	
Cc1ccc(CN[C@H]2C(=O)NCC[C@H]2C)c(O)c1	877499637	RNAYJPSLONIVJV-ZWNOBZJWSA-N	248.326	1.315	10	20	BDCD	
C[C@H](N[C@@H](C)c1ncnn1C)c1ccccc1O	276698311	VKGVPXKGQMDEAH-UWVGGRQHSA-N	246.314	1.933	10	20	BDCD	
C[C@H]1CCN1C(=O)c1cccc(O)c1O	706850856	XJACNQPPXWFHAY-ZETCQYMHSA-N	207.229	1.332	10	20	BDCD	
CNC[C@@H](C)CNCc1ccc(OC)c(C)c1	1328678547	YGQBZPGACXZMBC-LLVKDONJSA-N	236.359	1.949	10	20	BDCD	
Cc1oc(C(=O)O)cc1COc1cncnc1	1600831997	HGEISHFSPPWCOD-UHFFFAOYSA-N	234.211	1.655	10	20	BDCD	
O=C(O)[C@@H](NCc1cccc(F)c1O)C1CC1	1608550630	WWBKOXGPMHLODW-JTQLQIEISA-N	239.246	1.484	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2C[C@H](O)C2)c1	827826689	KHOOVWSYPQGHCL-MGCOHNPYSA-N	223.272	1.014	10	20	BDCD	
Cc1c[nH]ccc1=NCCc1ccc(O)c(O)c1	811811402	SKMHCZSSRHLTJZ-UHFFFAOYSA-N	244.294	1.878	10	20	BDCD	
COc1cccc(CNCc2n[nH]cc2C)c1O	291703935	ZFKOTBNEBUFIGX-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
Cc1cccc(CN(C)[C@@H](C)CN)c1O	381714513	KVGCRVPACSWWBR-JTQLQIEISA-N	208.305	1.480	10	20	BDCD	
CNC1(C(=O)NCc2ccccc2O)CCC1	310275425	OISDZPYZEAMCHX-UHFFFAOYSA-N	234.299	1.151	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CCCOC2)cc1	62192575	MYVQBBZNGRWRTK-SECBINFHSA-N	220.272	1.634	10	20	BDCD	
CCOC(=O)COCCSc1nccs1	120462506	NGFAFYBNJSTFAV-UHFFFAOYSA-N	247.341	1.815	10	20	BDCD	
CO[C@@H]1CN(c2ccc(N)cc2)C[C@H]1OC	234987261	UQPBKPAXHRNTNW-VXGBXAGGSA-N	222.288	1.119	10	20	BDCD	
COc1cccc(CN[C@H](CO)C(C)C)c1O	92393528	IEEYRQHARBWAHY-LLVKDONJSA-N	239.315	1.507	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](O)C1)c1ccc(F)cc1O	296109880	ZLLODQRRYLWLAD-QNSHHTMESA-N	225.263	1.705	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cc(F)ccc1F	808491457	NTGZFLTUDWGAPJ-UHFFFAOYSA-N	242.177	1.280	10	20	BDCD	
Cc1cc(CN(C)C[C@@H](C)O)ccc1N(C)C	293472032	FAIFZEJACFJQOK-GFCCVEGCSA-N	236.359	1.874	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)C[C@@]1(C)CO	827700459	UKCZMKMPXNKFOI-FZMZJTMJSA-N	235.327	1.843	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1C[C@@]12CCNC2	828015579	JCKLQKFNEFOWKB-SMDDNHRTSA-N	246.310	1.008	10	20	BDCD	
C[C@@H](N)C[C@@H](C)NC(=O)Cc1ccc(N)cc1	843503275	JTDPUANMNLLOTO-NXEZZACHSA-N	235.331	1.053	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]2C)c1	862761399	PXVHBTIXFMGEFZ-GXSJLCMTSA-N	219.284	1.973	10	20	BDCD	
Nc1ccc(CN2CC[C@@]3(CCOC3)C2)cc1	707630093	GLFRGMBTGMGIJM-CQSZACIVSA-N	232.327	1.881	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC1CNC1	1574137735	YPSGAHAHSAHMCQ-UHFFFAOYSA-N	219.332	1.122	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1	1580445517	HPQJVWCGYCMSDP-UPJWGTAASA-N	246.310	1.453	10	20	BDCD	
C[C@@H](O)CN[C@H](C)c1cc(C(=O)O)ccc1O	1593462539	MEEDHNAQPMNZNY-HTQZYQBOSA-N	239.271	1.122	10	20	BDCD	
NC[C@H](NCc1ccc2c(c1)CCO2)C1CC1	841028687	QSCGWDHUPPQQSD-ZDUSSCGKSA-N	232.327	1.448	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1cc(F)ccc1O	235161425	ITDJWMHZCPQLOA-SSDOTTSWSA-N	227.235	1.436	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)N(C)Cc2ccccc2O)CO1	383727404	LKIAHTADMCSODS-PWSUYJOCSA-N	249.310	1.776	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@@H](CN)C2)cc1	44527755	MBRGPNPEIUXUBT-AWEZNQCLSA-N	247.386	1.923	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCSC1	131513770	DRTFJPIYLUNUPU-JTQLQIEISA-N	237.324	1.762	10	20	BDCD	
CNC[C@H]1CCCN1Cc1ccc(N(C)C)cc1	133047993	BTJJWVSIDQKNJO-OAHLLOKOSA-N	247.386	1.936	10	20	BDCD	
CCOC[C@H](O)CN[C@H](C)c1ccccc1O	382449040	HPNOKGNRLCONMW-GHMZBOCLSA-N	239.315	1.440	10	20	BDCD	
CN(Cc1c[nH]nn1)Cc1ccccc1O	284147973	VQWRMGNWAJQXBW-UHFFFAOYSA-N	218.260	1.142	10	20	BDCD	
CC(=O)C(=O)CSc1ccc(Cl)nn1	808020859	PVDVQBJVIHKCAI-UHFFFAOYSA-N	230.676	1.380	10	20	BDCD	
C[C@@H](N[C@H]1CCNC1)c1cc(F)cc(F)c1O	817944968	QLHSIDGVMVKUSC-APPZFPTMSA-N	242.269	1.683	10	20	BDCD	
O=C(NC[C@@H]1CCCOC1)c1cc(O)cs1	732274393	HWKSKOFBMGGJHU-QMMMGPOBSA-N	241.312	1.610	10	20	BDCD	
CN(C)C1(C(=O)NCCc2ccc(N)cc2)CC1	911783510	VTLQPMGBESKIAK-UHFFFAOYSA-N	247.342	1.022	10	20	BDCD	
NC(=O)CCSc1ncc([N+](=O)[O-])s1	858843937	MEOZWBJNMHDKTF-UHFFFAOYSA-N	233.274	1.019	10	20	BDCD	
CN(C(=O)[C@@H](N)CC(F)F)c1ccc(N)cc1	877077751	SSMMNQPZYHSYPM-VIFPVBQESA-N	243.257	1.214	10	20	BDCD	
C[C@@H](C[S@](C)=O)NCc1ccccc1O	164253761	KGQWHRSITWNHOZ-BJOHPYRUSA-N	227.329	1.249	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)c1cnco1	762273833	CVQSBQCIKXCMCM-UHFFFAOYSA-N	248.238	1.058	10	20	BDCD	
COCCN(Cc1ccc(N)cc1)CC(F)F	1337834419	RYCTULDUKKTKQH-UHFFFAOYSA-N	244.285	1.982	10	20	BDCD	
CC(C)(N)CC(=O)NCc1ccc(N)cc1	1346220289	MGHCESBDRNZAOQ-UHFFFAOYSA-N	221.304	1.012	10	20	BDCD	
C[C@@H](NCCCC(=O)O)c1ccccc1O	37418423	FBAOQESOACKDFJ-SECBINFHSA-N	223.272	1.908	10	20	BDCD	
Cc1cccc(CNCCN2CCC2)c1O	309706108	ONLWAGRZGPAOBS-UHFFFAOYSA-N	220.316	1.496	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](O)C2CCC2)c1	316791751	RDCYFKHXZCGUPJ-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
CN(Cc1ncnn1C)c1ccc2c(c1)OCO2	121295362	BEDSCTATWNXUEC-UHFFFAOYSA-N	246.270	1.180	10	20	BDCD	
CN(C(=O)/C=C/c1ccc(O)c(O)c1)C1CC1	180709563	WHHFNPAZWWNPDJ-XVNBXDOJSA-N	233.267	1.732	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccc(=O)[nH]c1	133778059	ZTPDZDLBTGULOA-UHFFFAOYSA-N	244.250	1.011	10	20	BDCD	
C[C@H](NCc1ccccc1O)C(=O)N1CCCC1	134405608	NXIKDWNTTQBMNS-NSHDSACASA-N	248.326	1.493	10	20	BDCD	
CN(Cc1ccccc1O)CC(C)(C)O	264730244	QWLNMLAOAGJIMX-UHFFFAOYSA-N	209.289	1.595	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H]3C[C@H]2C(=O)O3)c1	294826708	PMXBJWDDHJUHNH-MNOVXSKESA-N	233.267	1.200	10	20	BDCD	
Cc1cc(Cl)cc([C@@H](C)NC2CNC2)c1O	817956310	WGZMAMLLKNRBPT-MRVPVSSYSA-N	240.734	1.976	10	20	BDCD	
C[C@@H](CO)NCc1cc(F)c(N(C)C)cc1F	858147053	GSJMQWDJHQYDDB-QMMMGPOBSA-N	244.285	1.501	10	20	BDCD	
CC[C@](C)(O)C(=O)NCc1ccccc1O	934936593	VHMGJCMQOIONEA-LBPRGKRZSA-N	223.272	1.169	10	20	BDCD	
Cc1ccc(CN2CC[C@H](O)C2)c(O)c1	876589804	PEGNFHSLERUCNX-NSHDSACASA-N	207.273	1.267	10	20	BDCD	
C[C@H](N[C@@H](CO)CCF)c1c(O)cccc1F	886632759	DFWJNPMHJRFDEQ-DTWKUNHWSA-N	245.269	1.902	10	20	BDCD	
COC[C@H](O)CN[C@@H](C)c1ccc(F)cc1O	71269116	YHVRXFCUVHGRRE-WCBMZHEXSA-N	243.278	1.189	10	20	BDCD	
COc1ccc(CNC[C@@H](O)C2CC2)cc1C	71302176	MRRLUMLJTYJNSY-CYBMUJFWSA-N	235.327	1.864	10	20	BDCD	
COC1CC(C(=O)Nc2ccc(N)cc2)C1	703424531	MGHPUNJYWJQJCP-UHFFFAOYSA-N	220.272	1.632	10	20	BDCD	
NCCCCNCc1ccc2c(c1)CCCO2	258889507	LDATZAMCTSKOLX-UHFFFAOYSA-N	234.343	1.840	10	20	BDCD	
CN(CCO)Cc1c(O)cccc1Cl	127921995	BMMDVQVAUXEPNV-UHFFFAOYSA-N	215.680	1.470	10	20	BDCD	
O=C(CC[C@H]1CCOC1)NCc1ccccc1O	267644392	ZJOGSYMFSSUMTQ-NSHDSACASA-N	249.310	1.825	10	20	BDCD	
OCC1(CNCc2cc(F)ccc2O)CCC1	183233134	BAKVLZZWXNHWQQ-UHFFFAOYSA-N	239.290	1.784	10	20	BDCD	
Oc1cccc2c1[C@H](NCCOCCF)CC2	705649282	HDXGQGXUNJQWHV-LLVKDONJSA-N	239.290	1.955	10	20	BDCD	
C[C@H](NC[C@@H]1CCN1C)c1cc(F)ccc1O	712596588	VCFOZTXVDYJMFZ-ONGXEEELSA-N	238.306	1.886	10	20	BDCD	
O=C(NC1CCOCC1)c1cccc(O)c1O	126266619	GOQMAQHOVBBMSR-UHFFFAOYSA-N	237.255	1.007	10	20	BDCD	
CN(Cc1c(O)cccc1Cl)[C@H]1CCNC1	128327094	YCWWYTYBFFTVFO-VIFPVBQESA-N	240.734	1.839	10	20	BDCD	
Cc1ccc(O)c(CN2CC(=O)N[C@H](C)C2)c1	295121623	XKYGWRHTVCFKBH-SNVBAGLBSA-N	234.299	1.021	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)c1cnn(C)c1	817955788	HTLPIPUEQIHXPE-LLVKDONJSA-N	244.342	1.896	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)CCCN)c1	841081372	WBMNQUBSWVRPOH-NSHDSACASA-N	222.332	1.918	10	20	BDCD	
CCOC[C@H](C)NCCc1ccc(N)cc1	841036576	WFSJZKPUUKWKBA-NSHDSACASA-N	222.332	1.826	10	20	BDCD	
Cc1cccc(O)c1CNC/C=C\CO	877624791	RWSZOXLBBNWJBU-IHWYPQMZSA-N	207.273	1.339	10	20	BDCD	
C[C@H](O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1	775407797	WMPJOGAOFVULFD-ZJUUUORDSA-N	236.315	1.311	10	20	BDCD	
CC1(NCc2ccc3c(c2)CCCO3)COC1	895754252	MHUKKBSWJZUACD-UHFFFAOYSA-N	233.311	1.890	10	20	BDCD	
C[C@@H]1NCCN(Cc2ccc(N)cc2)[C@@H]1C	1334773978	BVUPSTIZVQALEL-WDEREUQCSA-N	219.332	1.451	10	20	BDCD	
CON(C)CCN[C@@H](C)c1cc(C)ccc1O	850478985	JGRGCPVILFECPJ-NSHDSACASA-N	238.331	1.844	10	20	BDCD	
CN1CC[C@@H]1CN[C@@H]1CCc2cccc(O)c21	712581810	PSYZIFWNDNLLNS-VXGBXAGGSA-N	232.327	1.673	10	20	BDCD	
CC[C@H]1CN(Cc2ccccc2O)C[C@@H]1O	272378024	HIESWTNHJVMHHW-GWCFXTLKSA-N	221.300	1.595	10	20	BDCD	
C[C@H]1CSC[C@@H]1NC(=O)c1cc(O)cs1	807692531	ZSIGOEPJJIKWNZ-XPUUQOCRSA-N	243.353	1.935	10	20	BDCD	
C[C@@H](CN)N[C@@H](C)c1cc(F)cc(F)c1O	817969362	CPRHXCGBDGRQNH-BQBZGAKWSA-N	230.258	1.668	10	20	BDCD	
CCN[C@H](C)CN[C@@H]1CCc2cccc(O)c21	817974067	XSCMLULMJMVESA-ZYHUDNBSSA-N	234.343	1.967	10	20	BDCD	
O=C(CCO)NCc1ccc(N2CCCC2)cc1	902799427	IWUMXCJFNMXFKZ-UHFFFAOYSA-N	248.326	1.285	10	20	BDCD	
CON(C)Cc1c(O)ccc2ccncc12	835025434	VJQXOMUAEAHDML-UHFFFAOYSA-N	218.256	1.934	10	20	BDCD	
CCC[C@@H](CNC(=O)c1cc(O)cs1)OC	833372277	PFPIUFOTFXXLKM-VIFPVBQESA-N	243.328	1.999	10	20	BDCD	
CC(C)(N)CNCc1cc(Cl)ccc1O	841031575	WTQMKZMUJNGGEU-UHFFFAOYSA-N	228.723	1.873	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1N	1120263588	SLBFGUALBDLJBX-GWCFXTLKSA-N	219.332	1.438	10	20	BDCD	
CCCCN(C)C(=O)CN1CC(N=[N+]=[N-])C1	409423653	QCRDCWXGXAKVST-UHFFFAOYSA-N	225.296	1.239	10	20	BDCD	
CCN=c1nc(Nc2ccc(N)cc2)cc[nH]1	409428089	LSRFZASAQSFBCT-UHFFFAOYSA-N	229.287	1.656	10	20	BDCD	
Cc1cccc(CNCCc2ccnn2C)c1O	231036720	HTEIZYNHPHSIRT-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
Cc1cccc(O)c1CNCc1cn(C)nn1	877194453	MXVFNFIDWKVTKY-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
Cc1ccc(CNCCc2n[nH]c(C)n2)c(O)c1	877180235	SEUNHOFWKWNLJF-UHFFFAOYSA-N	246.314	1.459	10	20	BDCD	
C[C@@H](NCc1cnnn1C)c1ccccc1O	287465632	WBXCVXXDJHWYIQ-SECBINFHSA-N	232.287	1.372	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](CO)C1)c1cc(F)ccc1O	927146989	HROIXPWZKAUWDK-FXPVBKGRSA-N	239.290	1.953	10	20	BDCD	
CCOC(=O)CN(CC)Cc1ccc(N)cc1	35361335	HTKHCRXXNBDQJV-UHFFFAOYSA-N	236.315	1.654	10	20	BDCD	
C[C@H](NCCCCN)c1ccccc1O	37714788	BTSBLHWHXROTCK-JTQLQIEISA-N	208.305	1.782	10	20	BDCD	
C[C@H](NC[C@@H]1COCCN1)c1ccccc1O	530218585	CVRWBYJEPWMBMJ-WDEREUQCSA-N	236.315	1.031	10	20	BDCD	
Oc1cccc2c1[C@H](NC1CCNCC1)CC2	817937254	VZZYZKYPRSGBOY-GFCCVEGCSA-N	232.327	1.721	10	20	BDCD	
Oc1cccc2c1[C@@H](NCC1CCNCC1)CC2	817941788	RRWVHZBFXUGTPC-ZDUSSCGKSA-N	246.354	1.969	10	20	BDCD	
CC(=O)[C@H](C)OC(=O)c1cc(O)cs1	732354474	NFAMUXFBAPGALA-LURJTMIESA-N	214.242	1.588	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)c2nonc2C)c1	862759752	IHCILJOTKWETLV-UHFFFAOYSA-N	247.254	1.322	10	20	BDCD	
C[C@H](N)[C@H]1CCN(Cc2ccc(N)cc2)C1	1334753480	FFHYEKMCJBSBQH-JQWIXIFHSA-N	219.332	1.438	10	20	BDCD	
C[C@]1(CN)CCN(Cc2ccc(N)cc2)C1	1345159313	GBTAMRWOIUBNRV-CYBMUJFWSA-N	219.332	1.440	10	20	BDCD	
CNC(=S)NCc1ccc(N(C)C)cc1	7371515	NDUSQJFWLDAAOB-UHFFFAOYSA-N	223.345	1.347	10	20	BDCD	
CC(C)[C@H](O)CN[C@@H]1CCc2cccc(O)c21	297613960	IREDGLKZDKQTQM-DGCLKSJQSA-N	235.327	1.986	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCO3)CO1	402024793	GLZAACGWZVRGPM-ZWNOBZJWSA-N	233.311	1.889	10	20	BDCD	
CNC(=O)C[C@H](C)NCc1cc(F)ccc1O	323039845	OIXZRNTXKFKLBG-QMMMGPOBSA-N	240.278	1.146	10	20	BDCD	
COC[C@@H](C)CNCc1cc(F)ccc1O	226587911	WNRHVQSDFNJVNP-VIFPVBQESA-N	227.279	1.903	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCNC2)cc1	86725479	AOPUOEKIWQHKGX-GFCCVEGCSA-N	219.332	1.204	10	20	BDCD	
C[C@@H](N[C@H]1CCN(C)C1)c1ccccc1O	42544123	APWITNXQFKBVDN-MNOVXSKESA-N	220.316	1.747	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cc(Cl)ccc1O	42304434	KQNGMFZWOAKCAQ-SSDOTTSWSA-N	243.690	1.697	10	20	BDCD	
COC[C@@H](CO)N[C@H](C)c1cc(C)ccc1O	234898387	PPNDVANZNWUBSY-GHMZBOCLSA-N	239.315	1.359	10	20	BDCD	
COC[C@@H](CO)N[C@H](C)c1ccccc1O	234901155	VDEGACKVQUGGBT-NXEZZACHSA-N	225.288	1.050	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1c(F)cccc1F	808488228	CGTAZJGENVGXGR-UHFFFAOYSA-N	242.177	1.280	10	20	BDCD	
COc1cccc([C@@H](C)N[C@@H](C)CCO)c1O	846148456	ZQIAZJMAXXYUFA-VHSXEESVSA-N	239.315	1.822	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCCN[C@H]2C)c1	841065573	QRLQCXLMLDMUDE-AAEUAGOBSA-N	234.343	1.931	10	20	BDCD	
CN(C(=O)CCCCN)c1ccc(N)cc1	877077785	URKREGJXKHTUSF-UHFFFAOYSA-N	221.304	1.361	10	20	BDCD	
Cc1ccc([C@H](C)N[C@@H]2CC(=O)N(C)C2)c(O)c1	273612487	WLQPPFWFXAPTTN-WDEREUQCSA-N	248.326	1.582	10	20	BDCD	
O=C(Nc1cn[nH]c1)c1c(F)ccc(O)c1O	790069754	RQJVFSOJDFRJKM-UHFFFAOYSA-N	237.190	1.212	10	20	BDCD	
C[C@H](N)C[C@H](C)NCc1ccc(N)cc1	1336284929	DXKONDUVQGTBMB-UWVGGRQHSA-N	207.321	1.484	10	20	BDCD	
CCn1[nH]cnc1=NCc1ccc(N(C)C)cc1	1354029482	QRPFYMAZRYEPRR-UHFFFAOYSA-N	245.330	1.398	10	20	BDCD	
CCN(C)c1ccc(CN2CCN[C@H](C)C2)cc1	1577658125	XEJSMKLEOVEHFZ-CYBMUJFWSA-N	247.386	1.936	10	20	BDCD	
C[C@H](CC(N)=O)N[C@H](C)c1ccc(F)cc1O	168828310	WALTZGSTMGJHEM-HTQZYQBOSA-N	240.278	1.446	10	20	BDCD	
C[C@@H]1C[C@H](CN)CN1Cc1ccc(N(C)C)cc1	216058656	JZIPFPQVEOOPHS-TZMCWYRMSA-N	247.386	1.922	10	20	BDCD	
O=C(NCCC(F)(F)F)c1cccc(O)c1O	126405317	NLQXWOCFYZHCSS-UHFFFAOYSA-N	249.188	1.780	10	20	BDCD	
CC[C@H](NC[C@H](C)N)c1ccccc1O	817974006	XIPRRAVLJKVWCY-ONGXEEELSA-N	208.305	1.780	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC[C@H](C)N)c1	817972706	NVQDJRBLEZNTMH-VHSXEESVSA-N	208.305	1.698	10	20	BDCD	
CCOCCc1nc(Cc2ccc(N)cc2)no1	843159440	PMDGCMOOVHLPDJ-UHFFFAOYSA-N	247.298	1.822	10	20	BDCD	
CN1C(=O)CCC[C@H]1C(=O)Nc1ccc(N)cc1	911660985	QMXVOAQVCHTEPS-NSHDSACASA-N	247.298	1.218	10	20	BDCD	
Cc1cccc(CN2C[C@H](C)N[C@H](C)C2)c1O	843049754	VPZGBYUJKJGTEB-TXEJJXNPSA-N	234.343	1.883	10	20	BDCD	
CCOc1ccc(CN[C@@H]2CCNC2)c(O)c1	841045417	URSGMHLZNPNYPD-LLVKDONJSA-N	236.315	1.242	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@@H]2CCNC2=O)cc1C	758398393	NOXJVKPWNVHYHY-GFCCVEGCSA-N	248.326	1.329	10	20	BDCD	
CNC(=O)[C@@H]1CCC[C@H]1NCc1ccccc1O	765794969	GOLGTKMDZJJSCX-VXGBXAGGSA-N	248.326	1.397	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@@H]1[C@H]2CCC[C@H]21	1123977417	FLINFUIJXMDGJE-IAZYJMLFSA-N	247.294	1.760	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H](N)CC2CC2)cc1	83360035	LUGIABRJXUAANQ-GFCCVEGCSA-N	233.315	1.012	10	20	BDCD	
CC(C)[C@@H](N)C(=O)N(C)Cc1ccccc1O	37823738	UFHNDKUQXBQRKJ-GFCCVEGCSA-N	236.315	1.334	10	20	BDCD	
CN1CCC(C(=O)NCc2ccccc2O)CC1	269173651	ZWDRJBSASUDILY-UHFFFAOYSA-N	248.326	1.350	10	20	BDCD	
Cn1ccc(CN[C@@H]2CCc3cccc(O)c32)n1	386205794	MAQMUVNSAVDRFD-GFCCVEGCSA-N	243.310	1.903	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@H](F)C1	824570267	ABOCJQPLMIVCDV-VIFPVBQESA-N	225.263	1.945	10	20	BDCD	
COc1ccc(O)c(CNC2([C@H](C)O)CC2)c1	827585277	DNBDZOYFMBCWHO-VIFPVBQESA-N	237.299	1.404	10	20	BDCD	
C[C@@H](NC(=O)CNC1CC1)c1ccccc1O	870988370	NVSKQQOOFOYSNE-SECBINFHSA-N	234.299	1.321	10	20	BDCD	
C[C@H](Cn1cccn1)NCc1ccc(N)cc1	1345160752	YGSAIHARQUDGFC-LLVKDONJSA-N	230.315	1.644	10	20	BDCD	
COCC(=O)NCc1ccc(N(C)C)cc1	24378331	QMKCNEGFSQIYIN-UHFFFAOYSA-N	222.288	1.015	10	20	BDCD	
CC(C)[C@@](C)(O)CNCc1ccccc1O	123279178	UBZYWAQVUCRSIA-ZDUSSCGKSA-N	223.316	1.889	10	20	BDCD	
Nc1ccc(CN2CCC[C@@H](CCO)C2)cc1	227390474	UEQRERWFTXOJJV-LBPRGKRZSA-N	234.343	1.863	10	20	BDCD	
CC1CC(NC(=O)NCc2ccccc2O)C1	267830133	INCUGXXVBNSLEW-UHFFFAOYSA-N	234.299	1.990	10	20	BDCD	
C[C@@H]1C[C@H]1CNC[C@H](N)c1ccc(N(C)C)cc1	841040919	COBYQWHBZIHSHT-ZLDLUXBVSA-N	247.386	1.998	10	20	BDCD	
Cc1cc(O)c(CN2CCC(N)CC2)cc1C	843047024	DHRBZDPKBPZGRQ-UHFFFAOYSA-N	234.343	1.932	10	20	BDCD	
CO[C@@H](C)Cc1nc(Cc2ccc(N)cc2)no1	843160649	ZJMKJZXRFZWHJQ-VIFPVBQESA-N	247.298	1.820	10	20	BDCD	
COCC[C@H](C)OC(=O)c1cccc(O)c1O	784787617	KJJMOULDABUITM-QMMMGPOBSA-N	240.255	1.680	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H]1O	785765156	SLHXKDRMSNCWFD-RISCZKNCSA-N	234.343	1.565	10	20	BDCD	
CN1CC[C@H](NCc2cccc(Cl)c2O)C1	162861380	KQUSQGYUGUCHFX-JTQLQIEISA-N	240.734	1.839	10	20	BDCD	
Cc1cccc(CN2CCO[C@H](CF)C2)c1O	840955702	YHNHHMAVGVDMCV-GFCCVEGCSA-N	239.290	1.871	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1CCOC1)CCO2	37739027	IXAHFTDHBWXIHP-GFCCVEGCSA-N	233.311	1.748	10	20	BDCD	
CN(CCCC(=O)O)Cc1ccccc1O	83414387	XANPQNYCVFJNOJ-UHFFFAOYSA-N	223.272	1.689	10	20	BDCD	
COC1(CC(=O)NCc2ccccc2O)CCC1	234605433	LPUBHRLPQSULKV-UHFFFAOYSA-N	249.310	1.968	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(F)cc1	808489004	XXSXICSSTWKFIE-UHFFFAOYSA-N	224.187	1.141	10	20	BDCD	
Cc1ccc([C@H](C)NCCCON)c(O)c1C	902426406	SJZAYNAIIGYXMQ-NSHDSACASA-N	238.331	1.940	10	20	BDCD	
CC[C@H](C)NC(=S)NCc1cccn1C	743062187	UQUAWTKHAJJEFB-VIFPVBQESA-N	225.361	1.788	10	20	BDCD	
CCC(O)(CC)CNC(=O)c1cc(O)cs1	743712829	WDGBHJAKGUZXCK-UHFFFAOYSA-N	243.328	1.735	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(F)c2O)C[C@@H](C)N1	843048944	BGZBMWVXYXRMAW-NXEZZACHSA-N	238.306	1.714	10	20	BDCD	
CN[C@H]1CCCN(Cc2cccc(F)c2O)C1	843048540	GBULESLBFGFIOZ-NSHDSACASA-N	238.306	1.715	10	20	BDCD	
CC1(CNC(=O)c2cc(O)cs2)CC1	752820258	IWHNGFFQCTXXAJ-UHFFFAOYSA-N	211.286	1.984	10	20	BDCD	
Cc1ccc(C(=O)N2CC[C@H]3C[C@H]3C2)c(O)c1O	856060694	ATORDSXQUUSHIJ-UWVGGRQHSA-N	247.294	1.888	10	20	BDCD	
Nc1ccc(CNC(=O)CC2CCOCC2)cc1	1342698635	GWBGPOQLCRSIIC-UHFFFAOYSA-N	248.326	1.702	10	20	BDCD	
OCc1ccnc(NCc2ccccc2O)n1	767182934	NQLWLYVTAVIXJB-UHFFFAOYSA-N	231.255	1.287	10	20	BDCD	
Cc1ccc(O)c(CNCc2ncc[nH]2)c1	70646305	YPIBKTBYFYOPCR-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
C[C@@H](CCO)N(C)Cc1cc(F)cc(F)c1O	895149180	CTCLTFOBHHPOCP-QMMMGPOBSA-N	245.269	1.873	10	20	BDCD	
Cc1cccc(CNCC2(O)CCC2)c1O	162639090	IPDAHXVZDQUSNB-UHFFFAOYSA-N	221.300	1.705	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C(C)(C)F)c1	156879561	GYWKUVYGAYGWDG-UHFFFAOYSA-N	241.262	1.765	10	20	BDCD	
CN(C)c1ccc(CNc2ncn(C)n2)cc1	292328159	CKYAOIBQYZPGGK-UHFFFAOYSA-N	231.303	1.493	10	20	BDCD	
O=C(O)c1nccnc1Sc1nccs1	54554283	LZSBEXAZBWRBIL-UHFFFAOYSA-N	239.281	1.783	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2CCSC2)cc1	226357233	MAOQIORUMYZIOQ-NSHDSACASA-N	236.340	1.433	10	20	BDCD	
CC[C@@H](CNC(=O)c1cc(O)cs1)OC	812368972	GOQGUMNEGHEKAJ-QMMMGPOBSA-N	229.301	1.609	10	20	BDCD	
CC1(C)[C@@H](NC(=O)Cc2ccc(N)cc2)C[C@H]1N	884348436	ZFIGXWRVXIIBTA-NEPJUHHUSA-N	247.342	1.053	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCc2nc[nH]c2C1	861762796	GCOHHZMSDUEPHQ-UHFFFAOYSA-N	249.295	1.375	10	20	BDCD	
CN(C(=O)[C@@H]1C[C@H]1F)c1ccc(N)cc1	1522217978	QOMTVEASCOFOHQ-NXEZZACHSA-N	208.236	1.590	10	20	BDCD	
CCO[C@H](CC)C(=O)NCc1ccccc1O	769364247	ZGAOGRCHMQGXAD-GFCCVEGCSA-N	237.299	1.824	10	20	BDCD	
Nc1ccc(CNC[C@@H]2CCCN2)cc1	1335287764	AXLXCSKYBFUZCJ-LBPRGKRZSA-N	205.305	1.110	10	20	BDCD	
C[C@]1(NCc2ccc(F)c(F)c2O)CCNC1	1576545879	TYQJBYUVDUTREV-LBPRGKRZSA-N	242.269	1.512	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@](C)(O)C1CC1	877028655	CFGVHBCSEBKTLH-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
CC1(C)[C@@H]2CN(C(=O)c3cccc(O)c3O)C[C@H]21	193097139	WVJJDVGOQSWPLF-NXEZZACHSA-N	247.294	1.826	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)[C@@H](C)CN1	83117998	QNEFQDUMHVTGAF-QWRGUYRKSA-N	220.316	1.574	10	20	BDCD	
Oc1ccc(F)cc1CNCC1(O)CCCC1	226608880	NUFBTUNKYUMEAO-UHFFFAOYSA-N	239.290	1.926	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2C[C@@]23CCNC3)cc1	376245055	OQIDGYIHSVUQHU-WCQYABFASA-N	231.299	1.207	10	20	BDCD	
C[C@H]1NCCC[C@H]1C(=O)Nc1ccc(N)cc1	294866569	WHPMRYCPJYNYTR-BXKDBHETSA-N	233.315	1.595	10	20	BDCD	
C[C@@H](N)CN[C@H](C)c1ccc(N(C)C)cc1	817972183	UWPPINVTCIYUCL-GHMZBOCLSA-N	221.348	1.750	10	20	BDCD	
CCS(=O)(=O)NCc1cc(Cl)ccc1O	845995905	IOUJXQGQVBNEQR-UHFFFAOYSA-N	249.719	1.485	10	20	BDCD	
NCC[C@@H](NCc1ccccc1O)C(F)(F)F	841091296	XHQDPJKJBBTBLW-SNVBAGLBSA-N	248.248	1.762	10	20	BDCD	
Cc1cc(O)c(CN[C@H](CN)C2CC2)cc1C	841027657	DTYZWRVHVPQZRY-CYBMUJFWSA-N	234.343	1.836	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)OCC1CC1	867416877	IKHZSJPMFPYWAK-UHFFFAOYSA-N	237.255	1.734	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)OC1CCC1	867416998	KXROZUCZTILOEO-UHFFFAOYSA-N	237.255	1.877	10	20	BDCD	
Cc1ccc(CN(C)CC(=O)NC2CC2)c(O)c1	876549885	YHGHRYORCGHCQF-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
C[C@@H](Nc1cnn(CCO)c1)c1ccccc1O	783527955	KCWWQWYDMQCSGL-SNVBAGLBSA-N	247.298	1.754	10	20	BDCD	
CCO[C@H]1CN(c2ccc(N)cc2)C[C@H]1OC	409432745	LTYRVCWUHFJDOP-OLZOCXBDSA-N	236.315	1.509	10	20	BDCD	
CC[C@@H](NCc1ccccc1O)[C@H](C)O	395372178	VAVRPNFYCPEUKL-GXSJLCMTSA-N	209.289	1.641	10	20	BDCD	
c1cc2c(cc1CNC1CSC1)CCO2	701973828	ROZZTFAYMOEAFW-UHFFFAOYSA-N	221.325	1.827	10	20	BDCD	
CC(C)CC[C@@H](N)C(=O)NCc1ccc(N)cc1	1263304256	XAGBREMBPZHWMH-CYBMUJFWSA-N	249.358	1.649	10	20	BDCD	
Nc1ccc(CNC(=O)CC[C@@H]2CCNC2)cc1	1343473916	RVFBSTKVQFFZPV-GFCCVEGCSA-N	247.342	1.275	10	20	BDCD	
C/C(=C/C(=O)O)CN(C)c1ccc2c(c1)OCO2	1602954088	ANDPYVQCUQPBLV-UITAMQMPSA-N	249.266	1.882	10	20	BDCD	
C[C@H](CSc1ncc([N+](=O)[O-])s1)C(=O)O	226766125	QMCDSXKUJRMHFD-SCSAIBSYSA-N	248.285	1.864	10	20	BDCD	
COc1cccc(O)c1CN(C)C[C@H](C)N	863653175	DRMROXVRCXSLAD-VIFPVBQESA-N	224.304	1.180	10	20	BDCD	
COC[C@@H](C)NCc1cccc(OC)c1O	19904652	VWPCASGGWYOJPE-SECBINFHSA-N	225.288	1.525	10	20	BDCD	
CC(C)NC(=O)[C@@H](C)NCc1ccccc1O	167879079	MASLDVGJXUUWIF-SNVBAGLBSA-N	236.315	1.395	10	20	BDCD	
Cc1cccc(CN2CCO[C@@H](CF)C2)c1O	840955704	YHNHHMAVGVDMCV-LBPRGKRZSA-N	239.290	1.871	10	20	BDCD	
Cc1cccc(CNC[C@H]2CCCNC2)c1O	841033566	VOIHJPHFCGQSIA-LBPRGKRZSA-N	234.343	1.790	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](N)C2)c1O	309625052	PYEFGQXGGGSROE-LLVKDONJSA-N	206.289	1.234	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2C[C@@H](O)C2)cc1	720994362	JZQBQFWSQSDCTH-XBXGTLAGSA-N	234.343	1.613	10	20	BDCD	
CC(C)[C@](C)(O)CNCc1ccccc1O	123279004	UBZYWAQVUCRSIA-CYBMUJFWSA-N	223.316	1.889	10	20	BDCD	
C[C@H]1CCNC(=O)[C@@H]1NCc1ccccc1O	193687294	BUNGSUKQRXSLDE-JOYOIKCWSA-N	234.299	1.006	10	20	BDCD	
OCCN(Cc1cc(F)ccc1O)C1CCC1	276117603	XXRFNSBLIUWWDI-UHFFFAOYSA-N	239.290	1.878	10	20	BDCD	
CCOc1ccc(N(CC)CC(N)=O)cc1	299390392	JJJXVBHGSDMNRL-UHFFFAOYSA-N	222.288	1.397	10	20	BDCD	
Oc1ccccc1CNC(=S)NC1CCC1	814196337	APOPWWQUULXITC-UHFFFAOYSA-N	236.340	1.909	10	20	BDCD	
O=C(O)[C@@H]1CCN(Cc2cccc(F)c2O)C1	821511327	HZSUTJGSWYQUSW-SECBINFHSA-N	239.246	1.438	10	20	BDCD	
C[C@@H](NCCCON)c1cc(F)ccc1O	902426118	QRGDUQKRLVVONB-MRVPVSSYSA-N	228.267	1.462	10	20	BDCD	
COc1cc(C)cc(CN2CC[C@@H]2CO)c1O	902629257	ARVGDIKOIIGDRH-LLVKDONJSA-N	237.299	1.276	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@H](O)CC1	854671564	LEQJEGIYFLTGQZ-QMMMGPOBSA-N	241.312	1.441	10	20	BDCD	
C[C@@H]1OCCN(C(=O)c2cc(O)cs2)[C@@H]1C	768258304	OAUGQKPDNDRFKY-SFYZADRCSA-N	241.312	1.703	10	20	BDCD	
CN(C(=O)[C@]1(C)CCNC1)c1ccc(N)cc1	877079015	NVEXKBOHNDVLBS-CYBMUJFWSA-N	233.315	1.231	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCN(C2CCCC2)CC1	409433928	ZHMMBQJFNXDVAF-UHFFFAOYSA-N	237.307	1.384	10	20	BDCD	
CC[C@H](NC)C(=O)NCc1ccccc1O	692021568	NBPSQGSMVDRXKS-JTQLQIEISA-N	222.288	1.006	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H](C(=O)O)[C@H]1C	1600543484	YWLCDJMWQJUTAY-MNOVXSKESA-N	249.310	1.996	10	20	BDCD	
C[C@@H](N)CN[C@H](C)c1cc(C(=O)O)ccc1O	1604260748	YRZSNSJWUZYLEF-HTQZYQBOSA-N	238.287	1.088	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@@H](C)c1ccccc1O	163988377	JRLIEGIHMNPHAY-IUCAKERBSA-N	222.288	1.307	10	20	BDCD	
Cc1cccc(CN[C@H]2CCCNCC2)c1O	841058581	SYXUCLUWFTZHDM-ZDUSSCGKSA-N	234.343	1.932	10	20	BDCD	
CO[C@H]1CC[C@@H](NC(=O)Cc2ccc(N)cc2)C1	235013209	DFSQQNWBROWMNB-OLZOCXBDSA-N	248.326	1.495	10	20	BDCD	
Oc1cccc2c1[C@H](NCC1(O)CCC1)CC2	383723277	YTVJJMFAIBYCKJ-LLVKDONJSA-N	233.311	1.884	10	20	BDCD	
CO[C@@H](C)[C@@H](C)NCc1ccccc1O	133140190	UDNXNDAMHZTKIO-ZJUUUORDSA-N	209.289	1.905	10	20	BDCD	
Cc1n[nH]cc1CNCc1ccccc1O	38011109	PRFIYNPSHMPMNA-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
O=C(O)C[C@@H]1CCCN1Cc1ccccc1O	86791301	DYHQHZZSBLTANY-NSHDSACASA-N	235.283	1.831	10	20	BDCD	
CCNC(=O)N(C)Cc1ccccc1O	46906103	ZSASCNFLFNSKME-UHFFFAOYSA-N	208.261	1.554	10	20	BDCD	
CN(C)c1ccc(CN2C[C@@H](O)C(C)(C)C2)cc1	279961766	YJFPGJDNGOMTBR-CQSZACIVSA-N	248.370	1.955	10	20	BDCD	
Oc1cccc2c1[C@H](NCC1=CCNCC1)CC2	817968139	PWYYSESCRAPVMM-CYBMUJFWSA-N	244.338	1.889	10	20	BDCD	
O=C(N[C@H]1CCC[C@H]1CO)c1cc(O)cs1	839790085	MDQRFTQMKYYQKO-CBAPKCEASA-N	241.312	1.345	10	20	BDCD	
COc1cccc(CNC(=O)CCCF)c1O	830540493	LCDAICKZNADKKJ-UHFFFAOYSA-N	241.262	1.767	10	20	BDCD	
CC1(C)CCN[C@@H]1C(=O)Nc1ccc(N)cc1	852789772	FPNRUGQHEPBUJH-LLVKDONJSA-N	233.315	1.595	10	20	BDCD	
Cc1ccc(C(=O)OCCCF)c(O)c1O	767319621	OLZGXPXGZRNNND-UHFFFAOYSA-N	228.219	1.923	10	20	BDCD	
CCOc1ccc(CNC2(C)COC2)c(O)c1	877691187	KPCGMLIKBVVTND-UHFFFAOYSA-N	237.299	1.669	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOC[C@H]2CCC[C@@H]21	409429410	RPGLHFFQMUJAAY-BDAKNGLRSA-N	224.264	1.324	10	20	BDCD	
COC(=O)C[C@H](N)c1cc(F)ccc1O	95638378	QWYDJKUUVMGCNN-QMMMGPOBSA-N	213.208	1.094	10	20	BDCD	
CC(C)OC(=O)CN(C)Cc1ccccc1O	1322868440	HCGJWRSFGWLVRU-UHFFFAOYSA-N	237.299	1.776	10	20	BDCD	
CC(C)CC[C@H](N)C(=O)NCc1ccc(N)cc1	1263304257	XAGBREMBPZHWMH-ZDUSSCGKSA-N	249.358	1.649	10	20	BDCD	
CC[C@H](COC)NCc1c(O)cccc1OC	850151005	QECKFCAABPUUKO-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
CN(C)c1noc(Cc2ccc(N)cc2)n1	158836373	GYMJOFQKZWPQAZ-UHFFFAOYSA-N	218.260	1.309	10	20	BDCD	
Nc1ccc(NC(=O)C[C@@H]2CCCN2)cc1	160436055	MQMWLKFEZVVNSE-NSHDSACASA-N	219.288	1.349	10	20	BDCD	
Cc1ccc(CN2CCO[C@@H](CF)C2)c(O)c1	877586495	HLPXCYNIOKIFOK-LBPRGKRZSA-N	239.290	1.871	10	20	BDCD	
COc1cccc(O)c1CNCc1ncc[nH]1	877674901	WQTDEUHXNXWUSR-UHFFFAOYSA-N	233.271	1.414	10	20	BDCD	
Cc1ncoc1C(=O)N(C)Cc1ccccc1O	394873613	FLONEDXVJYGLMR-UHFFFAOYSA-N	246.266	1.961	10	20	BDCD	
O=C(NCc1ccccc1O)c1cccnc1O	133765122	UMYVPUUHWSGWJH-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@@H]1CCOC1	41046010	SWOOMXJUSVTUIT-LBPRGKRZSA-N	220.316	1.737	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@H](C)C(=O)O)c1	86756622	LVJQJTGWTGVNPE-MRVPVSSYSA-N	239.271	1.306	10	20	BDCD	
CN(C)c1ccc(CNC2CC(N)C2)cc1	87651244	MFKLPHRIVZGSFK-UHFFFAOYSA-N	219.332	1.332	10	20	BDCD	
COc1ccc(N(C)CCCN)cc1F	82595214	MAUBWJZYCRMOBW-UHFFFAOYSA-N	212.268	1.619	10	20	BDCD	
CN(C)CCCN[C@@H]1CCc2cccc(O)c21	296126482	VPBFAMLFJOBPJI-GFCCVEGCSA-N	234.343	1.921	10	20	BDCD	
CCO[C@@H](C)C(=O)NCc1ccc(O)c(O)c1	269057952	AKRPWNQCXNOFSP-QMMMGPOBSA-N	239.271	1.139	10	20	BDCD	
Cn1ccnc1CNC(=O)c1cc(O)cs1	732286055	OACSEPJTVCYNRL-UHFFFAOYSA-N	237.284	1.117	10	20	BDCD	
COc1cccc([C@@H](C)N[C@@H]2CC[C@H]2O)c1O	846175350	YQOWLHAQYUURLD-FBIMIBRVSA-N	237.299	1.575	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H]3C[C@]3(CO)C2)c1	783734555	MQUWQRGQFOJVPM-BXUZGUMPSA-N	249.310	1.215	10	20	BDCD	
CC[C@H](NCc1cc(F)ccc1O)[C@@H](C)O	386728550	ARUAUBDJMVGVLL-KCJUWKMLSA-N	227.279	1.780	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC[C@H](C(F)F)C1	409428370	MHUGIWLSABVZOZ-LURJTMIESA-N	218.207	1.800	10	20	BDCD	
CCCN(CCC)C(=O)CN1CC(N=[N+]=[N-])C1	409423591	PIAKTJNLVNSYQU-UHFFFAOYSA-N	239.323	1.630	10	20	BDCD	
O=C(O)[C@H](CC1CC1)NCc1ccccc1O	1334776628	HGFMEIRSAOCMAV-NSHDSACASA-N	235.283	1.735	10	20	BDCD	
C[C@H]1OCCN(C(=O)Cc2ccc(N)cc2)[C@@H]1C	125312109	FYBNZDQISKLHNY-GHMZBOCLSA-N	248.326	1.447	10	20	BDCD	
CC1(C)[C@@H](NC(=O)Nc2ccc(N)cc2)C[C@H]1O	841296547	UZDZZUKOURAXQG-WDEREUQCSA-N	249.314	1.550	10	20	BDCD	
Oc1ccccc1CNCCCn1cncn1	381751785	DWTQGUYWPGGTBN-UHFFFAOYSA-N	232.287	1.164	10	20	BDCD	
CC1(C)CN(Cc2cc(F)ccc2O)CCN1	396048056	CSQGAJWDWAZVGD-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
C[C@H](C(=O)N(C)C)N(C)Cc1ccccc1O	121144995	IAXFCPAQNYBALF-SNVBAGLBSA-N	236.315	1.301	10	20	BDCD	
Cc1ncsc1/C=C1/SC(=S)NC1=O	255456999	HIAOKXNWKUPVHU-QHHAFSJGSA-N	242.350	1.940	10	20	BDCD	
CC(C)[C@@H](NC(=O)c1cc(O)cs1)C(=O)O	736384863	KCHNRXCVTABBCP-MRVPVSSYSA-N	243.284	1.293	10	20	BDCD	
COc1cccc([C@H](C)N[C@H]2CCOC2)c1O	846158496	ZWTBGEHJIMZEKJ-UWVGGRQHSA-N	237.299	1.840	10	20	BDCD	
Nc1ccc(CNC(=O)CCCF)cc1	850711901	SMABFFVVBDUMOJ-UHFFFAOYSA-N	210.252	1.635	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@](C)(O)C1	769541442	BFILHFLJJYUQEH-ZDUSSCGKSA-N	237.299	1.358	10	20	BDCD	
CCN(C)c1ccc(Cn2cc(CO)nn2)cc1	881314909	IKIOMGYTONSTNW-UHFFFAOYSA-N	246.314	1.275	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H](C)N1	70075012	DSTUZCGLBSVYMD-STQMWFEESA-N	247.386	1.935	10	20	BDCD	
COC[C@@H]1CN(C(=O)CN=[N+]=[N-])CC1(C)C	409433318	MNIIXJXMIFEFCR-QMMMGPOBSA-N	226.280	1.428	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1COCO1)CCO2	894870550	LXFSKMSYCSIOQG-GFCCVEGCSA-N	235.283	1.084	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1N	1336286196	OLRAFEYBVLLPBU-JSGCOSHPSA-N	233.359	1.828	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCN[C@H](C)C2)c1O	841061558	KCIHKRWJMGXLTK-DGCLKSJQSA-N	234.343	1.931	10	20	BDCD	
Cc1ccc(CNC[C@@H]2CC[C@H](O)C2)c(O)c1	877468610	KXUIHLHFVQWGLU-YPMHNXCESA-N	235.327	1.951	10	20	BDCD	
CC(C)NCC(=O)N(C)Cc1ccccc1O	37823778	IQLKFHFLHIYZCL-UHFFFAOYSA-N	236.315	1.349	10	20	BDCD	
C[C@]1(NCc2cc(F)cc(F)c2O)CCOC1	708442482	MLYWHPROSKCSSC-LBPRGKRZSA-N	243.253	1.939	10	20	BDCD	
CC[C@@H](NC)C(=O)NCc1ccc(N(C)C)cc1	692071315	ANLGDJSCGKRVSK-CYBMUJFWSA-N	249.358	1.367	10	20	BDCD	
CCN(C)c1ccc(OCC(=O)OC)cc1	183795343	WZZWKOCQUUHZTE-UHFFFAOYSA-N	223.272	1.695	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCCN1	37823727	SJRPNYJELHNESX-LLVKDONJSA-N	234.299	1.103	10	20	BDCD	
CC1(C)CN(Cc2ccccc2O)C[C@H]1O	280482203	OCUNZFHKZINSDQ-GFCCVEGCSA-N	221.300	1.595	10	20	BDCD	
C[C@H](N[C@@H]1CCNC1)c1cc(F)cc(F)c1O	817944970	QLHSIDGVMVKUSC-IONNQARKSA-N	242.269	1.683	10	20	BDCD	
C[C@@H]1CCN(C(=O)c2cc(O)cs2)[C@H]1CO	832761435	ZIDIODOZCHJSTO-APPZFPTMSA-N	241.312	1.297	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@@H](O)C1CC1	840947873	ASYLQSQNCRXXFX-OAHLLOKOSA-N	248.370	1.922	10	20	BDCD	
CC[C@H](NC(=O)c1cc(O)cs1)C(C)(C)O	854662511	CULMEXGYUJXPIP-VIFPVBQESA-N	243.328	1.733	10	20	BDCD	
C[C@@H](N[C@H](C)c1ccccc1O)c1ncn(C)n1	275622491	AGEAIVBPEAGZBE-NXEZZACHSA-N	246.314	1.933	10	20	BDCD	
CCCN(CC(=O)O)Cc1ccc(C)cc1O	1573854093	OQPFRHQGNXWQNI-UHFFFAOYSA-N	237.299	1.997	10	20	BDCD	
Nc1ccc(CNC(=O)N2CC[C@H]3C[C@@H]3C2)cc1	1337070070	HPZGRQMQAPZOBV-NWDGAFQWSA-N	245.326	1.820	10	20	BDCD	
Cc1ccc(CNCC(=O)NC2CC2)c(O)c1	877530973	HCOHDWXXYOESHU-UHFFFAOYSA-N	234.299	1.069	10	20	BDCD	
COC[C@](C)(CO)NCc1cc(C)ccc1O	716954078	JHTRQQFRBZMSPQ-ZDUSSCGKSA-N	239.315	1.188	10	20	BDCD	
OCCCNCc1cc(Cl)ccc1O	20188123	AIVBSSXSYJBVAC-UHFFFAOYSA-N	215.680	1.518	10	20	BDCD	
O=C(OCc1ccncc1)c1cccc(O)c1O	803439462	CJEQMMCCMTZMSI-UHFFFAOYSA-N	245.234	1.850	10	20	BDCD	
C[C@H](N[C@H](C)CN)c1cc(F)cc(F)c1O	817965829	CPRHXCGBDGRQNH-RQJHMYQMSA-N	230.258	1.668	10	20	BDCD	
CCc1noc(C(=O)NCc2ccccc2O)n1	904436056	GMEWIFCWSIRVRU-UHFFFAOYSA-N	247.254	1.268	10	20	BDCD	
CNC[C@H](C)NCc1c(O)cccc1OC	853248715	IVWYSDLXQDSXSR-VIFPVBQESA-N	224.304	1.098	10	20	BDCD	
CCN1CCN(c2ccc(OC)cc2)CC1	70948096	RPPGCNGCGZNPPL-UHFFFAOYSA-N	220.316	1.837	10	20	BDCD	
CCC[C@](C)(CO)NCc1ccc(N)cc1	1334754663	QOISXPYCBWSBOW-CYBMUJFWSA-N	222.332	1.910	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](C)C(=O)O)c1	1346531837	RVURVEPUXQQXNT-MRVPVSSYSA-N	239.271	1.211	10	20	BDCD	
Nc1ccc(CN2CCO[C@H](C(F)F)C2)cc1	1352790034	NIEABVOOHAYTNE-NSHDSACASA-N	242.269	1.735	10	20	BDCD	
CS[C@@H](CO)[C@@H](C)NCc1ccccc1O	164279254	NPWYYJMMHGATNN-SKDRFNHKSA-N	241.356	1.594	10	20	BDCD	
NC1(CNCc2ccc3c(c2)CCO3)CCCC1	849350040	ODFZXWWDMVXGDU-UHFFFAOYSA-N	246.354	1.983	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)CC[C@H]1C(=O)O	1599929432	SHYPMERRDIUFDH-GXFFZTMASA-N	248.326	1.811	10	20	BDCD	
CCN1CC(=O)N[C@@H]1c1cc(C)c(C)cc1O	189872659	LFWWSWBUCZYQJR-ZDUSSCGKSA-N	234.299	1.459	10	20	BDCD	
CC[C@H](NCc1ccc(N(C)C)cc1)C(=O)O	75423477	VLFLNURCQOCGOZ-LBPRGKRZSA-N	236.315	1.705	10	20	BDCD	
Oc1ccc(F)cc1CN1CCn2cnnc2C1	226564714	UJEQOPPSEZXDDP-UHFFFAOYSA-N	248.261	1.139	10	20	BDCD	
CC[C@@H](N[C@H](C)CN)c1ccc(F)cc1O	817966433	NSIQBHHHRDHMIB-LDYMZIIASA-N	226.295	1.919	10	20	BDCD	
CCO/C=C\C(=O)NCc1ccccc1O	816912189	NUPKJQUHQUZBSO-FPLPWBNLSA-N	221.256	1.559	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@@H]2CCNC2)c1	817944778	LRCLZLLCIOMEPU-GHMZBOCLSA-N	220.316	1.713	10	20	BDCD	
CC[C@@H](NCCN)c1ccc(F)cc1O	817937335	WQQAGTCTODLWPA-SNVBAGLBSA-N	212.268	1.531	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@H]1CCNC1)CC2	817944610	IAOHRXDULMPLMM-WDEREUQCSA-N	218.300	1.331	10	20	BDCD	
O=C(NCC1(O)CCCC1)c1cc(O)cs1	748356710	RZWCPOUSZUFJKR-UHFFFAOYSA-N	241.312	1.489	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H](C)CN	841047764	CMCXAJHRCDXWQJ-LLVKDONJSA-N	235.375	1.745	10	20	BDCD	
CCOc1ccc(CN(C)[C@H](C)CN)c(O)c1	843051474	JCJWSNPWPBXJRQ-SNVBAGLBSA-N	238.331	1.570	10	20	BDCD	
CO[C@H](C)Cc1nc(Cc2ccc(N)cc2)no1	843160645	ZJMKJZXRFZWHJQ-SECBINFHSA-N	247.298	1.820	10	20	BDCD	
Cc1ccc(CN2CCC[C@H](O)C2)c(O)c1	876528127	PXCUDPZUZNUCQR-LBPRGKRZSA-N	221.300	1.657	10	20	BDCD	
C[C@@H](NCC(=O)N(C)C1CC1)c1ccccc1O	879649687	SLVDIHOBXQLPCG-SNVBAGLBSA-N	248.326	1.664	10	20	BDCD	
O=C(N[C@H](CO)CC1CC1)c1cc(O)cs1	778511193	NYPYCPTVFRQKIF-QMMMGPOBSA-N	241.312	1.345	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1C[C@H]2C=C[C@H]1C2	882424737	ZRLSODBUZDDEKG-YUMQZZPRSA-N	249.241	1.637	10	20	BDCD	
CN(Cc1cc(F)cc(F)c1O)CC(C)(C)O	894025380	ARQXYDOQUVDTKH-UHFFFAOYSA-N	245.269	1.873	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCn2ccnc2C1	778189585	RDDATNXFPLDYLF-LBPRGKRZSA-N	243.310	1.693	10	20	BDCD	
CON(C)C(=O)/C=C/c1ccc(O)c(O)c1	180619314	XAEAMDNMACMJBW-GQCTYLIASA-N	223.228	1.131	10	20	BDCD	
C[C@@H]1CCC[C@H]([C@H]2CCCC(=O)C2=O)N1	253168583	AKLOMWPYVUZNHM-OPRDCNLKSA-N	209.289	1.455	10	20	BDCD	
Cc1cccc(O)c1CNC[C@](C)(O)C1CC1	877028654	CFGVHBCSEBKTLH-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
C[C@H]1NCCN(Cc2cc(F)ccc2O)[C@@H]1C	379439306	PWTSYSAGSOBINC-NXEZZACHSA-N	238.306	1.714	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@@](O)(C(F)(F)F)C1	308803713	FOKXZCLYXLSGQF-LURJTMIESA-N	224.186	1.296	10	20	BDCD	
Cc1ccc([C@@H](C)NCCOCCO)c(O)c1	20199202	KNXFRXBAPQDZND-LLVKDONJSA-N	239.315	1.360	10	20	BDCD	
O=C(CC1CC1)NCc1ccccc1O	136334308	MFYUDKROCAFPTD-UHFFFAOYSA-N	205.257	1.809	10	20	BDCD	
Cc1ccc(O)c(CN(C)CC(C)(C)O)c1	93414689	BJMUBQTUEMGUFP-UHFFFAOYSA-N	223.316	1.903	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)CCCN	237056551	KLMDXSRRRRVDHC-UHFFFAOYSA-N	249.358	1.416	10	20	BDCD	
CC[C@@H](CO)N[C@@H]1CCc2cccc(O)c21	296224280	ZXIAQPFFUPNMQR-WDEREUQCSA-N	221.300	1.740	10	20	BDCD	
CCN(C)c1ccc([C@H](C)NC2CNC2)cc1	817955601	ZRKJYVDWVWGWQC-NSHDSACASA-N	233.359	1.765	10	20	BDCD	
CNC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C	840255342	DCJNQEVEOPDVFF-LLVKDONJSA-N	249.358	1.921	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](O)C1)c1c(O)cccc1F	886621905	FVEWUDVJLUXPCT-HLTSFMKQSA-N	225.263	1.705	10	20	BDCD	
C[C@H]1CN[C@H](C)CN1Cc1ccc(N(C)C)cc1	86466779	WHXKGXMNJSTLIV-OLZOCXBDSA-N	247.386	1.935	10	20	BDCD	
C[C@H](N)CNC(=O)N[C@H](C)c1ccccc1O	892104129	VZLQIPPKRYBARI-DTWKUNHWSA-N	237.303	1.100	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)/C=C/c2ccco2)C1	409422793	IYBMTGFDDCLPEE-ONEGZZNKSA-N	218.216	1.814	10	20	BDCD	
CCOC(=O)[C@@H](C)NCc1ccc(C)cc1O	83364807	CGYBKLPAAKEFEC-SNVBAGLBSA-N	237.299	1.742	10	20	BDCD	
CN[C@H](C)CCNCc1cc(F)ccc1O	1328677127	KAXKTOKVKTWDTH-SECBINFHSA-N	226.295	1.619	10	20	BDCD	
Nc1ccc(CN2[C@H]3CCNC[C@H]2CC3)cc1	1335285210	LHROKTZNASXXRY-ZIAGYGMSSA-N	231.343	1.595	10	20	BDCD	
CCOCCNCc1cccc(OCC)c1O	36229022	WNJIBRBPGYDLMW-UHFFFAOYSA-N	239.315	1.917	10	20	BDCD	
CCCS(=O)(=O)NCc1ccccc1O	125402475	GVDIXKLDZPEBHZ-UHFFFAOYSA-N	229.301	1.222	10	20	BDCD	
C[C@H]1C[C@@H](C)O[C@@H]1C(=O)NCc1ccc(N)cc1	1343473108	LBVINNSXBPZOPP-CWSCBRNRSA-N	248.326	1.699	10	20	BDCD	
CC1(C)C[C@H]1C(=O)NCCc1ccc(N)cc1	124416539	AKBNZHCYLPXVQT-LBPRGKRZSA-N	232.327	1.974	10	20	BDCD	
COC[C@@H](CCO)N[C@@H](C)c1ccccc1O	228793911	SPWVTWJNSOXVAH-WDEREUQCSA-N	239.315	1.440	10	20	BDCD	
CN(Cc1ccccc1O)[C@H]1CCOC1	132772099	DDXWSEYTYWAFIY-NSHDSACASA-N	207.273	1.613	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@H]2CCCO2)cc1	87206465	OJEUUCYDHFLAOA-GFCCVEGCSA-N	234.299	1.454	10	20	BDCD	
CN(C)c1ccc(CNC(=O)CC(C)(C)N)cc1	84184164	NSUKFPLNZVHROG-UHFFFAOYSA-N	249.358	1.496	10	20	BDCD	
C[C@@H](CO)CN[C@H](C)c1ccc(F)cc1O	83218840	KEVIVFIWRQBOCL-RKDXNWHRSA-N	227.279	1.810	10	20	BDCD	
C[C@H]1c2nncn2CCN1Cc1ccccc1O	276872860	YRDCPAGYAUAMSA-JTQLQIEISA-N	244.298	1.561	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@H]1CCCN1)CC2	817953600	OXXXQNLHKJOAEM-NEPJUHHUSA-N	232.327	1.721	10	20	BDCD	
Cc1ccc([C@@H](C)NC[C@@H](C)N)c(O)c1	817972745	OHQSCDVPTLQXCD-NXEZZACHSA-N	208.305	1.698	10	20	BDCD	
COCCOC(=O)CSc1nccs1	727955253	XZBJQRFLIBJMAX-UHFFFAOYSA-N	233.314	1.425	10	20	BDCD	
O=C(NCc1ccon1)c1cc(O)cs1	747514782	HZIPPPWIGWDJLI-UHFFFAOYSA-N	224.241	1.372	10	20	BDCD	
CCOc1ccc(O)c(CN2CC[C@H](N)C2)c1	843047379	SLXCPEWBBIGBBS-NSHDSACASA-N	236.315	1.324	10	20	BDCD	
CC(C)(O)CCOC(=O)c1cccc(O)c1O	758548745	UFVGSCJTXGKDKN-UHFFFAOYSA-N	240.255	1.416	10	20	BDCD	
CC[C@H](CO)NCc1ccc(N(C)C)c(C)c1	931773205	OYNGJEAVNWDJTR-CYBMUJFWSA-N	236.359	1.922	10	20	BDCD	
CN(CC(=O)NCC(C)(C)C)c1ccc(N)cc1	863558403	HFWAVKXXXURLCJ-UHFFFAOYSA-N	249.358	1.867	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)[C@@H](C)CN1C	775987313	VKSQXHBMKHJWEF-RYUDHWBXSA-N	234.343	1.917	10	20	BDCD	
C[C@@H](CNCc1ccc(Cl)cc1O)C(=O)O	1589066436	GZKIHJSCBPCJER-ZETCQYMHSA-N	243.690	1.856	10	20	BDCD	
COC[C@H](C)NCc1cccc(OC)c1O	19904654	VWPCASGGWYOJPE-VIFPVBQESA-N	225.288	1.525	10	20	BDCD	
C[C@H]1COC[C@H]1NC(=O)Nc1ccc(N)cc1	699776761	INXZNLNAGMICJF-GZMMTYOYSA-N	235.287	1.425	10	20	BDCD	
CN[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1	128873090	FNHKIBQONQSDNI-CYBMUJFWSA-N	233.359	1.546	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CCCO1	61913558	MFECNYQSMIEEOM-LLVKDONJSA-N	248.326	1.449	10	20	BDCD	
C[C@H](O)CCCNCc1ccc2c(c1)CCO2	227963357	HNCBLSYHPIUVBG-NSHDSACASA-N	235.327	1.872	10	20	BDCD	
C[C@@H](CO)CN[C@H](C)c1cc(F)ccc1O	87111426	IJJORDKEBAVHLH-RKDXNWHRSA-N	227.279	1.810	10	20	BDCD	
CCN(CC(=O)NC1CC1)c1ccc(OC)cc1	299399068	UZPJQOHOGJGTKM-UHFFFAOYSA-N	248.326	1.800	10	20	BDCD	
CNCCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21	817952592	RULDXIWTMGXGDA-WCBMZHEXSA-N	238.306	1.889	10	20	BDCD	
C[C@@H](NC1CCNCC1)c1ccc(F)cc1O	817934968	DEGQFFIJEMJYHE-SECBINFHSA-N	238.306	1.934	10	20	BDCD	
O=C(NOCCC1CC1)c1cccc(O)c1O	817388439	WWEXUMQLZGQWNH-UHFFFAOYSA-N	237.255	1.559	10	20	BDCD	
CCO/C=C\C(=O)N(C)Cc1ccccc1O	816889003	IJYHQDNPONLSMG-HJWRWDBZSA-N	235.283	1.901	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H](O)C(C)(C)C1	877485761	GHVFELUUMLFOQX-CYBMUJFWSA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(O)c(CNC(C)(C)CO)c1	70955059	GTPLJZZRJZBZOH-UHFFFAOYSA-N	209.289	1.561	10	20	BDCD	
CCCNCc1ccc(OC)c(OC)c1O	892443520	HHZSAFNEOGBVSF-UHFFFAOYSA-N	225.288	1.909	10	20	BDCD	
CN(C)C1(CNCc2ccc3c(c2)CCO3)CC1	397873608	UQGXNJCEJZMXHS-UHFFFAOYSA-N	246.354	1.805	10	20	BDCD	
CN(Cc1ccc(N)cc1)[C@H]1CCCCNC1=O	35063958	NVOHIIIKSSAHNG-ZDUSSCGKSA-N	247.342	1.369	10	20	BDCD	
NC(=O)[C@@H]1CCCN(Cc2ccccc2O)C1	155066355	AXLMESDZKPNYKB-LLVKDONJSA-N	234.299	1.090	10	20	BDCD	
CCNCCNCc1ccc(OC)c(C)c1	258920798	OLXKZQYGNUCTSV-UHFFFAOYSA-N	222.332	1.703	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2C[C@@H]2F)cc1	1122540284	RHOAPAXQPFVSFK-ZJUUUORDSA-N	208.236	1.243	10	20	BDCD	
CC(C)[C@@H](O)CNCc1cc(F)cc(F)c1O	708487468	XZPQSUMLOSSKBW-NSHDSACASA-N	245.269	1.777	10	20	BDCD	
C[C@@H](C(=O)N(C)c1ccc(N)cc1)N(C)C	877076661	OURUEYRNRRRSJL-VIFPVBQESA-N	221.304	1.182	10	20	BDCD	
COc1cccc(CNC(=O)CC2CC2)c1O	105651644	BFHALXUDFBLLGK-UHFFFAOYSA-N	235.283	1.817	10	20	BDCD	
C[C@H](N[C@H](C)CO)c1cc(F)cc(F)c1O	134914109	IXANYTFAWCRUIM-RQJHMYQMSA-N	231.242	1.702	10	20	BDCD	
N[C@@H](CCO)c1ccc(N2CCCC2)cc1	44236253	AWPBEZOTPHPNID-ZDUSSCGKSA-N	220.316	1.669	10	20	BDCD	
C[C@@H](NCC(=O)N1CCCC1)c1ccccc1O	135719972	WCPIKXDCRZCTAF-LLVKDONJSA-N	248.326	1.665	10	20	BDCD	
COCCCC(=O)N(C)c1ccc(N)cc1	87420392	UIERBDGVMXHRID-UHFFFAOYSA-N	222.288	1.658	10	20	BDCD	
COc1cccc(CNCc2cc(C)on2)c1O	44692282	LEKYWKUZEBRXIA-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
COc1cccc(CN(C2CC2)C2COC2)c1O	296134680	UTVSYNGBFINARB-UHFFFAOYSA-N	249.310	1.764	10	20	BDCD	
COc1ccc(N(C)Cc2cnnn2C)cc1	844355330	NOUYSJMAHJKKAE-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
CNC[C@@H](C)NCc1cc(OC)ccc1O	853248328	DEJHVWVLEKNSPH-SECBINFHSA-N	224.304	1.098	10	20	BDCD	
Cc1cccc(O)c1CNCc1ncc[nH]1	877672711	LIWCTRHIIGRRHJ-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
CC(C)(O)CCC(=O)NCc1ccccc1O	787445528	MVWSPNOWSALUQD-UHFFFAOYSA-N	237.299	1.560	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOC[C@@H]2CCCC[C@H]21	409435104	SIQVMTCUWUSCED-VHSXEESVSA-N	238.291	1.714	10	20	BDCD	
C[C@@H](NCC[C@H]1CCNC1=O)c1ccccc1O	879649584	WQGJEXYYLWNLPU-MNOVXSKESA-N	248.326	1.569	10	20	BDCD	
CCOc1ccc(N(C)C[C@@H](C)N)cc1	20239535	MCHRTQUTBPNBGE-SNVBAGLBSA-N	208.305	1.869	10	20	BDCD	
CCOc1cccc(CN[C@H]2C[C@H](O)C2)c1O	850417685	HVRJRLIYNBUUSV-XYPYZODXSA-N	237.299	1.404	10	20	BDCD	
CC[C@](C)(CO)NCc1ccc2c(c1)CCO2	77111492	DQZSJQORAWIMDK-CQSZACIVSA-N	235.327	1.872	10	20	BDCD	
COc1cc(Cl)cc(CN(C)CCN)c1O	132388650	NHYSYPKRCPDPOB-UHFFFAOYSA-N	244.722	1.445	10	20	BDCD	
O=C(NCc1ccccc1O)NCC1CC1	299464286	ARYALGRLQKKQJN-UHFFFAOYSA-N	220.272	1.601	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H]2CCNC2)c(O)c1	817944585	HGRSXBNSDIXAFX-MNOVXSKESA-N	220.316	1.713	10	20	BDCD	
COC1CN(Cc2cc(F)ccc2O)C1	839131619	XGIKVHIJXDRSIL-UHFFFAOYSA-N	211.236	1.362	10	20	BDCD	
C[C@@H](OC(=O)c1cc(O)cs1)C(=O)O	736692921	ZDKQEIPWBXLICS-SCSAIBSYSA-N	216.214	1.084	10	20	BDCD	
CCC1(CNC(=O)c2cc(O)cs2)COC1	839786622	BOYZZMWQBZNVKI-UHFFFAOYSA-N	241.312	1.610	10	20	BDCD	
CC(C)C[C@@H](CN)NCc1cc(F)ccc1O	841038021	FVOINLQXOPXSSC-LBPRGKRZSA-N	240.322	1.994	10	20	BDCD	
CC[C@@H](N[C@H]1CCCNC1=O)c1ccccc1O	50394200	QGFJNIYGQRQOOX-NEPJUHHUSA-N	248.326	1.712	10	20	BDCD	
Oc1cc2c(cc1CN1CC=CCC1)[C@H](O)CO2	778577623	SZGULQGNLDKSOB-CYBMUJFWSA-N	247.294	1.580	10	20	BDCD	
CCOC[C@@H]1CN(C(=O)CN=[N+]=[N-])C[C@@H]1C	409434687	QDIJWWIBZYPPDV-IUCAKERBSA-N	226.280	1.428	10	20	BDCD	
CN(Cc1cc(F)cc(F)c1O)C[C@@H]1CCN1	1578486239	SOTCERNFSYBWJU-JTQLQIEISA-N	242.269	1.464	10	20	BDCD	
C[C@@H]1C[C@H]1C(=O)NCc1cccc(O)c1O	1521852483	WLWAGZLJOJPOKK-VXNVDRBHSA-N	221.256	1.370	10	20	BDCD	
C[C@H](Sc1ncc([N+](=O)[O-])s1)C(=O)O	226765871	RKKYYVZDDNNSTO-VKHMYHEASA-N	234.258	1.617	10	20	BDCD	
CC(C)[C@H](C(=O)NCc1ccc(N)cc1)N(C)C	1343567857	UCEVKYZWTPYLEE-CYBMUJFWSA-N	249.358	1.471	10	20	BDCD	
CCNC(=O)CCC(=O)Nc1ccc(N)cc1	160385554	MJJPRCMKWPNQBE-UHFFFAOYSA-N	235.287	1.124	10	20	BDCD	
O=C(Nc1c[nH]ccc1=O)c1cc(O)cs1	732271398	VNQURWKOJGTMBG-UHFFFAOYSA-N	236.252	1.394	10	20	BDCD	
Nc1ccc(NC(=O)[C@H](N)C2CCC2)cc1	832250162	LKTKEVPOBDDNLF-LLVKDONJSA-N	219.288	1.335	10	20	BDCD	
C[C@@H]1CCN1C(=O)/C=C/c1ccc(O)c(O)c1	914157154	OEQZUFPAQMUVIJ-HYYFJVDXSA-N	233.267	1.732	10	20	BDCD	
C[C@@H]1C[C@@H](NC(=O)c2cc(O)cs2)CO1	844152995	JFKIKWBZGZUTLI-RNFRBKRXSA-N	227.285	1.361	10	20	BDCD	
CC1(C(=O)NCc2ccc(O)cc2O)CCC1	910950869	LJXIUSUUZQULIF-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
COc1cccc([C@H](C)N[C@@H]2CC[C@H]2O)c1O	846175353	YQOWLHAQYUURLD-JMJZKYOTSA-N	237.299	1.575	10	20	BDCD	
C[C@H]1C[C@H](C(=O)NCc2ccc(N)cc2)CCO1	1341922893	GPVQFZUWEUVJJI-CMPLNLGQSA-N	248.326	1.700	10	20	BDCD	
COc1cccc(CNc2ncccn2)c1O	67448151	SXHLPVINQAXBKE-UHFFFAOYSA-N	231.255	1.803	10	20	BDCD	
NCCCCN[C@H]1CCc2cccc(O)c21	393759750	KGWDURNOVZNCRP-NSHDSACASA-N	220.316	1.708	10	20	BDCD	
CN1CCCC[C@H]1C(=O)NCc1ccccc1O	731872990	VCENYBVUPQGINV-LBPRGKRZSA-N	248.326	1.493	10	20	BDCD	
C[C@H](CN)CNCc1ccc(N2CCCC2)cc1	1325321308	ULLQYCQEJCOJCD-CYBMUJFWSA-N	247.386	1.971	10	20	BDCD	
CO[C@@H](C)CNC(=O)NCc1ccc(N)cc1	1336140118	GFUORAFNCXCONN-VIFPVBQESA-N	237.303	1.103	10	20	BDCD	
Oc1cccc2c1[C@@H](NCCn1ccnc1)CC2	295847767	FYFAORUYZCJYMX-LBPRGKRZSA-N	243.310	1.866	10	20	BDCD	
COc1ccc(O)c(CN2CCSCC2)c1	179666099	SBOQNTNMVWVRFX-UHFFFAOYSA-N	239.340	1.950	10	20	BDCD	
COCCCN(C)C(=O)c1cccc(O)c1O	126397299	MHHJRMBNRKUGFF-UHFFFAOYSA-N	239.271	1.206	10	20	BDCD	
CCOC(=O)C[C@@H](O)CSc1nccs1	135001468	DCMANOLPJFKWST-SSDOTTSWSA-N	247.341	1.549	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)[C@H](C)CN1	83117995	QNEFQDUMHVTGAF-GHMZBOCLSA-N	220.316	1.574	10	20	BDCD	
COc1ccc(O)c(CN2CCC[C@H](O)C2)c1	271774465	FWYQXFKCDSMKSD-NSHDSACASA-N	237.299	1.358	10	20	BDCD	
Cc1n[nH]c(CN(C)c2ccc3c(c2)OCO3)n1	293328956	WQIRLMPQVUNKGU-UHFFFAOYSA-N	246.270	1.478	10	20	BDCD	
COc1ccc(O)c(CN(C2CC2)C2COC2)c1	295962861	HYRYGFCYRGWLAM-UHFFFAOYSA-N	249.310	1.764	10	20	BDCD	
OC/C=C/CNCc1c(O)cccc1Cl	717536375	XXBKHSLRCJHQFF-OWOJBTEDSA-N	227.691	1.684	10	20	BDCD	
Cc1cc(C)c([C@H](C)NCC2CNC2)c(O)c1	817964927	JIYVYXMXAIFJOG-NSHDSACASA-N	234.343	1.879	10	20	BDCD	
Nc1ccc(CCN[C@@H]2CCCNC2)cc1	843126657	SFHVTBCJKYNXAB-CYBMUJFWSA-N	219.332	1.153	10	20	BDCD	
COC[C@H](O)CN[C@H](C)c1ccc(F)cc1O	71269118	YHVRXFCUVHGRRE-PSASIEDQSA-N	243.278	1.189	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](CO)C1)c1cc(F)ccc1O	707593338	HROIXPWZKAUWDK-KKZNHRDASA-N	239.290	1.953	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1NCC1(C)C)c1ccccc1O	870988031	DNYXHLDNZJFTSV-SKDRFNHKSA-N	248.326	1.567	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)[C@H](C)N	156729646	CKYQCISBHPCOCP-JTQLQIEISA-N	236.315	1.478	10	20	BDCD	
CC(C)NCC(=O)N[C@H](C)c1ccccc1O	870988682	XAADAUNNRPCACB-SNVBAGLBSA-N	236.315	1.567	10	20	BDCD	
COc1cccc(CN[C@H](C)C[C@@H](C)O)c1O	228085207	FFGGOSLVOCDFME-NXEZZACHSA-N	239.315	1.650	10	20	BDCD	
COc1ccc(O)c(CNCc2cncn2C)c1	114505712	KCVZXAJCFUIPQD-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
NCC1CCN(Cc2cc(F)ccc2O)CC1	219482999	LZGXJAOZAIGNJK-UHFFFAOYSA-N	238.306	1.702	10	20	BDCD	
COc1ccc(N(C)CCO)cc1OC	49814969	ZEPLGIUJLWMFFO-UHFFFAOYSA-N	211.261	1.132	10	20	BDCD	
C[C@H](O)CN[C@@H]1CCc2cccc(O)c21	295809567	CRYGRDVUZQCENP-WCBMZHEXSA-N	207.273	1.350	10	20	BDCD	
CCN1CCN(C(=O)c2cc(O)cs2)CC1	809936916	FAQKMDSFFVRIBF-UHFFFAOYSA-N	240.328	1.231	10	20	BDCD	
CC(C)(N)CN[C@H]1CCc2cccc(O)c21	817960869	SBGNDKGQAYFGSV-JTQLQIEISA-N	220.316	1.706	10	20	BDCD	
C[C@@H](C[C@@H](C)N)NCCc1ccc(N)cc1	817957703	OJXZJKQEDWOGGP-MNOVXSKESA-N	221.348	1.527	10	20	BDCD	
C[C@@H]1CCN(Cc2ccccc2O)C[C@@H]1CO	857061319	OIGGLOUYIHGJDY-DGCLKSJQSA-N	235.327	1.843	10	20	BDCD	
Cc1ccc(O)c(CN(C)C2CC(O)C2)c1	761222538	KMONJGYAPGSHPF-UHFFFAOYSA-N	221.300	1.656	10	20	BDCD	
[N-]=[N+]=NCCn1nc(C(F)(F)F)cc1O	409437813	JAJYMRFIUDTOLX-UHFFFAOYSA-N	221.142	1.918	10	20	BDCD	
CN(CCCF)Cc1cc2c(cc1O)OCO2	716640774	YBIKKAYUQUUSBX-UHFFFAOYSA-N	241.262	1.912	10	20	BDCD	
O=C(O)CC1(NCc2cc(F)ccc2O)CC1	1601936448	RKHYKJFYTXWUGM-UHFFFAOYSA-N	239.246	1.628	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)C1(N)CC1	169100895	FYRRUEUKDSCJFD-UHFFFAOYSA-N	247.342	1.169	10	20	BDCD	
CC(C)(CCO)NCc1ccccc1O	127132263	IDHKOGJTCSOXJB-UHFFFAOYSA-N	209.289	1.643	10	20	BDCD	
COCC[C@H](CO)NCc1c(C)cccc1O	894654338	FODACRLPYJGKNV-LLVKDONJSA-N	239.315	1.188	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1CCC[C@H]1O	305745869	OXXVDSISGAZFLD-GXTWGEPZSA-N	235.327	1.985	10	20	BDCD	
CO[C@@H]1COC[C@@H]1NCc1ccc2c(c1)CCO2	839193577	SRTOTIGARQEDNW-GXTWGEPZSA-N	249.310	1.125	10	20	BDCD	
C[C@@H](CN)C(=O)N[C@H](C)c1ccccc1O	870988426	PBKVOIUTUIXQBN-DTWKUNHWSA-N	222.288	1.164	10	20	BDCD	
C[C@@H](NC(=O)C1(O)CCC1)c1ccccc1O	827940309	AEEHLXKOGMNAQX-SECBINFHSA-N	235.283	1.484	10	20	BDCD	
COC(=O)CSc1ncc(C(=O)OC)s1	829678035	WOSJBQQKIIWKMJ-UHFFFAOYSA-N	247.297	1.195	10	20	BDCD	
CNCCCNCc1c(O)cccc1Cl	841043639	ZFWJEPLCCWBYHO-UHFFFAOYSA-N	228.723	1.745	10	20	BDCD	
Nc1ccc(NC[C@@]23CNC[C@@H]2C3)cc1	853246858	VIAKOCKKIUMRLO-JOYOIKCWSA-N	203.289	1.290	10	20	BDCD	
CCN(CCCO)Cc1cc(F)cc(F)c1O	894054325	LPZWCXUMARHCRY-UHFFFAOYSA-N	245.269	1.875	10	20	BDCD	
CC[C@H](NCc1cc(F)cc(F)c1O)[C@H](C)O	708535838	QVFBBKVLGHYADE-CPCISQLKSA-N	245.269	1.919	10	20	BDCD	
C[C@]1(C(=O)NCCc2ccc(N)cc2)CCOC1	687370431	ZQNAJMNRROXSGI-AWEZNQCLSA-N	248.326	1.354	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCCCN1)c1ccccc1O	877255859	IQADWPAXNVLLBC-PWSUYJOCSA-N	248.326	1.712	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@H]1[C@@H]2CNC[C@@H]21	1345103104	BGQDGEMCHXEZDZ-JDICNCQASA-N	238.718	1.353	10	20	BDCD	
CCNC(=O)CN(C)c1ccc(OCC)cc1	157310057	OYJOEVCJJBVKPH-UHFFFAOYSA-N	236.315	1.658	10	20	BDCD	
Cc1ccc(CN[C@@H](C)CC(N)=O)c(O)c1	877095218	PTJQIJIKDYGSPS-VIFPVBQESA-N	222.288	1.054	10	20	BDCD	
Nc1ccc(NC(=O)c2cc[nH]n2)cc1	62775194	RRAMVJLPLQXFSB-UHFFFAOYSA-N	202.217	1.244	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](O)C1)c1ccc(F)cc1O	850579589	ZLLODQRRYLWLAD-SZEHBUNVSA-N	225.263	1.705	10	20	BDCD	
CC[C@@H](N[C@H](C)CO)c1ccccc1O	35602848	YWQZBLCLTGPWSI-MWLCHTKSSA-N	209.289	1.814	10	20	BDCD	
CC[C@@H](NCc1ccc(N(C)C)cc1)C(=O)O	75423478	VLFLNURCQOCGOZ-GFCCVEGCSA-N	236.315	1.705	10	20	BDCD	
CC(C)[C@@H](O)C(=O)N(C)Cc1ccccc1O	285563537	GAIBCFRQMJEYPB-GFCCVEGCSA-N	237.299	1.368	10	20	BDCD	
CC(C)C1(O)CN(C(=O)c2cc(O)cs2)C1	802612580	JYCKUTGJNMZGGJ-UHFFFAOYSA-N	241.312	1.297	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCN[C@@H](C)C2)c1	841061404	IHTIKOBEDZSVDH-WCQYABFASA-N	234.343	1.931	10	20	BDCD	
COc1cccc(CNCCN2CCC2)c1O	697390699	RZVBQLTZMAWRAO-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
CC(C)[C@@H](C(=O)Nc1ccc(N)cc1)N(C)C	62461290	SBNLBKPBQKOKLN-LBPRGKRZSA-N	235.331	1.794	10	20	BDCD	
CC(C)(CCNCc1ccccc1O)C(=O)O	395586610	DSQLPRNSHILUAG-UHFFFAOYSA-N	237.299	1.983	10	20	BDCD	
C[C@]1(O)CCN(Cc2cc(F)cc(F)c2O)C1	1334350300	RWHBKUYTKYUIOY-LBPRGKRZSA-N	243.253	1.627	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(N)cc2)CC[C@H]1N	1336286198	OLRAFEYBVLLPBU-TZMCWYRMSA-N	233.359	1.828	10	20	BDCD	
COc1ccc(CN[C@H](C)CC(=O)O)cc1C	1594094522	JEJLPXYOZOKJDJ-SNVBAGLBSA-N	237.299	1.956	10	20	BDCD	
CC(C)(N)CNCc1ccc2c(c1)CCCO2	258687765	BHBBWPGCYUZYAL-UHFFFAOYSA-N	234.343	1.839	10	20	BDCD	
Nc1ccc(CC(=O)NCCN2CCCC2)cc1	35663352	PQQJVZXDJIOUHA-UHFFFAOYSA-N	247.342	1.023	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCOC1	181252508	BYHKQNLRRVMKAS-XCRNYIDWSA-N	249.266	1.016	10	20	BDCD	
C[C@H]1CN[C@H](C)CN1Cc1cc(F)ccc1O	235348542	DNWZVPBYUJOPDC-ZJUUUORDSA-N	238.306	1.714	10	20	BDCD	
O=C(OCC(=O)C(F)F)c1cc(O)cs1	800165138	GKCSSYIYGKVUAB-UHFFFAOYSA-N	236.195	1.445	10	20	BDCD	
NC[C@H]1CCC[C@@H]1NCCc1ccc(N)cc1	817958112	SEEMBMQCGVCCCZ-OCCSQVGLSA-N	233.359	1.528	10	20	BDCD	
NCC1(CC(=O)NCCc2ccc(N)cc2)CC1	818545343	ZFUFFBCQIMJJLB-UHFFFAOYSA-N	247.342	1.057	10	20	BDCD	
CCCCN(CCO)C(=O)c1cc(O)cs1	821361011	YXJMAUCHCBIUSY-UHFFFAOYSA-N	243.328	1.688	10	20	BDCD	
Oc1c(F)cc(Cl)cc1CN[C@H]1CCNC1	841045289	RTGQZJGWHHTFKJ-VIFPVBQESA-N	244.697	1.636	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@@H]1CCNC1	841044219	BOAOGUSNEMZZIO-SECBINFHSA-N	226.707	1.497	10	20	BDCD	
COc1cccc(CNC(=O)C2=COCC2)c1O	769507295	CWHJUWMVBSFNLC-UHFFFAOYSA-N	249.266	1.321	10	20	BDCD	
C[C@@H](C[S@@](C)=O)NCc1ccccc1O	164253976	KGQWHRSITWNHOZ-VFZGTOFNSA-N	227.329	1.249	10	20	BDCD	
C[C@@H](NC1CC1)c1cc(C(=O)O)ccc1O	1609774301	JUKQFIBBEFGCPG-SSDOTTSWSA-N	221.256	1.903	10	20	BDCD	
Cc1ccc(CN[C@H](C)C[C@H](C)N)c(O)c1	1579696844	IXJCAONCNZXVGJ-WDEREUQCSA-N	222.332	1.916	10	20	BDCD	
C[C@H](O)CCN(C)C(=O)Cc1ccc(N)cc1	157067240	RSBWKDLIMFBRCE-JTQLQIEISA-N	236.315	1.041	10	20	BDCD	
CO[C@@H]1CCOC[C@H]1NCc1ccccc1O	724879945	GKEDVMZJEPXTDC-DGCLKSJQSA-N	237.299	1.286	10	20	BDCD	
Oc1cc2c(cc1CNC1CC1)OCO2	42878953	FFCURJCHLKUNBT-UHFFFAOYSA-N	207.229	1.373	10	20	BDCD	
C[C@@H](NCc1ccc(N2CCCC2)cc1)C(=O)O	49357161	DBHGCPJVJMFRFN-LLVKDONJSA-N	248.326	1.850	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2CCCCN2)cc1	234265175	XNOSVTBWTYTYCK-CQSZACIVSA-N	247.386	1.984	10	20	BDCD	
CC[C@H]1NCC[C@H]1C(=O)Nc1ccc(N)cc1	294779693	NORSRMMZWXAUBG-VXGBXAGGSA-N	233.315	1.595	10	20	BDCD	
CN(CCC(=O)N(C)C)Cc1ccccc1O	731842864	MDNDNHXLRUHSQT-UHFFFAOYSA-N	236.315	1.302	10	20	BDCD	
O=C(NCc1cocn1)NCc1ccccc1O	730907247	FLPCMTMQIQMVDQ-UHFFFAOYSA-N	247.254	1.380	10	20	BDCD	
O=C(OC[C@H]1CCOC1)c1cc(O)cs1	732354837	SVHDDJAWZRNHME-ZETCQYMHSA-N	228.269	1.647	10	20	BDCD	
CNC[C@@H]1CCN(Cc2cccc(F)c2O)C1	843053365	XZYFYXWZAICXCT-JTQLQIEISA-N	238.306	1.573	10	20	BDCD	
Oc1c(F)cccc1CN1C[C@@H]2CNC[C@@H]2C1	779030524	OFCSVWWUOJEJRO-PHIMTYICSA-N	236.290	1.183	10	20	BDCD	
COC[C@H]1CCCCN1C(=O)CN=[N+]=[N-]	409432860	WSWXKWUVOKZHBR-MRVPVSSYSA-N	212.253	1.324	10	20	BDCD	
Cc1nc(COC(=O)c2cc(O)cs2)n[nH]1	795405808	WKFKREHITKOYPQ-UHFFFAOYSA-N	239.256	1.237	10	20	BDCD	
C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N)cc2)CO1	1335602857	GOZYLOKPQURLSB-BXKDBHETSA-N	249.314	1.245	10	20	BDCD	
C[C@H](NCc1cc(Cl)cc(F)c1O)C(=O)O	1605049810	DESXGTMMGVEOOI-YFKPBYRVSA-N	247.653	1.747	10	20	BDCD	
CO[C@@H](C)CCC(=O)NCc1ccccc1O	167352941	GJBWOLIEHUCYJJ-JTQLQIEISA-N	237.299	1.824	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1ncc[nH]1	857467153	UEKNRIZNZMKRPF-UHFFFAOYSA-N	231.255	1.388	10	20	BDCD	
CCNC(=O)CN(C)Cc1ccc(C)cc1O	876621908	LYVRKHAPWNJAES-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
C[C@]1(CN)CCN(Cc2cc(F)ccc2O)C1	310379966	PIBZKIIYWGNPCA-CYBMUJFWSA-N	238.306	1.702	10	20	BDCD	
CC[C@H](C)NC(=O)c1ccc(C)c(O)c1O	177658315	NBYBFWNUHXSCGR-QMMMGPOBSA-N	223.272	1.935	10	20	BDCD	
O=C(O)c1ccc(CNCc2ccccc2O)o1	228409136	OOSKTIPNKPBUEN-UHFFFAOYSA-N	247.250	1.973	10	20	BDCD	
CN(C)c1ccc(CN(C)C2(CO)CC2)cc1	285589815	ULMGQSOIHVXFHJ-UHFFFAOYSA-N	234.343	1.709	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1C[C@@H]1F)c1ccccc1O	1347190432	PXIDPBKMOMPXDH-QNSHHTMESA-N	223.247	1.927	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(Cl)s1	808484138	KMVDBTDWXIHSOE-UHFFFAOYSA-N	246.671	1.716	10	20	BDCD	
O=C(NCc1cccnc1)c1cc(O)cs1	731867196	ZEUPSUBARBQCQG-UHFFFAOYSA-N	234.280	1.779	10	20	BDCD	
Cc1cccc(O)c1CNCCC[S@](C)=O	877052458	XGFJEHVABHLVGG-INIZCTEOSA-N	241.356	1.559	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2cc(F)ccc2O)CCN1	841062935	ZMOZHXMWGBPUSZ-SKDRFNHKSA-N	238.306	1.761	10	20	BDCD	
CCNC(=N)NCCCSc1nccs1	849008437	JEAOZLAEAXGYBY-UHFFFAOYSA-N	244.389	1.759	10	20	BDCD	
Cc1cc(O)c(CN[C@H](CO)CCF)cc1C	846096062	FAPVSRNBRDNVFC-LBPRGKRZSA-N	241.306	1.819	10	20	BDCD	
CO[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C1	708413779	NYOASLDNIJRXAA-SNVBAGLBSA-N	243.253	1.891	10	20	BDCD	
O=C1C[C@H](CSc2nccs2)CN1	1327165644	UHZWMUYOJPKNQS-LURJTMIESA-N	214.315	1.371	10	20	BDCD	
CCN(CC(=O)O)Cc1cc(F)c(F)cc1O	1605415771	RKKDEAHNIVBJKO-UHFFFAOYSA-N	245.225	1.577	10	20	BDCD	
CN1CC[C@H](N(C)Cc2ccccc2O)C1=O	116279490	MMVAICGUUJDYGE-NSHDSACASA-N	234.299	1.055	10	20	BDCD	
CC(C)(O)CSc1ncc(C(=O)O)s1	1590902325	SVVVWDCSNDMTTO-UHFFFAOYSA-N	233.314	1.704	10	20	BDCD	
Cc1cccc(CN[C@H]2CCOC2)c1O	162872238	IRMUPONZZVJBKU-NSHDSACASA-N	207.273	1.579	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](C(N)=O)C2)c1	157194548	OZYYKNWJWLXBGL-JTQLQIEISA-N	234.299	1.008	10	20	BDCD	
Cc1ccc(CNCCC[C@H](C)O)c(O)c1	877484905	SKEYAEQMCHZWFE-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@H](C2CC2)C1	365967411	LZSLDDRVFMGPTL-JTQLQIEISA-N	247.294	1.970	10	20	BDCD	
CO[C@H]1CCN(Cc2ccc(N)cc2)C1	146857332	IYCRMSLSQUGCHF-LBPRGKRZSA-N	206.289	1.490	10	20	BDCD	
C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(N)=O	37261358	BWNVFQBCNIUVPK-UWVGGRQHSA-N	235.331	1.277	10	20	BDCD	
C[C@H]1CCN[C@H](C(=O)NCc2ccccc2O)C1	127714437	SGBABAVXEMQNQV-JQWIXIFHSA-N	248.326	1.397	10	20	BDCD	
Oc1ccc(F)cc1CNC1CCC(O)CC1	156406433	WJMQZKZCYZWVQO-UHFFFAOYSA-N	239.290	1.924	10	20	BDCD	
Cc1cccc(CNCCC[C@H](C)O)c1O	228090923	RTQSIZVSWHYOMB-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
Cc1cc(CN(C)C[C@H](C)O)ccc1N(C)C	293472035	FAIFZEJACFJQOK-LBPRGKRZSA-N	236.359	1.874	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1CCCOC1	297193291	VKWXEWCICGQTOM-HWKANZROSA-N	249.266	1.317	10	20	BDCD	
COc1ccc(CN[C@H]2C[C@H](C(=O)O)C2)cc1C	849231650	DYUHUUISDOLBEZ-HAQNSBGRSA-N	249.310	1.956	10	20	BDCD	
CC(C)[C@H](C(=O)N(C)c1ccc(N)cc1)[C@@H](C)N	877076070	LUVAQDZZBUPXEE-MFKMUULPSA-N	249.358	1.851	10	20	BDCD	
Cc1ccc(CN2CC(C)(C(=O)O)C2)c(O)c1	1607779106	AXKFIIRQVMNLGC-UHFFFAOYSA-N	235.283	1.607	10	20	BDCD	
CC1(C)CCN[C@@H]1C(=O)NCc1ccccc1O	852882874	BUEILKBWAAZYQQ-GFCCVEGCSA-N	248.326	1.397	10	20	BDCD	
Nc1ccc(CC(=O)N2CCCOCC2)cc1	61913842	IMDDNQZECODKOA-UHFFFAOYSA-N	234.299	1.060	10	20	BDCD	
CN(C)[C@@H]1CCCN(Cc2ccccc2O)C1	156069266	KDLUGPITGMXEEF-CYBMUJFWSA-N	234.343	1.918	10	20	BDCD	
CC(C)(CNCc1ccccc1O)OCCO	288510816	SYPRPQSQNQMVAV-UHFFFAOYSA-N	239.315	1.269	10	20	BDCD	
Cc1cnc(C(=O)NCc2ccc(O)c(O)c2)o1	813813323	PCTPMNIAORLJSS-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
CN(C)CCCNC(=O)c1cc(O)cs1	823645758	RPZOXHHBKOJTKH-UHFFFAOYSA-N	228.317	1.135	10	20	BDCD	
N[C@H]1C[C@H](NCc2cccc(Cl)c2O)C1	906517327	MSVSEAHMEDXRNJ-KYZUINATSA-N	226.707	1.625	10	20	BDCD	
CC(C)(C)[C@@H](CO)NCc1ccc(N)cc1	1120370969	LIGJYUQLFQAKGW-GFCCVEGCSA-N	222.332	1.765	10	20	BDCD	
CC[C@H](CCO)CNCc1ccccc1O	87362654	WRHXDLQILQVKQL-LLVKDONJSA-N	223.316	1.890	10	20	BDCD	
COCCNCc1cc(C)cc(OC)c1O	894145586	FJIUSYUUBLGTRZ-UHFFFAOYSA-N	225.288	1.445	10	20	BDCD	
C[C@H](O)CCOC(=O)c1cccc(O)c1O	1327475453	GLZZTNBEBBOMDA-ZETCQYMHSA-N	226.228	1.026	10	20	BDCD	
Nc1ccc(NC(=O)C[C@H]2CCCN2)cc1	160436158	MQMWLKFEZVVNSE-LLVKDONJSA-N	219.288	1.349	10	20	BDCD	
CS[C@H](C)C(=O)NCCc1ccc(N)cc1	152482360	JVZNEQVUSQFGJO-SECBINFHSA-N	238.356	1.679	10	20	BDCD	
C[C@@H](CN[C@@H]1CCc2cccc(O)c21)N(C)C	297659965	KNFDAHVBAAOXCB-CMPLNLGQSA-N	234.343	1.919	10	20	BDCD	
Nc1ccc(CN2CC[C@@H]3OCC[C@@H]3C2)cc1	724808120	DXTOOAKIPSUHQS-OCCSQVGLSA-N	232.327	1.880	10	20	BDCD	
COc1cccc(O)c1CN1CCCC1	725844484	ZLLZDXPRMWRYKP-UHFFFAOYSA-N	207.273	1.997	10	20	BDCD	
CC[C@H](N)C(=O)N[C@H](C)c1ccccc1O	870988215	JCGOGVCBXZYIJT-SCZZXKLOSA-N	222.288	1.307	10	20	BDCD	
Cc1cc(N2C(=O)[C@@H]3[C@@H](C2=O)C3(C)C)ccc1N	113661601	BRAYONAHCCZIDS-QWRGUYRKSA-N	244.294	1.723	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H]([C@@H](C)N)C2)c1	126870698	RIACFKIKJZPWHG-NEPJUHHUSA-N	234.343	1.870	10	20	BDCD	
C[C@@H]1COCCN1Cc1cc(F)ccc1O	226562487	ALVKSOUAGJDYKZ-SECBINFHSA-N	225.263	1.752	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H](O)C1CC1	236547777	SQMNFJDJQVRQGV-GFCCVEGCSA-N	225.263	1.392	10	20	BDCD	
Cc1cccc(CN2CC[C@@H]([C@@H](C)O)C2)c1O	272568237	VHBPEGLBXDRAEN-VXGBXAGGSA-N	235.327	1.903	10	20	BDCD	
COCCOCCOc1ccc(N(C)C)cc1	277736980	IFMUORIYJZINOZ-UHFFFAOYSA-N	239.315	1.794	10	20	BDCD	
CN1CC(=O)N[C@@H]1c1cccc(Cl)c1O	298795156	SKBPOJWCLGDARE-JTQLQIEISA-N	226.663	1.106	10	20	BDCD	
Cc1cccc(CN2CC[C@H](CCN)C2)c1O	904405399	HBWLQDNSLUPFDQ-LBPRGKRZSA-N	234.343	1.871	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC[C@@H](O)C1	840910591	SMTNTADMLYARKL-CQSZACIVSA-N	234.343	1.628	10	20	BDCD	
CC(C)(N)CNCc1cccc(Cl)c1O	841030399	HNSHZFWKXNGQGX-UHFFFAOYSA-N	228.723	1.873	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CC[C@@H](CN)C2)c1	841085173	WBTPIRFYPQIGLQ-YPMHNXCESA-N	234.343	1.918	10	20	BDCD	
O=C(NCc1ccccc1O)c1cnco1	759610346	YOPZMAIBNUWJKP-UHFFFAOYSA-N	218.212	1.310	10	20	BDCD	
O=C(NCc1ccccc1O)c1cnc[nH]1	701177583	TWYPGPJHONWOHY-UHFFFAOYSA-N	217.228	1.045	10	20	BDCD	
Oc1ccccc1CN1[C@H]2CC[C@H]1COC2	695058334	BZWNMCOUALMQTI-RYUDHWBXSA-N	219.284	1.755	10	20	BDCD	
CN(CC(F)F)C(=O)NCc1ccc(N)cc1	1335731714	URBYQNYWMWZJHQ-UHFFFAOYSA-N	243.257	1.675	10	20	BDCD	
COCCCNC(=O)NCc1ccc(N)cc1	1120473210	ZWBGLXNKYCXFGW-UHFFFAOYSA-N	237.303	1.105	10	20	BDCD	
CCOCCN(C)Cc1cccc(OC)c1O	156089449	PBLBPMPPFUEHRX-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
OCCCNCc1ccc(N2CCCC2)cc1	37236436	MFVCTLLDASEXBJ-UHFFFAOYSA-N	234.343	1.759	10	20	BDCD	
CC(C)(CO)CNCc1cc(F)cc(F)c1O	708486316	QIWMTOVVWHUNCV-UHFFFAOYSA-N	245.269	1.779	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H](CO)C2)cc1C	92763683	HJMOCFLFBFEXLT-GFCCVEGCSA-N	235.327	1.823	10	20	BDCD	
CC(C)(CN[C@H]1CCc2cccc(O)c21)C(N)=O	296766393	KIAICKZQGBIELF-JTQLQIEISA-N	248.326	1.481	10	20	BDCD	
CNCCCN[C@H](C)c1cc(OC)ccc1O	817940896	OWNRVRBFVIRVQB-SNVBAGLBSA-N	238.331	1.661	10	20	BDCD	
CCCN(C)CC(=O)NCCc1ccc(N)cc1	832658872	FCBQIEIMAZBCHN-UHFFFAOYSA-N	249.358	1.269	10	20	BDCD	
O=C(NCc1ccccc1O)O[C@H]1CCOC1	914141031	WSBSVVHEYUBICH-JTQLQIEISA-N	237.255	1.407	10	20	BDCD	
CCC[C@@H]1CNCCN1Cc1ccccc1O	843058422	SIKIRZROYMCOJK-CYBMUJFWSA-N	234.343	1.966	10	20	BDCD	
CCNCCNCc1ccc(N(C)C)c(F)c1	841037041	OIOONBWKBIXAIS-UHFFFAOYSA-N	239.338	1.591	10	20	BDCD	
C[C@H]1CN(C(=O)c2cc(O)cs2)CC[C@H]1O	779462841	VYIVQOKOTYPAQJ-IONNQARKSA-N	241.312	1.297	10	20	BDCD	
C[C@@H](CCCO)NCc1ccc2c(c1)CCO2	88503478	ZDUXYTYBCGMZIS-NSHDSACASA-N	235.327	1.872	10	20	BDCD	
CCO[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	83916985	YWBBEQFNPWRTCQ-ZDUSSCGKSA-N	248.326	1.449	10	20	BDCD	
CC[C@](C)(CO)NCc1cc(F)cc(F)c1O	708486926	STFJFACSQXDOPT-GFCCVEGCSA-N	245.269	1.921	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1NCC1(C)C	710086344	YQTUDJSYXSJVCW-LBPRGKRZSA-N	248.326	1.349	10	20	BDCD	
C[C@@H](NC(=O)C[C@@H](N)C1CC1)c1ccccc1O	870988541	SCYPGYZZEJNXNI-BXKDBHETSA-N	248.326	1.697	10	20	BDCD	
CC[C@H](N)CNCc1ccc2c(c1)CCO2	841070567	QXPFVTKLYAQGEF-LBPRGKRZSA-N	220.316	1.448	10	20	BDCD	
COCC1(CC(=O)NCc2ccc(N)cc2)CC1	401425407	VRMVGMGEBJBCGN-UHFFFAOYSA-N	248.326	1.702	10	20	BDCD	
CCN(C)C(=O)[C@@H](C)NCc1ccc(N)cc1	1120371809	RCSJKRMMKFDDSO-SNVBAGLBSA-N	235.331	1.225	10	20	BDCD	
COc1cccc(CNC(=O)c2cn[nH]c2)c1O	105651380	RLYMBOWCFNSWIA-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
CN(CCCO)c1ccc2c(c1)OCO2	49814487	CPVPIIIUBOPQRV-UHFFFAOYSA-N	209.245	1.234	10	20	BDCD	
COc1ccc(N(C)CC(C)(C)N)cc1	49973729	GGIQYQWASBSQKP-UHFFFAOYSA-N	208.305	1.869	10	20	BDCD	
CC(C)(O)CNCc1c(O)cccc1Cl	83552536	JAABLPHSLNYGKV-UHFFFAOYSA-N	229.707	1.906	10	20	BDCD	
Cc1cc(O)c(CN2CCO[C@@H]3C[C@H]32)cc1C	368143254	RVGLAHVIOJPGRC-TZMCWYRMSA-N	233.311	1.982	10	20	BDCD	
CC[C@@H](NC[C@@H](C)N)c1ccccc1O	817974005	XIPRRAVLJKVWCY-MWLCHTKSSA-N	208.305	1.780	10	20	BDCD	
CCN(CC(=O)O)Cc1cc(C)c(C)cc1O	737075366	QGYBJNPEPKNICX-UHFFFAOYSA-N	237.299	1.916	10	20	BDCD	
Nc1ccc(NC(=O)NC[C@H]2CCCCO2)cc1	42825688	DZKCNIYYFKBHTN-GFCCVEGCSA-N	249.314	1.959	10	20	BDCD	
C[C@@]1(CO)CCCN1Cc1ccccc1O	788435848	NNQICOACMHOXLY-ZDUSSCGKSA-N	221.300	1.739	10	20	BDCD	
CCCN(CCO)Cc1cc(F)cc(F)c1O	893895549	OPUGLXLSIIULGG-UHFFFAOYSA-N	245.269	1.875	10	20	BDCD	
Cc1cc[nH]c1C(=O)NCc1ccc(O)c(O)c1	797942506	SYSISXOQYJIKMW-UHFFFAOYSA-N	246.266	1.664	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H](C(=O)O)[C@@H]1C	1600543486	YWLCDJMWQJUTAY-WDEREUQCSA-N	249.310	1.996	10	20	BDCD	
Cc1ccc(CN[C@@H]2CC=C(C(=O)O)C2)c(O)c1	1600418894	PXLORKPSRRJKBP-GFCCVEGCSA-N	247.294	1.964	10	20	BDCD	
CN1CCc2cc([C@@H](CN)N3CCCC3)ccc21	34936240	JBQRHIFZTANXKI-OAHLLOKOSA-N	245.370	1.775	10	20	BDCD	
C[C@H]1CCN(CC(=O)NCc2ccc(N)cc2)C1	1576728972	BBBDFUXJHAJGAO-NSHDSACASA-N	247.342	1.227	10	20	BDCD	
COC(=O)CN(C)Cc1cccc(C)c1O	179710126	HLEJXTKRQKMUSI-UHFFFAOYSA-N	223.272	1.305	10	20	BDCD	
C[C@H](CO)N[C@H](C)c1ccc(N(C)C)cc1	37258359	BWVNROJIOMNVKB-GHMZBOCLSA-N	222.332	1.784	10	20	BDCD	
C[C@@H]1C[C@@H]1C(=O)NCCc1ccc(N)cc1	40675580	MVYOQRARGBVRBZ-SKDRFNHKSA-N	218.300	1.584	10	20	BDCD	
CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1	247939114	MKBAKOLDZYQIGG-ZDUSSCGKSA-N	249.310	1.920	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC1CC(N)C1	906510558	LPWUDMQZPKRRQH-UHFFFAOYSA-N	233.359	1.640	10	20	BDCD	
Cc1cc(CN2CCN[C@H](C)C2)ccc1N(C)C	923292446	YEWUTJQEOMDNBE-CYBMUJFWSA-N	247.386	1.855	10	20	BDCD	
CN(C)CC1CN(C(=O)c2cc(O)cs2)C1	854722284	RQJSRYHOQSQTJT-UHFFFAOYSA-N	240.328	1.087	10	20	BDCD	
CN(C(=O)[C@@H]1CCCNCC1)c1ccc(N)cc1	877075854	JZVDBTOHTLPNMQ-LLVKDONJSA-N	247.342	1.621	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H](O)C[C@@H](C)C1	877576900	RFWFJUIHZNICEC-PWSUYJOCSA-N	235.327	1.903	10	20	BDCD	
C[C@]1(CO)CCCN1Cc1ccccc1O	788435846	NNQICOACMHOXLY-CYBMUJFWSA-N	221.300	1.739	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H](CO)C2(CCCC2)C1	409431261	JTCOBJFCSWDCAY-JTQLQIEISA-N	224.308	1.781	10	20	BDCD	
O=C(NCc1ccccc1O)c1ncccn1	735857894	URJRDLDXQMSZHY-UHFFFAOYSA-N	229.239	1.112	10	20	BDCD	
C[C@@H](NCCCN(C)C)c1ccccc1O	19958451	SFHCJGWSUZQNPG-LLVKDONJSA-N	222.332	1.995	10	20	BDCD	
CCc1cccc(CNCc2ncc[nH]2)c1O	691484984	XDHSXFLHCYPASC-UHFFFAOYSA-N	231.299	1.968	10	20	BDCD	
Cc1cccc(CN(C)[C@H](C)CN)c1O	381714516	KVGCRVPACSWWBR-SNVBAGLBSA-N	208.305	1.480	10	20	BDCD	
CCN1C[C@@H](N[C@@H](C)c2ccccc2O)CC1=O	391595237	HINVPNHIUZEKSQ-QWRGUYRKSA-N	248.326	1.664	10	20	BDCD	
COCCN(C)c1ccc(OC)c(F)c1	121741708	PTPRPMUXLOEGBL-UHFFFAOYSA-N	213.252	1.917	10	20	BDCD	
COC(=O)[C@@H](C)N(C)Cc1ccccc1O	119527652	ZCLDXXOWBOBWQK-SECBINFHSA-N	223.272	1.386	10	20	BDCD	
C[C@H]1C[C@H](CN)CN1Cc1ccc(N(C)C)cc1	216058697	JZIPFPQVEOOPHS-GXTWGEPZSA-N	247.386	1.922	10	20	BDCD	
CO[C@H]1CN(c2ccc(N)cc2)C[C@H]1OC	234987238	UQPBKPAXHRNTNW-TXEJJXNPSA-N	222.288	1.119	10	20	BDCD	
C[C@@H](NCCCOCCO)c1ccccc1O	183721922	MRRCKOZMCXTWMD-LLVKDONJSA-N	239.315	1.442	10	20	BDCD	
COc1ccc(CN[C@H](C)CO)cc1C	37258696	HIHHVUZEXSXNQO-SNVBAGLBSA-N	209.289	1.474	10	20	BDCD	
CC(C)(CO)CNCc1cc(F)ccc1O	226617532	CJFRXPZCPJSEFJ-UHFFFAOYSA-N	227.279	1.639	10	20	BDCD	
C[C@@H](O)C1(NC(=O)c2cc(O)cs2)CC1	856129501	YWRFOCLGXXHHNH-ZCFIWIBFSA-N	227.285	1.097	10	20	BDCD	
Nc1ccc(CNCC2(N)CCCC2)cc1	1120371953	WFCMMZGEWUXQBZ-UHFFFAOYSA-N	219.332	1.630	10	20	BDCD	
C[C@@H](NCCCCO)c1ccccc1O	193276906	KYQDQONWGJXDTM-SNVBAGLBSA-N	209.289	1.815	10	20	BDCD	
CCCC(=O)NCCc1ccc(O)c(O)c1	11638321	XNLMDDXRVYTBGW-UHFFFAOYSA-N	223.272	1.557	10	20	BDCD	
COC(=O)C[C@@H](N)c1ccc(N(C)C)cc1	19784021	ZDZPKDIOYSXSFS-LLVKDONJSA-N	222.288	1.316	10	20	BDCD	
OC[C@H](NCc1ccc2c(c1)CCCO2)C1CC1	921744105	RMEWQFGVCVPZSL-AWEZNQCLSA-N	247.338	1.872	10	20	BDCD	
C[C@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)CCN1	834673848	WUSVVXMYTCYGQE-GWCFXTLKSA-N	247.342	1.068	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@]3(CCNC3)C2)c1	310808021	AJKSTMUXXCREEQ-HNNXBMFYSA-N	246.354	1.886	10	20	BDCD	
C[C@@H](NC(=O)C1(N)CC1)c1ccccc1O	877255301	CCUGLJRTHSHKNP-MRVPVSSYSA-N	220.272	1.061	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2C[C@H]3CC[C@@H]2O3)c1	132359441	OSKJUQHIKVJJMG-BZPMIXESSA-N	249.310	1.810	10	20	BDCD	
CNCCCNCc1ccc2c(c1)CCO2	83350563	AGPRXZIPTSYIAV-UHFFFAOYSA-N	220.316	1.321	10	20	BDCD	
Oc1ccc(F)cc1CN1C[C@@H]2CNC[C@@H]2C1	226580321	ACRVEIXFSMZIJB-PHIMTYICSA-N	236.290	1.183	10	20	BDCD	
CN(C)c1ccc(CN[C@]2(C)CCOC2=O)cc1	289474290	HPYADGZSKCWPOS-CQSZACIVSA-N	248.326	1.548	10	20	BDCD	
CCOC1CN(Cc2cc(F)ccc2O)C1	297497588	UPXIUSXHMJROPW-UHFFFAOYSA-N	225.263	1.752	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)CN(C)C	877523698	LYRNDNNNCPPEML-NSHDSACASA-N	222.332	1.740	10	20	BDCD	
C[C@H]1CNCCN1Cc1cccc(Cl)c1O	843047452	MMXFQRNZLQQXIQ-VIFPVBQESA-N	240.734	1.839	10	20	BDCD	
CC[C@H]1CC[C@@H](C(=O)NCc2ccc(N)cc2)O1	1343566069	DJOBKXRHCOYTQO-STQMWFEESA-N	248.326	1.843	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)c2[nH]nnc2C)c1	862757261	NCWSKBYCYOXCTL-UHFFFAOYSA-N	246.270	1.057	10	20	BDCD	
CCC1(C(=O)NCc2cc(C)ccc2O)COC1	862757739	CZTIOTXHSNVBOP-UHFFFAOYSA-N	249.310	1.743	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H](O)C1	876589501	MCSLQLGITJZKFA-JTQLQIEISA-N	207.273	1.267	10	20	BDCD	
Cc1cc(O)c(CNC[C@H]2COCO2)cc1C	894871978	HOIIHCOPCXCVDQ-LBPRGKRZSA-N	237.299	1.472	10	20	BDCD	
C[C@H](O)CNCc1c(O)ccc(Cl)c1F	190666073	GETJKYSMNQIVLZ-LURJTMIESA-N	233.670	1.655	10	20	BDCD	
COc1cccc(CN2CC[C@H](F)C2)c1O	689863346	PNBQRBREEBNTFF-JTQLQIEISA-N	225.263	1.945	10	20	BDCD	
CCc1cccc(CN(C)CC(=O)NC)c1O	692109561	PCUXKQKOQODHDO-UHFFFAOYSA-N	236.315	1.132	10	20	BDCD	
NCC[C@@H]1CCCCN1Cc1ccc(N)cc1	1334775501	ZSEOJEBZDCBPKD-AWEZNQCLSA-N	233.359	1.972	10	20	BDCD	
NC[C@H](NCc1ccc(N)cc1)C1CCCC1	1356083734	ZJVRIKFKHMUGND-AWEZNQCLSA-N	233.359	1.876	10	20	BDCD	
O=C(NCC1CCC1)c1cccc(O)c1O	163270476	IFZCYXFUEXYASL-UHFFFAOYSA-N	221.256	1.628	10	20	BDCD	
COc1ccc(N(C)CC(=O)N(C)C2CC2)cc1	844353357	TVYCGZBINFGDTJ-UHFFFAOYSA-N	248.326	1.752	10	20	BDCD	
CC1(NC(=O)Cc2ccc(N)cc2)CC1	158194205	ISCMUUNOFLGNNQ-UHFFFAOYSA-N	204.273	1.480	10	20	BDCD	
C[C@@H](N)CCC(=O)N(C)Cc1ccccc1O	70316961	VVYRBYGKLLBAIU-SNVBAGLBSA-N	236.315	1.478	10	20	BDCD	
CN(C)c1ccc(CNC2(CO)CCC2)cc1	133142806	UNVUVIKTKQCHTN-UHFFFAOYSA-N	234.343	1.757	10	20	BDCD	
COCCN[C@@H](C)c1cc(F)cc(F)c1O	134906262	LBKBDFFXJBTQTI-ZETCQYMHSA-N	231.242	1.967	10	20	BDCD	
C[C@H](NCC(C)(C)N)c1ccccc1O	139130573	QPJXFTPYOACMNH-VIFPVBQESA-N	208.305	1.780	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@H]1CCCNC1)CC2	817941954	USIHIAPPXGQHCV-NWDGAFQWSA-N	232.327	1.721	10	20	BDCD	
C[C@H](N[C@H](CN)C1CC1)c1ccc(F)cc1O	817961265	VZZJHPDNXHVHIR-QPUJVOFHSA-N	238.306	1.919	10	20	BDCD	
COC[C@@H](C)NC(=O)c1cc(O)cs1	731864537	ZXHBWNOZMLBADL-ZCFIWIBFSA-N	215.274	1.218	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC(=O)N(C)C1	840937610	SMLWIIVMUMAZCU-UHFFFAOYSA-N	247.342	1.293	10	20	BDCD	
C/C=C(\C)C(=O)NCc1ccc(O)cc1O	910950042	AUXBBDCFGUXLIE-FPYGCLRLSA-N	221.256	1.680	10	20	BDCD	
CN(CCF)c1ccc(OCC(=O)O)cc1	846279814	MGGAGYWUMHPNMJ-UHFFFAOYSA-N	227.235	1.556	10	20	BDCD	
CC1=NO[C@H](CNCc2ccccc2O)C1	895312075	TXQYPIBOMMLBSY-NSHDSACASA-N	220.272	1.647	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@@H](O)[C@H](CCF)C1	409429951	IAMFCAMDQYJCIS-RKDXNWHRSA-N	216.260	1.339	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@@H]2CCCC[C@@]2(CO)C1	409430794	JAMHTIXHJPZXIK-ONGXEEELSA-N	238.291	1.308	10	20	BDCD	
COc1ccc(O)c(CNc2ncccn2)c1	83357880	XGIAADBZYPUNOG-UHFFFAOYSA-N	231.255	1.803	10	20	BDCD	
CC(=O)OC[C@@H](C)N[C@H](C)c1ccccc1O	895852225	RUAOOHHROVOEAM-NXEZZACHSA-N	237.299	1.994	10	20	BDCD	
O=C(NCc1ccccc1O)C1=CCOCC1	793679851	DPEBBANBOQUOTG-UHFFFAOYSA-N	233.267	1.355	10	20	BDCD	
CN(C)c1ccc(OCC2(CO)COC2)cc1	757718754	WRLWTNQIBYHAQO-UHFFFAOYSA-N	237.299	1.140	10	20	BDCD	
CN(C)CCCN(C)Cc1cc(F)ccc1O	234231703	REKTZSBLRXGDSL-UHFFFAOYSA-N	240.322	1.915	10	20	BDCD	
Cc1ccc(CNC[C@@H]2CCCNC2=O)c(O)c1	877586938	YLATXURFIABTTC-LBPRGKRZSA-N	248.326	1.316	10	20	BDCD	
CN1CC[C@]2(CCN(Cc3ccccc3O)C2)C1	292865467	VUMHBBWDSLANHH-HNNXBMFYSA-N	246.354	1.920	10	20	BDCD	
C[C@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)CO1	402046777	NPJIFKLIIYINPZ-JOYOIKCWSA-N	234.299	1.105	10	20	BDCD	
CCOc1cccc(CN(C)[C@H](C)CN)c1O	382998407	NPMVRSBOEMBQLP-SNVBAGLBSA-N	238.331	1.570	10	20	BDCD	
COc1cccc(CN[C@H]2C[C@H](CO)C2)c1O	923008726	WDDDVDFLQXLRAK-HOMQSWHASA-N	237.299	1.261	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2CCCC[C@@H]2O)cc1	51988695	SOKSGBLFUXVKJS-STQMWFEESA-N	248.326	1.231	10	20	BDCD	
CCOc1cccc(CN[C@@H](CC)CO)c1O	20195031	ISLXXYOOFICIMX-NSHDSACASA-N	239.315	1.651	10	20	BDCD	
O[C@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2	323277184	KLIUJYPIDSNRAX-STQMWFEESA-N	233.311	1.625	10	20	BDCD	
COCCC1(C(=O)NCc2ccc(N)cc2)CC1	297245618	QGCARQAQJVTUFM-UHFFFAOYSA-N	248.326	1.702	10	20	BDCD	
C[C@@]1(NCc2ccc3c(c2)CCO3)CCOC1=O	289910258	USTAMMWBKNQTIZ-CQSZACIVSA-N	247.294	1.417	10	20	BDCD	
O=C(CCO)NCc1cc(Cl)ccc1O	902951578	YLILDUBZDOTTTA-UHFFFAOYSA-N	229.663	1.044	10	20	BDCD	
O=C(c1cc(O)cs1)N1O[C@H]2C=C[C@H]1CC2	831519921	ADGVAWDLRZLKIC-CBAPKCEASA-N	237.280	1.928	10	20	BDCD	
COCCCCNC(=O)c1cc(O)cs1	731869241	DGPKVFLWUVYZNN-UHFFFAOYSA-N	229.301	1.610	10	20	BDCD	
CCc1cccc(CN(C)CC(=O)OC)c1O	848880506	FWHNXJNKBWJLHE-UHFFFAOYSA-N	237.299	1.559	10	20	BDCD	
C[C@H](Cn1cccn1)NCCc1ccc(N)cc1	841033844	BXOBHBASLRUZHH-GFCCVEGCSA-N	244.342	1.686	10	20	BDCD	
CCN(C)c1ccc(CN2CCOCC2)cc1	741752662	DNQRZUJKNIIZRP-UHFFFAOYSA-N	234.343	1.975	10	20	BDCD	
CNCCNCc1c(O)ccc(Cl)c1F	841035628	IMZXFQWQLQISER-UHFFFAOYSA-N	232.686	1.494	10	20	BDCD	
COC(=O)C[C@@H](N)c1cc(F)ccc1O	95638079	QWYDJKUUVMGCNN-MRVPVSSYSA-N	213.208	1.094	10	20	BDCD	
COc1cccc(CNC[C@@H]2CCN2C)c1O	712584557	BNTDMLPIKQZSKJ-NSHDSACASA-N	236.315	1.195	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2COC[C@@H]2C)c1	699482838	ZXPHGQAODWQMES-CMPLNLGQSA-N	221.300	1.825	10	20	BDCD	
CC1(NCc2ccc(N)cc2)CCNCC1	1334775477	YXDRYSLKABYHOT-UHFFFAOYSA-N	219.332	1.501	10	20	BDCD	
CC(=O)CN(C)c1ccc(OCC(=O)O)cc1	1603002279	ZSEHTDAQFIMUFY-UHFFFAOYSA-N	237.255	1.175	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@H](C)c1cc(F)ccc1O	168830504	DSQBONJJNUCYSL-JGVFFNPUSA-N	240.278	1.446	10	20	BDCD	
CCc1nnc(Sc2nccs2)[nH]1	306517042	ZWQOBLOSFLOBCK-UHFFFAOYSA-N	212.303	1.975	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2C[C@H]2F)cc1	1122540283	RHOAPAXQPFVSFK-VHSXEESVSA-N	208.236	1.243	10	20	BDCD	
CCNC(=O)[C@H](C)N[C@H](C)c1ccccc1O	36795289	XTLQJXHIAIUBPV-ZJUUUORDSA-N	236.315	1.567	10	20	BDCD	
C[C@H](CN[C@@H]1CCc2cccc(O)c21)N(C)C	297659997	KNFDAHVBAAOXCB-ZYHUDNBSSA-N	234.343	1.919	10	20	BDCD	
C[C@@H](NC(=O)[C@H](N)CC1CC1)c1ccccc1O	1330875622	HBKNGZQKVSEMIW-BXKDBHETSA-N	248.326	1.697	10	20	BDCD	
CCOC(=O)CN(C)c1ccc(N)cc1	20374448	XSJMIFPEJWMEJV-UHFFFAOYSA-N	208.261	1.268	10	20	BDCD	
C[C@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)CCO1	235709689	WPUYCNRRKVZPHP-GXFFZTMASA-N	248.326	1.495	10	20	BDCD	
CC1(C)C[C@@H]1CNC(=O)Cc1ccc(N)cc1	226350875	UBAANIIFKDFSNL-LLVKDONJSA-N	232.327	1.974	10	20	BDCD	
COc1ccc(O)c(CN[C@H](CO)C(C)C)c1	92392548	WGFVDJYUFNFEGX-GFCCVEGCSA-N	239.315	1.507	10	20	BDCD	
CN1CC[C@H]1CNCc1cccc(Cl)c1O	712563950	BIMRDNZKCLVRMI-JTQLQIEISA-N	240.734	1.839	10	20	BDCD	
C[C@@H](NC[C@@H](N)C1CC1)c1ccc(F)cc1O	817965930	XCTLLZKVBKZMII-PRHODGIISA-N	238.306	1.919	10	20	BDCD	
Cc1nonc1C(=O)N[C@H](C)c1ccccc1O	827937339	SOECHRKXTGAIBO-SSDOTTSWSA-N	247.254	1.575	10	20	BDCD	
COCC[C@@H](CO)NCc1ccc(C)cc1O	877501015	KYVMISZWHJSKOR-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
COc1cccc(CNCC(F)(F)CN)c1O	841059309	APQYDDQPIULBIQ-UHFFFAOYSA-N	246.257	1.084	10	20	BDCD	
COC1CN(Cc2cc(F)cc(F)c2O)C1	894970882	ONHCZYQUZVSXQZ-UHFFFAOYSA-N	229.226	1.501	10	20	BDCD	
Cc1ccc([C@H](C)NC[C@H](C)O)c(O)c1	35601542	YPIMBHDITIXSNT-UWVGGRQHSA-N	209.289	1.732	10	20	BDCD	
Cc1ccc(O)c(CNCc2cncn2C)c1	289903694	RDGYDNZCPIGCLU-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
O=C(NCc1ccccn1)c1cccc(O)c1O	126228946	TVYFECIRJIOENG-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
CN(C[C@@H]1CCCO1)C(=O)Cc1ccc(N)cc1	42463301	KYUMPBGQULFOBG-ZDUSSCGKSA-N	248.326	1.449	10	20	BDCD	
CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1	145433864	YQBABVBSOULFJL-NSHDSACASA-N	248.326	1.720	10	20	BDCD	
C[C@H](N)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O	817972906	PJHRPWAXMIJZCF-YUMQZZPRSA-N	239.275	1.298	10	20	BDCD	
CCC(=O)[C@@H](C)OC(=O)c1cc(O)cs1	732353126	DNGNEMGLGQSEIS-ZCFIWIBFSA-N	228.269	1.978	10	20	BDCD	
O=C(NCc1ccco1)NCc1ccccc1O	748324442	DLXBOLVNMZWLQZ-UHFFFAOYSA-N	246.266	1.985	10	20	BDCD	
CO[C@@H](C)CNC(=O)NCc1ccccc1O	852530909	RWPOOZYBQQIEAI-VIFPVBQESA-N	238.287	1.226	10	20	BDCD	
COCC1(NCc2cc(OC)ccc2O)CC1	697491762	AAUXYZQHPXIJCX-UHFFFAOYSA-N	237.299	1.669	10	20	BDCD	
O=C(NCCCF)NCc1ccccc1O	767961917	RPCBJDXRVIQYMC-UHFFFAOYSA-N	226.251	1.551	10	20	BDCD	
COC/C=C\C(=O)NCc1ccccc1O	774061624	BRQZNLODXNJEBF-DAXSKMNVSA-N	221.256	1.211	10	20	BDCD	
O=C(NOC1CCOCC1)c1cc(O)cs1	776264195	OAXHCAVOVASQNV-UHFFFAOYSA-N	243.284	1.294	10	20	BDCD	
C[C@@H](CO)N[C@@H](C)c1c(O)cccc1F	886532761	OIOYBVBETSUOGR-YUMQZZPRSA-N	213.252	1.563	10	20	BDCD	
C[C@@H](NC[C@@H]1CCC(=O)N1)c1ccccc1O	79952421	GTRHRSYDNRYRLU-ZJUUUORDSA-N	234.299	1.321	10	20	BDCD	
COCC1CN(Cc2ccc(C)cc2O)C1	895976526	RDFUEEUQFBWXPV-UHFFFAOYSA-N	221.300	1.779	10	20	BDCD	
Cc1ccc(CN[C@H](C)C[C@@H](C)N)c(O)c1	1579696841	IXJCAONCNZXVGJ-GHMZBOCLSA-N	222.332	1.916	10	20	BDCD	
CC(C)CNC(=S)NCc1cccn1C	231647833	DXZDZKPTHUDYJK-UHFFFAOYSA-N	225.361	1.645	10	20	BDCD	
CN(C(=O)[C@@H]1CCCCN1C)c1ccc(N)cc1	877077049	UYPHPKZAUVDJCY-ZDUSSCGKSA-N	247.342	1.716	10	20	BDCD	
CCN(C)C(=O)CNCc1ccc(C)cc1O	877421333	CCDUTHRVAPVNDJ-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CC[C@H](OC)C(=O)NCCc1ccc(N)cc1	269150003	NUYBTKQNQVFTCT-LBPRGKRZSA-N	236.315	1.353	10	20	BDCD	
O[C@@H]1CC[C@H]1NCc1ccc(N2CCCC2)cc1	1352028809	JATWIUCUJAMEQG-HUUCEWRRSA-N	246.354	1.900	10	20	BDCD	
C[C@@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)CCO1	235359186	WPUYCNRRKVZPHP-MFKMUULPSA-N	248.326	1.495	10	20	BDCD	
Nc1ccc(CN2CCN3C(=O)CC[C@H]3C2)cc1	126332033	OFPHHAZCPLGBGF-ZDUSSCGKSA-N	245.326	1.075	10	20	BDCD	
CCN(CC(N)=O)Cc1cccc(C)c1O	188466198	ICRLZWCPJSHOGZ-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
C[C@@H]1CN(CCSc2nccs2)CCO1	188301841	UQZFLIUHNPCBSL-SECBINFHSA-N	244.385	1.956	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCc2ncc[nH]2)c1	80581902	YTPLYKRLRTYERP-VIFPVBQESA-N	247.298	1.975	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)CC[C@H]1O	253210666	ZQJZFEQYCCMRLU-ZWNOBZJWSA-N	220.316	1.472	10	20	BDCD	
C[C@H](N[C@@H]1CCNC1)c1cc(F)ccc1O	817945302	ZBPSFXMPMBJCFF-WCBMZHEXSA-N	224.279	1.544	10	20	BDCD	
C[C@H](NCc1ccc(N(C)C)c(F)c1)C(=O)O	739030963	IHBURRIXMJNLEZ-QMMMGPOBSA-N	240.278	1.454	10	20	BDCD	
C[C@@H](CNC(=O)c1cc(O)cs1)N(C)C	732268171	DAQDTXAKIUHJCU-ZETCQYMHSA-N	228.317	1.134	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@@H]2CC(=O)N(C)C2)c1	273564583	JCVRFFBKBLRGON-GHMZBOCLSA-N	248.326	1.582	10	20	BDCD	
CN(C(=O)C(C)(F)F)c1ccc(N)cc1	702069470	LGHMMUSHJYKTIG-UHFFFAOYSA-N	214.215	1.887	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)c2ncnn2C)c1	276755085	UACMZBIKZOUGLN-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
C[C@H](O)COC(=O)/C=C\c1ccc(O)c(O)c1	792039747	GEIBBGKKKXKFEQ-NHLYECAPSA-N	238.239	1.035	10	20	BDCD	
C[C@H](N[C@H]1CCCN(C)C1=O)c1ccccc1O	707764253	ZUKHDPDGGBZLLL-JQWIXIFHSA-N	248.326	1.664	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cccc(Cl)c1O	165157441	DTIUVFSLGHXIRV-SSDOTTSWSA-N	243.690	1.697	10	20	BDCD	
Cc1cccc(CN[C@H](C)c2ncn(C)n2)c1O	276264032	QGRCRIVOVXAMJQ-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
C[C@H](CCO)CN[C@@H]1CCc2cccc(O)c21	297529347	DLRNSVXYGKQESH-ZYHUDNBSSA-N	235.327	1.988	10	20	BDCD	
COCCCC(=O)N[C@H](C)c1ccccc1O	827931088	XQYFRRGLEYZGHE-SNVBAGLBSA-N	237.299	1.996	10	20	BDCD	
Cc1cccc(CN2CCC[C@H](O)C2)c1O	132479555	HGUGINYYIJHURZ-LBPRGKRZSA-N	221.300	1.657	10	20	BDCD	
CCN(CC(N)=O)Cc1c(O)cccc1Cl	231829989	RTKPNHUYGOJZAH-UHFFFAOYSA-N	242.706	1.353	10	20	BDCD	
C[C@H](CCO)NCc1cc(Cl)ccc1O	96811789	YJLFBGHWSUBCNF-MRVPVSSYSA-N	229.707	1.906	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](O)C[C@@H](C)C2)c1	825311807	OIZZMTGOYZLWEJ-YPMHNXCESA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(C(=O)O[C@H]2CCOC2)c(O)c1O	837483689	CWQOKNCUFAFUGN-QMMMGPOBSA-N	238.239	1.352	10	20	BDCD	
O[C@H]1C[C@H](NCc2ccc(N3CCCC3)cc2)C1	1327265231	WIGSNVGSPCPCFF-CTYIDZIISA-N	246.354	1.900	10	20	BDCD	
C[C@H](N)C[C@@H](C)NC(=O)Cc1ccc(N)cc1	843503279	JTDPUANMNLLOTO-VHSXEESVSA-N	235.331	1.053	10	20	BDCD	
CCO[C@H]1C[C@@H]1C(=O)NCc1cc(C)ccc1O	862758910	QHXXGNAFQRXZBU-AAEUAGOBSA-N	249.310	1.742	10	20	BDCD	
Nc1ccc(CC(=O)NC2CCC2)cc1	52206421	VXFZWWONYSLUNS-UHFFFAOYSA-N	204.273	1.480	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H](O)C2)cc1F	157651463	JGLDZUNBJMBOIK-NSHDSACASA-N	238.306	1.458	10	20	BDCD	
CC[C@](C)(O)CNCc1c(C)cccc1O	876915671	XKWAVBSTOSJRIX-ZDUSSCGKSA-N	223.316	1.951	10	20	BDCD	
CC[C@@H]1CN(C(=O)Nc2ccc(N)cc2)CCO1	36770594	ARIWTPUKCGNTAM-GFCCVEGCSA-N	249.314	1.912	10	20	BDCD	
COC(=O)[C@@H]1CCCN1Cc1cc(C)ccc1O	124813092	IHYLDVGOLPNJQP-LBPRGKRZSA-N	249.310	1.838	10	20	BDCD	
Oc1ccc(F)cc1CN[C@H]1CCCC[C@@H]1O	190265888	YPARGYYZSKQJEB-AAEUAGOBSA-N	239.290	1.924	10	20	BDCD	
COC(=O)c1cnc(SCCCO)s1	295267159	JEFUUBBXNPAADJ-UHFFFAOYSA-N	233.314	1.404	10	20	BDCD	
CO[C@H]1COC[C@@H]1N[C@H](C)c1ccccc1O	290214424	QFSQDXWWDBEWHG-CDMKHQONSA-N	237.299	1.457	10	20	BDCD	
CCn1ccnc1SCC(=O)C(C)=O	808020696	LBCPILQMYUXSFA-UHFFFAOYSA-N	212.274	1.153	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@@H](C)CN)c1	817970033	JXHWLARLVXZPLP-DTWKUNHWSA-N	224.304	1.399	10	20	BDCD	
NC1(CNCc2cccc(Cl)c2O)CC1	904449404	HRCHLXWYOIXHHJ-UHFFFAOYSA-N	226.707	1.627	10	20	BDCD	
O=C(NCC(F)(F)F)c1cc(O)cs1	731867945	DJLOQUMZURQRQK-UHFFFAOYSA-N	225.191	1.746	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](CO)C2CC2)cc1C	742371117	IBSRCCMLQUUUCU-ZDUSSCGKSA-N	235.327	1.870	10	20	BDCD	
CCN(CCOCCN)c1ccc(OC)cc1	843358052	YHLCOBYJPZKJCU-UHFFFAOYSA-N	238.331	1.497	10	20	BDCD	
CNC[C@H](C)N[C@@H](C)c1ccccc1O	854230946	CDAHMAHFXOIJMU-UWVGGRQHSA-N	208.305	1.651	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOC[C@@H]2CCC[C@@H]21	409429414	RPGLHFFQMUJAAY-IUCAKERBSA-N	224.264	1.324	10	20	BDCD	
Oc1c(F)cccc1CNC[C@@H]1[C@H]2CNC[C@H]21	1580888757	YCFLRXGSPZQERU-RTCCRHLQSA-N	236.290	1.086	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2O3)cc1	386636214	HPQJVWCGYCMSDP-FRRDWIJNSA-N	246.310	1.453	10	20	BDCD	
C[C@@H]1[C@@H](C(=O)NCc2ccccc2O)C1(F)F	1263769006	MAUUUXBAKXAVET-XCBNKYQSSA-N	241.237	1.910	10	20	BDCD	
CCOCCC(=O)NCc1ccccc1O	122390194	ALEFNZFSRFXSQG-UHFFFAOYSA-N	223.272	1.435	10	20	BDCD	
O=C(NC1CCCC1)c1cccc(O)c1O	126191494	UTXWZDBTIVNMAZ-UHFFFAOYSA-N	221.256	1.770	10	20	BDCD	
CO[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1	49086461	PUOUPJKVEPUAKD-JTQLQIEISA-N	236.315	1.404	10	20	BDCD	
C[C@H](CCN)NCc1ccc2c(c1)CCO2	220517936	RZWYPOSMZMENSZ-SNVBAGLBSA-N	220.316	1.448	10	20	BDCD	
CCOc1cccc(CNC[C@@H](C)OC)c1O	191206107	GTPQMNBOROJKHG-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
Nc1ccc(NC(=O)CCC2CCNCC2)cc1	238133937	GEKWMEICIWYRHI-UHFFFAOYSA-N	247.342	1.987	10	20	BDCD	
C[C@H]1CC(=O)NCCN1Cc1ccccc1O	377825473	CBLCOWDAIZQUBP-JTQLQIEISA-N	234.299	1.103	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2[C@H]3CCC(=O)[C@H]32)cc1	911661459	VBMYYTJFOSGCGQ-ZMLRMANQSA-N	230.267	1.432	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCC1(CO)CC1	840935824	ZXHQQOZUDVLEGV-UHFFFAOYSA-N	248.370	1.923	10	20	BDCD	
CC[C@@H](C)C[C@@H](N)C(=O)Nc1ccc(N)cc1	911660887	NWISYQBOKOCACX-BXKDBHETSA-N	235.331	1.971	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCN[C@H](C)C2)c1	841061403	IHTIKOBEDZSVDH-DGCLKSJQSA-N	234.343	1.931	10	20	BDCD	
C[C@H](NCc1nccn1C)c1ccccc1O	71273072	YYPMOROQHVKZLN-JTQLQIEISA-N	231.299	1.977	10	20	BDCD	
[N-]=[N+]=NCCN1CCC(N2CCOCC2)CC1	409428768	NCBBQLPCKVFPJR-UHFFFAOYSA-N	239.323	1.093	10	20	BDCD	
OC[C@]12C[C@@H]1CN(Cc1ccccc1O)C2	783745334	VTEDGKPWYDRFPN-DGCLKSJQSA-N	219.284	1.206	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CCO[C@H]3C[C@@H]32)c1	793620604	WZYJIWTYZQWTJF-STQMWFEESA-N	233.311	1.982	10	20	BDCD	
C[C@@H]1[C@@H](C)N(Cc2ccc(N)cc2)CCN1C	1334754802	RQPQKKMVWMTCRB-VXGBXAGGSA-N	233.359	1.793	10	20	BDCD	
Cc1ccc(CN2CCC[C@@H](C(=O)O)C2)c(O)c1	1594358488	BAXYBJZGEWQHFQ-GFCCVEGCSA-N	249.310	1.997	10	20	BDCD	
N[C@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)C1	1580423048	NFHBNQQPSCVWFW-BETUJISGSA-N	232.327	1.591	10	20	BDCD	
C[C@H](NCCO)c1cc(F)cc(F)c1O	134911086	OLNUCSKENBTNJS-LURJTMIESA-N	217.215	1.313	10	20	BDCD	
CCN(Cc1ccccc1O)[C@H]1CCNC1=O	281798983	OSOSABQEXZYAEZ-NSHDSACASA-N	234.299	1.103	10	20	BDCD	
CCN(CC(N)=O)Cc1cc(C)c(C)cc1O	188063968	PDZKPOYVGIFWTI-UHFFFAOYSA-N	236.315	1.316	10	20	BDCD	
CCOCCCC(=O)NCc1ccc(N)cc1	95033960	WXQSNFOJNDXAES-UHFFFAOYSA-N	236.315	1.702	10	20	BDCD	
C[C@@H](N[C@@H]1CCN(C)C1)c1cc(F)ccc1O	94617858	QZUUWIWSDVNAGL-MWLCHTKSSA-N	238.306	1.886	10	20	BDCD	
C[C@@H](CN(C)C)N[C@H]1CCc2cccc(O)c21	297436610	VSOKLPVFGJUDHI-JQWIXIFHSA-N	234.343	1.919	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@H](C)CO	809745132	DDOOZHSCTKEYTQ-SECBINFHSA-N	225.288	1.213	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)C[C@]1(C)CO	827700461	UKCZMKMPXNKFOI-SMDDNHRTSA-N	235.327	1.843	10	20	BDCD	
COc1ccc(CNC2CC(N)C2)cc1C	906510701	RDTKJSGDRZSYRC-UHFFFAOYSA-N	220.316	1.583	10	20	BDCD	
CCN[C@H](C)CNCc1cccc(F)c1O	841066996	YXGWXUJJCHRZLK-SECBINFHSA-N	226.295	1.619	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](N)[C@H](C)C2)c1O	843053085	YMDUMSBVQDQNOW-DGCLKSJQSA-N	234.343	1.870	10	20	BDCD	
O=C1OC[C@@H](COC(=O)c2cc(O)cs2)O1	763973896	VPXNLVKYFVCLNG-ZCFIWIBFSA-N	244.224	1.146	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)[C@@H](C)CN1	86466781	WHXKGXMNJSTLIV-STQMWFEESA-N	247.386	1.935	10	20	BDCD	
CC[C@](C)(CO)NCc1cccc(OC)c1O	80886477	UUSDUJLDWSGFOG-CYBMUJFWSA-N	239.315	1.651	10	20	BDCD	
c1cc2c(cc1CNC1CCNCC1)CCCO2	84565845	OGYXATLYXLCSLT-UHFFFAOYSA-N	246.354	1.853	10	20	BDCD	
CCO[C@H]1CCN(C(=O)Nc2ccc(N)cc2)C1	701740343	PRWSWBILKRZVDA-LBPRGKRZSA-N	249.314	1.912	10	20	BDCD	
OCCNCc1c(O)ccc(Cl)c1F	190695789	HQEJVQWGHYZACC-UHFFFAOYSA-N	219.643	1.267	10	20	BDCD	
Nc1ccc(CNC(=O)NC[C@H]2CCCO2)cc1	1335362556	ZXSVVBFLAHLGMM-GFCCVEGCSA-N	249.314	1.247	10	20	BDCD	
C[C@H](NCc1ccc(N)cc1)[C@H]1CCCNC1	1336285369	LHVQVLZPAQVWKW-AAEUAGOBSA-N	233.359	1.747	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)NCc2ccc(N)cc2)CCN1	1341932407	YGEDBNHTGLCYJE-ZYHUDNBSSA-N	247.342	1.273	10	20	BDCD	
CNCCCN(C)c1ccc(OC)c(OC)c1	125005538	MIYBQQMJJDHOBL-UHFFFAOYSA-N	238.331	1.750	10	20	BDCD	
O=C(O)[C@H]1CCC[C@H]1NCc1ccccc1O	1601810912	XDMAMEUYUMKPRR-WDEREUQCSA-N	235.283	1.735	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCNC2(C)C)c1O	841087255	SJGHCBFQEVFPGO-GFCCVEGCSA-N	234.343	1.931	10	20	BDCD	
Cc1ccc(CN2CC[C@](C)(C(N)=O)C2)c(O)c1	877493068	DAESLCHYQHCJNK-AWEZNQCLSA-N	248.326	1.398	10	20	BDCD	
CCc1noc(CN(C)Cc2ccccc2O)n1	109769631	BZUFTTDMSFORIV-UHFFFAOYSA-N	247.298	1.970	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)Nc1cn[nH]c1	180925602	CMMJPTBYBGRQGU-DUXPYHPUSA-N	245.238	1.473	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@@H](C)CCO)c1	132434853	KVZYOEUWXVLTME-UWVGGRQHSA-N	239.315	1.822	10	20	BDCD	
C[C@H](CCO)N(C)Cc1ccccc1O	846110947	LNVLAFAKOHTMKA-SNVBAGLBSA-N	209.289	1.595	10	20	BDCD	
C[C@]1(O)CC[C@@H]1NCc1ccc(N)cc1	1898196719	PGHQJOAZWRYTCY-RYUDHWBXSA-N	206.289	1.272	10	20	BDCD	
Nc1ccc(CC(=O)NCC[C@@H](O)C2CC2)cc1	1358499668	DPAZUIYGLSFKTI-CYBMUJFWSA-N	248.326	1.089	10	20	BDCD	
Cc1ccc(CNC[C@H]2COCO2)c(O)c1	894888916	MEKVLHSAPVZBLY-NSHDSACASA-N	223.272	1.163	10	20	BDCD	
CC[C@@H](NCc1cnnn1C)c1ccccc1O	287386002	PUGIBNPODSIOBZ-GFCCVEGCSA-N	246.314	1.762	10	20	BDCD	
C[C@@H]1C[C@@H](N)CCN1Cc1ccccc1O	168845000	LCYJMLUNZJSYGT-PWSUYJOCSA-N	220.316	1.704	10	20	BDCD	
CC(=O)C(=O)CSc1ncccc1C	289729880	SORSXSUDECNKEA-UHFFFAOYSA-N	209.270	1.640	10	20	BDCD	
COc1ccc(CNC[C@H](N)C2CC2)cc1C	841049741	NKPDJAYAELMHQV-ZDUSSCGKSA-N	234.343	1.831	10	20	BDCD	
CCN(CC(N)=O)Cc1ccc(N(C)C)cc1C	840942183	VAXZGLCAMBWUCL-UHFFFAOYSA-N	249.358	1.368	10	20	BDCD	
CCCNC(=S)NCc1ccccc1O	748159260	UTTCQXNHCRAPCN-UHFFFAOYSA-N	224.329	1.766	10	20	BDCD	
CC[C@H](OC)C(=O)NCc1cc(C)ccc1O	862758988	SGGOPQKREVPXTO-LBPRGKRZSA-N	237.299	1.742	10	20	BDCD	
C[C@]1(NC(=O)c2cc(O)cs2)CCOC1	765234080	ILIZSIBBDNIYHL-JTQLQIEISA-N	227.285	1.363	10	20	BDCD	
O=C(OCc1ccccn1)c1cccc(O)c1O	776281410	CJIOLHQBSBBAQF-UHFFFAOYSA-N	245.234	1.850	10	20	BDCD	
CN1CCCc2cc(CN[C@@H]3CCOC3)ccc21	75186316	WGLGTCASJKQVAR-CQSZACIVSA-N	246.354	1.948	10	20	BDCD	
CC[C@@H]1CN(c2ccc(N)cc2)CC[C@H]1O	409436081	XYLFIKIJRGJELC-ZWNOBZJWSA-N	220.316	1.866	10	20	BDCD	
C[C@H](O)[C@H]1CCCN1c1ccc(N)cc1	409426776	IRHNDIUKANLSKC-JOYOIKCWSA-N	206.289	1.618	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccc(F)cc2)C1	409422586	GLBXEBYMBUVKGK-UHFFFAOYSA-N	220.207	1.960	10	20	BDCD	
CCOc1cccc(CNCCCNC)c1O	83366297	RPGRFNPJNCPXDC-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
C[C@@H](CO)CN[C@H](C)c1ccccc1O	83215434	VZSFWQZCKKDXQX-NXEZZACHSA-N	209.289	1.671	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2COC[C@H]2C)c1	699482843	ZXPHGQAODWQMES-ZYHUDNBSSA-N	221.300	1.825	10	20	BDCD	
O=C(O)[C@@H](CF)NCc1cccc(F)c1O	1601651844	XJXXMOFGXTWYNU-MRVPVSSYSA-N	231.198	1.044	10	20	BDCD	
Oc1ccccc1CNCCCn1ccnc1	20506312	OXEFTYXMHAPZPF-UHFFFAOYSA-N	231.299	1.769	10	20	BDCD	
C[C@@H](N[C@@H]1CCN(C)C1=O)c1ccccc1O	120855947	AHWDXIFYPVROOO-MWLCHTKSSA-N	234.299	1.274	10	20	BDCD	
CC[C@H](O)CNCc1ccc2c(c1)CCO2	229964595	XNYISUZYZDPDII-LBPRGKRZSA-N	221.300	1.482	10	20	BDCD	
Nc1ccc(CNC(=O)C2[C@H]3CCC[C@H]23)cc1	161546189	KOTBDPMCRMBPNV-RYUDHWBXSA-N	230.311	1.931	10	20	BDCD	
C[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1	276586359	MHYVHWWQEANHPA-SSDOTTSWSA-N	239.246	1.719	10	20	BDCD	
CCN(C)c1ccc(CN(C)CCCO)cc1	815106856	BQMPJVSWOFAERU-UHFFFAOYSA-N	236.359	1.957	10	20	BDCD	
C[C@H](NC1CCNCC1)c1cc(F)ccc1O	817937527	XHVOKUADSBDDCM-VIFPVBQESA-N	238.306	1.934	10	20	BDCD	
C[C@H](N[C@@H]1CCCNC1)c1ccc(F)cc1O	817942126	XADDSTHUDCLDOS-GXSJLCMTSA-N	238.306	1.934	10	20	BDCD	
Cc1cccc(CNC[C@H](N)C2CC2)c1O	841050781	UDEPHFAEERMYHW-LBPRGKRZSA-N	220.316	1.528	10	20	BDCD	
CNCCNCc1cc(Cl)cc(F)c1O	841036821	UWAOCVVLDVATSH-UHFFFAOYSA-N	232.686	1.494	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)C[C@@H](C)N)c1	843129849	SDSCVKFENJCSOT-NXEZZACHSA-N	238.331	1.616	10	20	BDCD	
CCN(CCN)Cc1ccc(N(C)C)c(C)c1	923398193	IJGHDLLUNYZCDJ-UHFFFAOYSA-N	235.375	1.842	10	20	BDCD	
C[C@@H]1CCCN(Cc2ccc(N)cc2)[C@@H]1CN	1120263964	YGYDIFMYWQDIHU-BXUZGUMPSA-N	233.359	1.828	10	20	BDCD	
Cc1cccc(CN[C@@H](C)CN(C)C)c1O	165176188	NFGBYBWLBSAPEO-NSHDSACASA-N	222.332	1.740	10	20	BDCD	
C[C@](O)(CNCc1ccccc1O)C(F)(F)F	270483083	JSLHQUMCOXJQTH-JTQLQIEISA-N	249.232	1.795	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cnn(C)c1	97496526	HYPNKRKRBZBRSV-UHFFFAOYSA-N	245.282	1.398	10	20	BDCD	
COC[C@H]1CN(Cc2ccc(N)cc2)CCO1	705830360	QERIDXGPRNRWQW-CYBMUJFWSA-N	236.315	1.116	10	20	BDCD	
CCc1cccc(CNCc2cn(C)nn2)c1O	709428412	AVBTZQMRSDISKU-UHFFFAOYSA-N	246.314	1.373	10	20	BDCD	
CCc1cccc(CN(C)CCN(C)C)c1O	692110818	ZRPVECPPKIDJAE-UHFFFAOYSA-N	236.359	1.948	10	20	BDCD	
C[C@@H](NC(=O)[C@@H](N)CC1CC1)c1ccccc1O	1330875623	HBKNGZQKVSEMIW-SKDRFNHKSA-N	248.326	1.697	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)CC[C@H]1N	300417483	VKQVLPSAKUBEOS-BXKDBHETSA-N	238.306	1.700	10	20	BDCD	
CSCCNC(=O)Cc1ccc(N)cc1	68993312	WOHXSJQDLXQDAY-UHFFFAOYSA-N	224.329	1.291	10	20	BDCD	
C[C@H](CC(N)=O)NCc1ccc(N(C)C)cc1	122783871	XFCSOBBTVUPZIU-SNVBAGLBSA-N	235.331	1.106	10	20	BDCD	
CC[C@](C)(O)CNCc1ccc2c(c1)CCO2	96478845	SZXLIDWDOZATJG-AWEZNQCLSA-N	235.327	1.872	10	20	BDCD	
C[C@H](CN)N[C@H]1CCc2cccc(O)c21	817966089	GFAGOWMBBNIUMJ-SCZZXKLOSA-N	206.289	1.316	10	20	BDCD	
NC1CC(NCc2c(O)cccc2Cl)C1	906509559	JJWYSOKWIOPIDV-UHFFFAOYSA-N	226.707	1.625	10	20	BDCD	
CCc1nnc(SCC(=O)C(C)=O)s1	849973111	OGGKIPATGAVTEV-UHFFFAOYSA-N	230.314	1.351	10	20	BDCD	
Cc1cnc(CNC(=O)c2cc(O)cs2)o1	748378280	IZAGZUGAEBWQPK-UHFFFAOYSA-N	238.268	1.680	10	20	BDCD	
COc1ccc(CNC(=N)NC2CCC2)c(O)c1	849025143	PSUKXLNNOMETRL-UHFFFAOYSA-N	249.314	1.567	10	20	BDCD	
C[C@@H](NC/C=C\c1ccc(N(C)C)cc1)C(=O)O	854240299	RRHRJMSETLVUET-DOGVGXBMSA-N	248.326	1.829	10	20	BDCD	
COc1ccc(CNC(=O)OCCF)c(O)c1	859143874	IDYJRHZRNBLYLA-UHFFFAOYSA-N	243.234	1.597	10	20	BDCD	
CS/C=C\C(=O)NCc1ccccc1O	769364597	JBOHFSNLFYQVQM-SREVYHEPSA-N	223.297	1.885	10	20	BDCD	
CCCN(CCO)C(=O)c1cc(O)cs1	760137813	IUDSADZBDJZKSU-UHFFFAOYSA-N	229.301	1.298	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@]1(C)CCC(=O)N1	877578059	SFVXDHVIUVICQL-CQSZACIVSA-N	248.326	1.459	10	20	BDCD	
[N-]=[N+]=NCCN(C1CCOCC1)C1CC1	409434540	PRRYYQACFLTBJS-UHFFFAOYSA-N	210.281	1.940	10	20	BDCD	
COCCCN(CCO)Cc1ccc(N)cc1	1336287001	VRPMDGJQSSUQBS-UHFFFAOYSA-N	238.331	1.100	10	20	BDCD	
CON(C(=O)c1ccc(C)c(O)c1O)C(C)C	1347699205	QTTGLMIRWJTECW-UHFFFAOYSA-N	239.271	1.818	10	20	BDCD	
O=C(O)[C@H]1CC[C@@H](NCc2ccccc2O)C1	1601795563	CNSNRDZZSMMXHG-GXSJLCMTSA-N	235.283	1.735	10	20	BDCD	
CN(CC1(CN)CCC1)c1ccc2c(c1)OCO2	258976823	UGLQORYYAGQTPE-UHFFFAOYSA-N	248.326	1.981	10	20	BDCD	
Cc1ccc(CN[C@@H]2CCCN(C)C2=O)c(O)c1	877080474	QZXBBVFCKKVZDF-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
O=C(CCC1CC1)NCCc1ccc(O)c(O)c1	122407769	QDQNFQPDVKBOJS-UHFFFAOYSA-N	249.310	1.947	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1CCCN1C	211616642	ZBWWOXIZBDPEGS-CYBMUJFWSA-N	234.343	1.918	10	20	BDCD	
CC[C@@H](C(=O)OC)N(C)Cc1ccccc1O	173359171	VXFLIOGTTNYIAI-NSHDSACASA-N	237.299	1.776	10	20	BDCD	
CN1C[C@@H](NCc2ccc(N(C)C)cc2)CC1=O	263780930	VNBYKWOCJSYWBI-LBPRGKRZSA-N	247.342	1.073	10	20	BDCD	
CC[C@H]1CN(Cc2cc(F)ccc2O)C[C@@H]1O	272355110	DQWGERXUKJTDKS-ZANVPECISA-N	239.290	1.734	10	20	BDCD	
CN(C)c1ccc(CNc2nnco2)cc1F	276478759	RRAJGRCYZVYYDR-UHFFFAOYSA-N	236.250	1.887	10	20	BDCD	
CC(=O)C(=O)CSc1nccn1C1CC1	808020495	HEOJNRRXCUDDHY-UHFFFAOYSA-N	224.285	1.468	10	20	BDCD	
CC[C@H](O)CNCc1cc([N+](=O)[O-])ccc1O	813790494	UFVSPXGBFBURLK-JTQLQIEISA-N	240.259	1.161	10	20	BDCD	
NC1CC(NCc2cccc(F)c2O)C1	906510760	VQMUPZAJESZTTH-UHFFFAOYSA-N	210.252	1.111	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2CCOCC2)c1	862761211	JMSAMZKLJQNWIE-UHFFFAOYSA-N	249.310	1.743	10	20	BDCD	
CCN1CCN(Cc2ccc(C)cc2O)CC1=O	877338312	CCBUWAAIYKAMSP-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
OC[C@H]1C[C@@H](N[C@@H]2CCc3cccc(O)c32)C1	707622204	XBPKFBOQYPTHQL-ADEWGFFLSA-N	233.311	1.740	10	20	BDCD	
Nc1ccc(CNCCCNC2CC2)cc1	1337839015	ZWTNZTXGIWJOCL-UHFFFAOYSA-N	219.332	1.501	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)N2CCC(=O)CC2)o1	1537963005	OFCZILYRMXKYTQ-UHFFFAOYSA-N	248.242	1.895	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C(=O)NCC[C@@H]2C)c1	193692260	UIIMQPUZGSFFKD-GXFFZTMASA-N	248.326	1.315	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H]3CNC[C@@H]3C2)c1	90320617	RFQOEOYBWYALQB-TXEJJXNPSA-N	248.326	1.052	10	20	BDCD	
COCCSc1ncc(C(=O)OC)s1	295158890	GLFOJLMUWGTQAB-UHFFFAOYSA-N	233.314	1.668	10	20	BDCD	
Cc1cccc(CN2CC3(CCOC3)C2)c1O	293883168	DFENHQXUOFTPFV-UHFFFAOYSA-N	233.311	1.923	10	20	BDCD	
Cc1cc(Cl)cc([C@H](C)NCCN)c1O	817937613	YKDMECOPRATMEY-QMMMGPOBSA-N	228.723	1.963	10	20	BDCD	
Cc1ccc(C(=O)N2CC[C@@H](F)C2)c(O)c1O	836821931	VPBZPUAQZRHZKA-MRVPVSSYSA-N	239.246	1.590	10	20	BDCD	
NC[C@H]1CCN(Cc2cccc(F)c2O)C1	843048363	MCUKPSGZWIGNTN-SECBINFHSA-N	224.279	1.312	10	20	BDCD	
CCCC(=O)NCc1ccc(O)cc1O	910958403	SCZHWVIZVDTVNU-UHFFFAOYSA-N	209.245	1.514	10	20	BDCD	
Oc1c(F)cccc1CNC[C@@H]1C[C@H](F)CN1	841078577	JEBGNQLJTYYGRG-UWVGGRQHSA-N	242.269	1.321	10	20	BDCD	
CC[C@H](C(=O)O)N(C)Cc1cc(C)ccc1O	86803406	BZTRXLJIPBINRM-LLVKDONJSA-N	237.299	1.996	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCC[C@@H]2CN)cc1	89147860	QUVALSMNYAEKQX-UKRRQHHQSA-N	247.386	1.970	10	20	BDCD	
CC(=O)N1CCC(NCc2ccc(N)cc2)CC1	217889041	LPSWHXWREOLNIX-UHFFFAOYSA-N	247.342	1.369	10	20	BDCD	
C[C@@H](N)C(=O)NCCCSc1nccs1	160059135	HFDRHWIGEKJJRT-SSDOTTSWSA-N	245.373	1.089	10	20	BDCD	
COc1ccc(CNC(=O)[C@H]2C[C@H]2F)c(O)c1	1521550145	QXTCLVXABVDDNM-VHSXEESVSA-N	239.246	1.375	10	20	BDCD	
CC[C@H](O)CNCc1c(O)cccc1Cl	229967812	SSZWIXLXZWTGJI-QMMMGPOBSA-N	229.707	1.906	10	20	BDCD	
CN(C[C@H]1CCCNC1)c1ccc(N)cc1	1118896833	HAZPKJQXDSKDNZ-NSHDSACASA-N	219.332	1.705	10	20	BDCD	
OCC1(CNCc2cc(F)cc(F)c2O)CC1	708440535	CGOQWDMKXGXVFC-UHFFFAOYSA-N	243.253	1.533	10	20	BDCD	
Cc1cccc(CNC2([C@H](C)O)CC2)c1O	827585746	PIWFACRTXZLLHW-JTQLQIEISA-N	221.300	1.704	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](CO)C2)c1O	132498774	IHBUAVIEQVTPEP-LLVKDONJSA-N	221.300	1.515	10	20	BDCD	
O=S(=O)(CCCCF)Nc1ccc(O)cc1	294079635	AALJOOCAKNZJPF-UHFFFAOYSA-N	247.291	1.884	10	20	BDCD	
OC/C=C/CNCc1cc(Cl)ccc1O	717533687	NCCHUPFQBWXBDT-OWOJBTEDSA-N	227.691	1.684	10	20	BDCD	
C[C@@H](NCCCON)c1cc(Cl)ccc1O	902426397	SGAMIJFZOXBWOB-MRVPVSSYSA-N	244.722	1.977	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H](N)CC(F)F	903884920	HYQOUIGODYEGSR-JTQLQIEISA-N	244.285	1.807	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC[C@H]2C[C@@H]2C1	856060742	BJCJCBKPTNPUJY-JGVFFNPUSA-N	223.297	1.936	10	20	BDCD	
C/C=C/C(=O)NCc1cc(OC)ccc1O	769530478	CLGSEDSNCKNYSQ-ONEGZZNKSA-N	221.256	1.593	10	20	BDCD	
CCO[C@@H](C)C(=O)N(C)c1ccc(N)cc1	877080480	JMIKUJHRKSLELF-VIFPVBQESA-N	222.288	1.657	10	20	BDCD	
C[C@H](O)CN[C@@H](C)c1c(O)cccc1F	886487785	VDUUPKHKFHSWFY-YUMQZZPRSA-N	213.252	1.563	10	20	BDCD	
COc1ccc(O)c(CN2CCN[C@H](C)C2)c1	88058610	BGMDXLOXSRZUPK-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
C[C@H](O)C[C@H](C)NCc1cc(F)cc(F)c1O	708483619	DZBYWRCILWDAHC-YUMQZZPRSA-N	245.269	1.919	10	20	BDCD	
CN(Cc1cnsn1)Cc1ccccc1O	846823810	ADKCTAWEYZUFIQ-UHFFFAOYSA-N	235.312	1.876	10	20	BDCD	
Oc1ccc(CCNc2cnccn2)cc1O	811810798	CSKMVQZFKOPCPN-UHFFFAOYSA-N	231.255	1.542	10	20	BDCD	
CC(C)OCC(=O)N(C)c1ccc(N)cc1	37275027	WZLHYXJEMSGUSL-UHFFFAOYSA-N	222.288	1.657	10	20	BDCD	
C[C@H]1C[C@H](CN)CN1Cc1ccccc1O	126769969	DGUZVOCCOSGBTH-WDEREUQCSA-N	220.316	1.561	10	20	BDCD	
C/C=C(\C)C(=O)NCc1ccccc1O	269151012	PZFAXPIEJMWJKM-YCRREMRBSA-N	205.257	1.975	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccsc1	808490636	GCIKEODDHLAJRV-UHFFFAOYSA-N	212.226	1.063	10	20	BDCD	
COc1ccc(N2CCC(NC(C)=O)CC2)cc1	726562422	MLZOAVGGBCNBKO-UHFFFAOYSA-N	248.326	1.800	10	20	BDCD	
O=C(NOCC1CCC1)c1cc(O)cs1	856352117	VTHIZRXQCAMMCO-UHFFFAOYSA-N	227.285	1.915	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC2(CCOC2)C1	854672000	YUUNTVMHCHSNHM-UHFFFAOYSA-N	239.296	1.316	10	20	BDCD	
CCCN(CCO)Cc1c(C)cccc1O	876537898	HDMKHAUHEARBRS-UHFFFAOYSA-N	223.316	1.905	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H](N)C2)c1	70955772	UVPIYEPCWUUVER-LBPRGKRZSA-N	220.316	1.624	10	20	BDCD	
CC(=O)CN1CCOc2cc(N(C)C)ccc21	878319518	UZACKYIPYYZDMB-UHFFFAOYSA-N	234.299	1.540	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C(=O)O)c1O	165157605	VDOSDVIIBBZVTJ-QMMMGPOBSA-N	209.245	1.263	10	20	BDCD	
CN(C)c1ccc(CN[C@@H](C(=O)O)C2CC2)cc1	86757901	GDROOQFXWFDUBS-CYBMUJFWSA-N	248.326	1.705	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1CCCC1	158896532	DOASLAQSIJAEFF-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CCN1CCN(Cc2ccccc2O)C[C@H]1C	250322180	NHNRZMHLKUOKDS-GFCCVEGCSA-N	234.343	1.918	10	20	BDCD	
[N-]=[N+]=NCC(=O)N(C1CC1)[C@@H]1CCSC1	409426933	DFKIBHFSQOYDII-MRVPVSSYSA-N	226.305	1.793	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H](C)CO)c(O)c1	35602322	VXJYERNHSDQEKW-ZJUUUORDSA-N	209.289	1.732	10	20	BDCD	
Cc1cccc(CN2CC[C@H](C(N)=O)C2)c1O	183449106	RFOKZHIYMFVEDY-NSHDSACASA-N	234.299	1.008	10	20	BDCD	
C[C@@H](NCC(=O)N(C)C)c1ccccc1O	37225423	COTDUYIQPCTJMP-SECBINFHSA-N	222.288	1.131	10	20	BDCD	
CCCN(Cc1ccccc1O)[C@@H](C)C(N)=O	174372646	SDGUSFQNGNJLMU-JTQLQIEISA-N	236.315	1.478	10	20	BDCD	
O[C@@H](CNCc1ccc2c(c1)CCO2)C1CC1	71302549	ILCXRTBATZWVJX-ZDUSSCGKSA-N	233.311	1.482	10	20	BDCD	
NC(=O)[C@H]1CCCCN1Cc1ccc(N)cc1	42403954	OLYIRYQYUDCCLM-GFCCVEGCSA-N	233.315	1.109	10	20	BDCD	
Cc1cc(O)c(CNC[C@@H](O)C2CC2)cc1C	266219716	RAFWXPXSAIFYQC-CQSZACIVSA-N	235.327	1.870	10	20	BDCD	
C[C@@H](O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O	273427505	UPVQRPWTOYJBDI-HTQZYQBOSA-N	240.259	1.332	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3CCCN[C@@H]3C2)c1O	271767142	FPQSFISNFALATI-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
C[C@]1(NCc2cc(F)ccc2O)CCOC1=O	290824643	HBPLAAMGTFQKAT-LBPRGKRZSA-N	239.246	1.327	10	20	BDCD	
C[C@H](NC[C@H](N)C1CC1)c1ccc(F)cc1O	817965933	XCTLLZKVBKZMII-UFBFGSQYSA-N	238.306	1.919	10	20	BDCD	
N[C@@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1	843044496	DZBJHNDGBSPLKC-SSDOTTSWSA-N	244.697	1.718	10	20	BDCD	
NCC[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	1341123531	PNDATPNLDCCVMU-GFCCVEGCSA-N	247.342	1.009	10	20	BDCD	
CC[C@]1(O)CCN(Cc2cc(F)ccc2O)C1	779217793	BPIQVUNCEZLQAY-ZDUSSCGKSA-N	239.290	1.878	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)C1CCC1	98074480	SEGAPICIXKWDRP-UHFFFAOYSA-N	235.283	1.557	10	20	BDCD	
C[C@@H]1CCN[C@H](C(=O)NCc2ccc(N)cc2)C1	1524009765	VPHOAAYPBXYNAP-MFKMUULPSA-N	247.342	1.273	10	20	BDCD	
C[C@H](NCC1(O)CCC1)c1ccccc1O	162199686	NALCOSLGZHQEIT-JTQLQIEISA-N	221.300	1.958	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1CCCO1	876890088	WVACMIWOMZWSEF-LLVKDONJSA-N	221.300	1.969	10	20	BDCD	
Cc1ccc(CN[C@H](C)c2nncn2C)c(O)c1	877016434	GHWJWPJHWPQQDF-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
CC[C@H](NCc1nncn1C)c1ccccc1O	38007445	DKYJEFZHQYETTA-NSHDSACASA-N	246.314	1.762	10	20	BDCD	
Cn1cc(CN[C@@H]2CCc3cccc(O)c32)nn1	389815584	OSISAHSVDJQPMQ-LLVKDONJSA-N	244.298	1.298	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@H](O)C2)cc1C	128157023	KFFUYWYGXXVWIX-LBPRGKRZSA-N	221.300	1.576	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@@H]2CCNC2)c1	70955794	AGFUNFGXPZCGEQ-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
CC(C)=CC(=O)NCc1ccccc1O	131526670	BKJLWIOJMKRDNS-UHFFFAOYSA-N	205.257	1.975	10	20	BDCD	
CO[C@@H](C)CN(C)C(=O)c1cccc(O)c1O	286395370	MWAFFLWCIRCXTL-QMMMGPOBSA-N	239.271	1.205	10	20	BDCD	
C[C@@H](N[C@@H]1CCOC1)c1cc(F)ccc1O	87784330	ZROBVWDEYMQABN-PSASIEDQSA-N	225.263	1.971	10	20	BDCD	
CNCCCNCc1cccc(F)c1O	83347007	HVHOETYGNPKCKW-UHFFFAOYSA-N	212.268	1.230	10	20	BDCD	
CN(CCC(=O)O)Cc1cccc(Cl)c1O	820586263	RLWNTRVOTRXRMZ-UHFFFAOYSA-N	243.690	1.952	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C)CN	829764642	RFRCJRICWPVFAA-NSHDSACASA-N	249.358	1.272	10	20	BDCD	
Cc1ccc(C(=O)N2CC[C@H](F)C2)c(O)c1O	836821142	VPBZPUAQZRHZKA-QMMMGPOBSA-N	239.246	1.590	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](C)C(=O)O)c1	848638413	SHJXELDRBJBTHJ-VIFPVBQESA-N	223.272	1.511	10	20	BDCD	
CC[C@@](C)(O)C(=O)N(C)Cc1ccccc1O	934705299	UZLYQYSOULFDFK-CYBMUJFWSA-N	237.299	1.512	10	20	BDCD	
CON(C)CCNCc1cc(F)cc(F)c1O	883171064	NCBSBNTUIVYZKH-UHFFFAOYSA-N	246.257	1.253	10	20	BDCD	
C[C@H]1CC[C@@H](CNCc2ccc(N)cc2)O1	398106443	KNRPMKOZYSJMND-GWCFXTLKSA-N	220.316	1.926	10	20	BDCD	
Cc1cccc(CNC[C@H](C)CO)c1O	162829905	HEWPCXKWFZRPJG-VIFPVBQESA-N	209.289	1.419	10	20	BDCD	
CCN(C)Cc1cc(OC)c(OC)cc1O	160245636	HKHIOTQIMHLIIO-UHFFFAOYSA-N	225.288	1.861	10	20	BDCD	
Oc1cc2c(cc1CN[C@H]1C=CCC1)OCO2	698326598	KKVHZVWXYVFLGV-JTQLQIEISA-N	233.267	1.929	10	20	BDCD	
CO[C@@H]1COC[C@H]1NCc1cccc(C)c1O	843428155	PKIGNLWPLWGNRP-VXGBXAGGSA-N	237.299	1.204	10	20	BDCD	
CO[C@@H]1CCN(Cc2ccc(C)cc2O)C1	876751326	VYASDDOZUUDIRU-GFCCVEGCSA-N	221.300	1.921	10	20	BDCD	
CCNC(=O)NCc1ccc(N(C)C)c(F)c1	58482948	KRHUSSUJTYWVKA-UHFFFAOYSA-N	239.294	1.711	10	20	BDCD	
CC(C)=CC(=O)NCc1cccc(O)c1O	1347234979	SKFHQITYBPKILN-UHFFFAOYSA-N	221.256	1.680	10	20	BDCD	
C[C@H](C1CC1)N(C)C(=O)c1cccc(O)c1O	126262956	WDBIDGKUEXMHPX-MRVPVSSYSA-N	235.283	1.968	10	20	BDCD	
CCCNC(=O)CN[C@@H](C)c1ccccc1O	36780985	NGGBGOYUONPNOH-JTQLQIEISA-N	236.315	1.569	10	20	BDCD	
C[C@@]1(C(=O)O)CCN(Cc2ccccc2O)C1	86779474	VLLYLIIKPBRYSC-CYBMUJFWSA-N	235.283	1.689	10	20	BDCD	
NC[C@@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1	238062936	ILWQDIZEBVXFOC-LBPRGKRZSA-N	247.342	1.009	10	20	BDCD	
CC(C)(C)c1cnc(SC[C@@H](O)CO)s1	268369850	YNCVUFXXBWGHIF-ZETCQYMHSA-N	247.385	1.886	10	20	BDCD	
CC(=O)C(=O)COc1ccc(-c2nnco2)cc1	808015841	QKGCUDRSELHLJG-UHFFFAOYSA-N	246.222	1.274	10	20	BDCD	
CC[C@@H](N)CN[C@@H](C)c1cc(OC)ccc1O	817980865	XQJKKTRMAGGVFJ-VHSXEESVSA-N	238.331	1.789	10	20	BDCD	
CC1=NO[C@@H](C(=O)NCc2cc(C)ccc2O)C1	862754984	MOOBWGPQBNEYLV-GFCCVEGCSA-N	248.282	1.482	10	20	BDCD	
CC[C@H](OC(=O)c1cc(O)cs1)C(C)=O	873359070	GWMXZAJYFNROCN-QMMMGPOBSA-N	228.269	1.978	10	20	BDCD	
COc1cc(C)cc(CN(C)C[C@@H](C)O)c1O	894450734	NYUTUUAREXJFQH-SNVBAGLBSA-N	239.315	1.522	10	20	BDCD	
CCNC(=O)NCc1ccc(OC)cc1O	792790534	SFCWDZYMAJXJFD-UHFFFAOYSA-N	224.260	1.220	10	20	BDCD	
OC[C@@H]1CCCN1Cc1cc(F)cc(F)c1O	1331532274	UICNSRJYJCSGPB-JTQLQIEISA-N	243.253	1.627	10	20	BDCD	
C[C@@H](NCc1cccc(Cl)c1O)C(N)=O	152637858	RVDBOBPCRMOLGI-ZCFIWIBFSA-N	228.679	1.009	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](O)C2)c1	128091939	MZBRNXNWXONPHB-LLVKDONJSA-N	207.273	1.267	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)CN(C)C	115725895	DZZIDCXEUWLAEW-UHFFFAOYSA-N	249.358	1.239	10	20	BDCD	
CCCC(=O)NCc1cc(OC)ccc1O	114541750	MWWLVVIRDODYEO-UHFFFAOYSA-N	223.272	1.817	10	20	BDCD	
Cc1ccc(C(=O)NC2CC2)c(O)c1O	177661113	HKPMCLSTKVOLCZ-UHFFFAOYSA-N	207.229	1.298	10	20	BDCD	
CCCCCN(CC(N)=O)Cc1ccc(N)cc1	35081204	RTOBADMYERSANN-UHFFFAOYSA-N	249.358	1.746	10	20	BDCD	
OCC1(NCc2cc(F)ccc2O)CCC1	180907014	AIMWKMSDEYFPKX-UHFFFAOYSA-N	225.263	1.536	10	20	BDCD	
CCNC(=O)NCCc1ccc(N)cc1	40675749	FQLZXXDTSHQSMJ-UHFFFAOYSA-N	207.277	1.130	10	20	BDCD	
C[C@@H](CCN)NCc1ccc2c(c1)CCO2	220517876	RZWYPOSMZMENSZ-JTQLQIEISA-N	220.316	1.448	10	20	BDCD	
COC(=O)C1(C)CN(Cc2ccccc2O)C1	822534603	PFOURJLIKCWRNJ-UHFFFAOYSA-N	235.283	1.387	10	20	BDCD	
CC[C@@H](O)CN[C@H](C)c1cc(OC)ccc1O	163989078	SGYYXRHVLZMHHR-NXEZZACHSA-N	239.315	1.822	10	20	BDCD	
Cc1cc(CN2CC[C@H]2CO)ccc1N(C)C	934019358	PLOSJVAVOXURCI-ZDUSSCGKSA-N	234.343	1.628	10	20	BDCD	
Cc1cc(CN2CCNCC2)ccc1N(C)C	82653136	YVSQPTXDAVGSME-UHFFFAOYSA-N	233.359	1.466	10	20	BDCD	
Nc1ccc(CNC(=O)NCC(F)F)cc1	1335736548	DGHYAMIPOCXXNG-UHFFFAOYSA-N	229.230	1.333	10	20	BDCD	
Cn1nccc1/C=C1\SC(S)=NC1=O	2573458	GDURVGHADRDIJL-XQRVVYSFSA-N	225.298	1.320	10	20	BDCD	
Cc1ccc(CNC[C@@H](O)C2CC2)c(O)c1	877526130	PWPFLBAMHKOIHU-CYBMUJFWSA-N	221.300	1.561	10	20	BDCD	
Nc1ccc(NC(=O)C[C@@H]2CCOC2)cc1	401250591	AAYBFJXGEAQXQK-VIFPVBQESA-N	220.272	1.634	10	20	BDCD	
Cn1cncc1CN[C@H]1CCc2cccc(O)c21	388384447	YXMFTGXCELOSCI-LBPRGKRZSA-N	243.310	1.903	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@H]1C[C@H](O)C1	850417959	SQSKGLOHNIBGBS-ZKCHVHJHSA-N	227.691	1.659	10	20	BDCD	
CC(C)NC(=O)CCNCc1ccccc1O	134491806	GHXRRNUVKAZAEA-UHFFFAOYSA-N	236.315	1.397	10	20	BDCD	
C[C@@H](NCC1(CO)CC1)c1cc(F)ccc1O	122329478	PUUDZRQBVGGENC-SECBINFHSA-N	239.290	1.954	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCCO1	136335220	CXDUQGSKARPVPW-LLVKDONJSA-N	221.256	1.187	10	20	BDCD	
C[C@H](N)CN[C@H](C)c1ccc(F)cc1O	817972235	KLTCAIXGKILTEB-JGVFFNPUSA-N	212.268	1.529	10	20	BDCD	
CCOc1ccc(CN[C@H]2CCNC2)c(O)c1	841045418	URSGMHLZNPNYPD-NSHDSACASA-N	236.315	1.242	10	20	BDCD	
C[C@@H]1C[C@H](CNCCc2ccc(N)cc2)CCN1	841037599	AZTURAPXUIGATL-TZMCWYRMSA-N	247.386	1.789	10	20	BDCD	
CC(C)OCCNC(=O)c1cc(O)cs1	758718241	JVIQVMCUVJKKQT-UHFFFAOYSA-N	229.301	1.609	10	20	BDCD	
C[C@H](NC[C@H]1C[C@H](O)C1)c1c(O)cccc1F	886650640	ZZHAMMLOZKIRTP-GUBZILKMSA-N	239.290	1.953	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOC[C@H]2CCC[C@H]21	409429417	RPGLHFFQMUJAAY-RKDXNWHRSA-N	224.264	1.324	10	20	BDCD	
C[C@@H](N[C@@H]1CCCNC(=O)C1)c1ccccc1O	877755974	VUSGJEOELNAOQC-GHMZBOCLSA-N	248.326	1.712	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1CCC1	1349079858	UOSBFWGUJSVYPT-UHFFFAOYSA-N	221.256	1.514	10	20	BDCD	
Oc1ccccc1CNC1CCC(O)CC1	19918603	OCJYIOTZKSPAQR-UHFFFAOYSA-N	221.300	1.785	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)C1CCNCC1	832388330	KWEUXJFNMIFSEO-UHFFFAOYSA-N	247.342	1.022	10	20	BDCD	
Nc1ccc(OCc2cn(CC3CC3)nn2)cc1	864633731	JWRJFZHWNHQVPY-UHFFFAOYSA-N	244.298	1.849	10	20	BDCD	
Cc1ccc([C@@H](C)NCc2cnnn2C)c(O)c1	287467602	WCWUVCXMSZZQQG-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
Cn1cncc1CNCc1cc(F)ccc1O	291587344	PMYMWIVSAHDLLQ-UHFFFAOYSA-N	235.262	1.555	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@H]2C(=O)O)cc1	3748008	OABUZGQTMZSWTB-ZDUSSCGKSA-N	248.326	1.802	10	20	BDCD	
Cc1ccc(C(=O)N(C)C2CC2)c(O)c1O	177676540	JHHOXEOVYQNOCD-UHFFFAOYSA-N	221.256	1.641	10	20	BDCD	
Cc1cccc(CN2C[C@@H](C)[C@H](CO)C2)c1O	191718056	QUOPUBDHHNCQKM-YPMHNXCESA-N	235.327	1.761	10	20	BDCD	
CCNC(=O)NCc1ccc(N(C)C)cc1C	734518939	KQNOAWCTJUZHNS-UHFFFAOYSA-N	235.331	1.880	10	20	BDCD	
C[C@@H](CN)N(C)Cc1c(O)ccc(Cl)c1F	843053185	YYDLQDPBHQJDMF-ZETCQYMHSA-N	246.713	1.964	10	20	BDCD	
CNC1(C(=O)Nc2ccc(N)cc2)CCC1	911661537	WLYSZQANDBADOF-UHFFFAOYSA-N	219.288	1.349	10	20	BDCD	
Cc1cc(CN2CC[C@@H](CN)C2)ccc1N(C)C	923281779	PMUYARIXZLTDFP-AWEZNQCLSA-N	247.386	1.842	10	20	BDCD	
CNC[C@H](C)N[C@H](C)c1cc(F)cc(F)c1O	854231720	KSAWDYFCXHIHRK-JGVFFNPUSA-N	244.285	1.929	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCCCO2)c1	862758030	MNXSKAXFHYFUCA-ZDUSSCGKSA-N	249.310	1.886	10	20	BDCD	
C[C@H](NS(C)(=O)=O)c1ccc(N(C)C)cc1	773085651	ZWYZDIUZFVYYJO-VIFPVBQESA-N	242.344	1.363	10	20	BDCD	
Nc1ccc(N2CC[C@@H](O)[C@H](CCF)C2)cc1	409425354	AJLIYYXIJJINKF-ZWNOBZJWSA-N	238.306	1.816	10	20	BDCD	
CNC(=O)C[C@@H](C)N[C@H](C)c1ccccc1O	322758376	FTQANWNWKHFYRF-NXEZZACHSA-N	236.315	1.567	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H](C(N)=O)C2)cc1C	54543742	DCDVVEHDAYHIFD-LLVKDONJSA-N	248.326	1.316	10	20	BDCD	
COC[C@H](C)N(C)Cc1cc(F)ccc1O	179946246	XPYAMPIHHQYYAI-VIFPVBQESA-N	227.279	1.998	10	20	BDCD	
Cc1cc(O)c(CN2CCN(C)C(=O)C2)cc1C	127344225	DUXNVGHTXGXUGX-UHFFFAOYSA-N	248.326	1.283	10	20	BDCD	
CC1(CO)CCN(Cc2ccccc2O)CC1	184072393	FKRHECHIZGFOOK-UHFFFAOYSA-N	235.327	1.987	10	20	BDCD	
C[C@@H](NC1CC1)C(=O)NCc1ccccc1O	295220487	QYYNVFBZKYXLHY-SECBINFHSA-N	234.299	1.149	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1CCCC1	276665464	NARJBCCFRJHUAK-UHFFFAOYSA-N	225.219	1.473	10	20	BDCD	
COC(=O)[C@@H](C)N(C)Cc1cc(F)ccc1O	280820343	JXZBUTCCOPJODI-MRVPVSSYSA-N	241.262	1.525	10	20	BDCD	
CC(=O)C(=O)CSc1ncc(C(C)C)n1C	289668765	OZLQQLJHLLWPHY-UHFFFAOYSA-N	240.328	1.794	10	20	BDCD	
CC(=O)C(=O)CSc1ncnc2ccccc12	808012088	JLCTTZSCKFLYCK-UHFFFAOYSA-N	246.291	1.880	10	20	BDCD	
CC(=O)C(=O)COC(=O)Cc1ccc(C)c(C)c1	808489790	DRBAVJAEIFZZLM-UHFFFAOYSA-N	248.278	1.547	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cccc(F)c1	808488720	ZSDGUKPWVSATRV-UHFFFAOYSA-N	224.187	1.141	10	20	BDCD	
C[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(F)cc1O	817977640	MFCQYIGPYXNUKX-XDRUHAPNSA-N	236.290	1.400	10	20	BDCD	
CCOc1ccc(CN[C@H](C)C(=O)O)c(O)c1	739508708	XLXRFXRGQGBRSU-MRVPVSSYSA-N	239.271	1.354	10	20	BDCD	
CN(C)c1ccc(CN2CC(C(C)(C)O)C2)cc1	839139521	HPJKJFSLILGZAJ-UHFFFAOYSA-N	248.370	1.955	10	20	BDCD	
C[C@H]1[C@H](CO)CCCN1Cc1ccccc1O	840979159	RXQNGRDCNFIACW-AAEUAGOBSA-N	235.327	1.985	10	20	BDCD	
Cc1ccc(C(=O)N2CC[C@@H]3C[C@H]3C2)c(O)c1O	856060696	ATORDSXQUUSHIJ-ZJUUUORDSA-N	247.294	1.888	10	20	BDCD	
COC(=O)[C@H](F)CSc1nccs1	133252917	BHTYDHOGIBYRBO-RXMQYKEDSA-N	221.278	1.746	10	20	BDCD	
COC[C@@H]1CC(F)(F)CN1CCN=[N+]=[N-]	409435077	SFPLYMUCAXRHCJ-ZETCQYMHSA-N	220.223	1.653	10	20	BDCD	
N[C@H](CC(=O)O)c1cccc(Cl)c1O	82969550	PEXMJKSFCLVJKA-SSDOTTSWSA-N	215.636	1.520	10	20	BDCD	
O=C(NCCN1CC=CC1)c1cc(O)cs1	1328128130	ATAOJVVQOHEALK-UHFFFAOYSA-N	238.312	1.055	10	20	BDCD	
CN(Cc1ccccc1O)c1nnnn1C1CC1	1332956276	DAXLHWQFJJEYOT-UHFFFAOYSA-N	245.286	1.350	10	20	BDCD	
C/C(=C\C(=O)O)CN(C)c1ccc2c(c1)OCO2	1602954089	ANDPYVQCUQPBLV-WEVVVXLNSA-N	249.266	1.882	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1CCOC1	876929292	HIXRPUXJAAYDNI-LLVKDONJSA-N	221.300	1.827	10	20	BDCD	
C[C@H](CCO)CN[C@H]1CCc2cccc(O)c21	297529345	DLRNSVXYGKQESH-PWSUYJOCSA-N	235.327	1.988	10	20	BDCD	
Cc1cccc(O)c1CNCCCCO	877482502	BFEFVHZWVYQCQI-UHFFFAOYSA-N	209.289	1.563	10	20	BDCD	
CCN(C)C(=O)c1ccc(C)c(O)c1O	179420021	BHCAUGYBNVYMQK-UHFFFAOYSA-N	209.245	1.498	10	20	BDCD	
CNC[C@H](C)CNCc1ccc2c(c1)CCCO2	1262487707	BQABGGLVVDOIPS-LBPRGKRZSA-N	248.370	1.957	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)CCN1	226561638	XSMIRUOLBNEZCM-SECBINFHSA-N	224.279	1.325	10	20	BDCD	
COc1cccc(O)c1CNCCCCO	381557359	PNHOCISHCHMGKO-UHFFFAOYSA-N	225.288	1.263	10	20	BDCD	
CC[C@@H]1C(=O)NCCN1Cc1cc(C)ccc1O	93050554	HFFCISUIIAOTNF-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
Cc1cccc(CN2CCNC(=O)C[C@H]2C)c1O	368132322	FSHZBPKCQXQLPP-LLVKDONJSA-N	248.326	1.411	10	20	BDCD	
Cc1cccc(CN2CC[C@@H]([C@H](C)O)C2)c1O	272568232	VHBPEGLBXDRAEN-NWDGAFQWSA-N	235.327	1.903	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1cccc(F)c1O	819896067	RSKPGGBEDKJAIY-SSDOTTSWSA-N	227.235	1.436	10	20	BDCD	
OC/C=C/CNCc1c(O)ccc(Cl)c1F	850357906	XYXHBWSPRLFMTA-OWOJBTEDSA-N	245.681	1.823	10	20	BDCD	
COC/C=C/C(=O)NCc1ccccc1O	774061626	BRQZNLODXNJEBF-QPJJXVBHSA-N	221.256	1.211	10	20	BDCD	
C[C@H](NCc1cc(F)ccc1O)C(C)(C)O	390509507	YVYJLOWHFOYZRY-QMMMGPOBSA-N	227.279	1.780	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)CC(C)(C)N	692013384	FRCNWPNCHMWUAQ-UHFFFAOYSA-N	235.375	1.922	10	20	BDCD	
CN(CCO)Cc1ccc(N2CCCC2)cc1	1235691528	MLXGTTQYFWBCDL-UHFFFAOYSA-N	234.343	1.711	10	20	BDCD	
CN(C(=O)[C@@H]1CCCC[C@@H]1N)c1ccc(N)cc1	1262009182	NFLZUODABKBUGR-OLZOCXBDSA-N	247.342	1.749	10	20	BDCD	
CN(CCC(=O)O)Cc1cc(F)ccc1O	234291238	UZYAUIBWWISXEN-UHFFFAOYSA-N	227.235	1.438	10	20	BDCD	
CNC(=O)C[C@@H](C)NCc1ccc2c(c1)CCO2	322833328	ZYQFLTSOYSFXMI-SNVBAGLBSA-N	248.326	1.236	10	20	BDCD	
COc1ccc(O)c(CNCc2cnn(C)c2)c1	41158949	RZTUCQHYYPDEOU-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
CCC(=O)NCc1cccc(OC)c1O	68488703	PDJIOZFQJXBEER-UHFFFAOYSA-N	209.245	1.427	10	20	BDCD	
CNC(=O)C1CCN(Cc2ccc(N)cc2)CC1	36127514	LSMHWRKUIBGYBU-UHFFFAOYSA-N	247.342	1.227	10	20	BDCD	
C[C@@H](O)CCN[C@H](C)c1ccccc1O	82992614	QNIYSYGPAIQBHS-NXEZZACHSA-N	209.289	1.814	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)C(C)(C)N	237056363	UUTKIAZMUMEWCL-UHFFFAOYSA-N	249.358	1.415	10	20	BDCD	
CCOc1cccc(CN2CC[C@@H](O)C2)c1O	271052319	WTPPUTDCTZVLHR-LLVKDONJSA-N	237.299	1.358	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC[C@H](C)CN)c1	817963208	SJBPULAKGSWPIS-GHMZBOCLSA-N	222.332	1.946	10	20	BDCD	
CC1(C)CN(C(=O)c2cc(O)cs2)CCN1	829584086	ZXOKPDLYJAPATG-UHFFFAOYSA-N	240.328	1.278	10	20	BDCD	
Cc1ccc(CN2CCS(=O)CC2)c(O)c1	876693750	IVQOGIQLALYCLZ-UHFFFAOYSA-N	239.340	1.265	10	20	BDCD	
COC(=O)[C@@H](C)NCc1c(C)cccc1O	877492405	JUGWXXDXRPFSCF-SECBINFHSA-N	223.272	1.352	10	20	BDCD	
C[C@H]1CNC[C@@H](C)N1Cc1cc(F)ccc1O	843063400	AVBMVXBJKDHEBZ-AOOOYVTPSA-N	238.306	1.714	10	20	BDCD	
COC/C=C\C(=O)NCc1cc(C)ccc1O	862755120	DOYYCZCAXHSSDZ-ARJAWSKDSA-N	235.283	1.519	10	20	BDCD	
Cc1cccc(O)c1CN1CCCN(C=O)CC1	877642413	KQKFYVAVLYZADD-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC(C(F)F)CC1	409423550	ACANAUQRVGBYPJ-UHFFFAOYSA-N	218.207	1.800	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@@H]2CCC[C@@H]2O)cc1	89151023	XFTZOHMUFBZEKM-AAEUAGOBSA-N	248.326	1.089	10	20	BDCD	
CC[C@@H](NCc1cc(F)cc(F)c1O)[C@H](C)O	708535841	QVFBBKVLGHYADE-WRWORJQWSA-N	245.269	1.919	10	20	BDCD	
Cc1ccc(CN2CC[C@](C)(C(=O)O)C2)c(O)c1	1605273265	STUFFWKZVKMMSM-AWEZNQCLSA-N	249.310	1.997	10	20	BDCD	
O=C(O)[C@@H](CF)NCc1ccc(Cl)cc1O	1608532605	FMPTVBGCQYPODX-MRVPVSSYSA-N	247.653	1.558	10	20	BDCD	
CN(C/C=C\C(=O)O)c1ccc2c(c1)OCO2	1777053783	ACKJKGYZMUYVAL-IHWYPQMZSA-N	235.239	1.492	10	20	BDCD	
O=C(O)CCCC(=O)NCc1ccccc1O	169816963	IADKLWGIEMHIPM-UHFFFAOYSA-N	237.255	1.263	10	20	BDCD	
NC(=O)C[C@H]1CCN(Cc2ccccc2O)C1	368132271	FHXWATJLWSGQID-SNVBAGLBSA-N	234.299	1.090	10	20	BDCD	
COc1ccc(O)c(CNC(=O)NC(C)C)c1	114581204	ZXMWGNAGFYVLQZ-UHFFFAOYSA-N	238.287	1.608	10	20	BDCD	
CC[C@H](CCO)NCc1cccc(OC)c1O	77453147	DNDUQCFURPDWOQ-LLVKDONJSA-N	239.315	1.651	10	20	BDCD	
CCCC(=O)NCc1ccc(O)c(O)c1	39096900	LSLQXNHEIAOWOW-UHFFFAOYSA-N	209.245	1.514	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](C)N(C)C)c1	70955268	LGBBPDOMHHELPT-LLVKDONJSA-N	222.332	1.740	10	20	BDCD	
O[C@H]1C[C@@H](NCc2ccc3c(c2)CCO3)C1	294881936	QDZOIYIRDNUZTM-TXEJJXNPSA-N	219.284	1.234	10	20	BDCD	
O=C(NCC1CC1)c1cccc(O)c1O	163267420	KCEMVESMYRUGIY-UHFFFAOYSA-N	207.229	1.238	10	20	BDCD	
COCC(C)(C)C(=O)NCc1ccccc1O	270020207	ABRDYJMQFXOFMP-UHFFFAOYSA-N	237.299	1.681	10	20	BDCD	
NC1CC(NCc2cc(Cl)ccc2O)C1	906509283	FLLLINRNVSXBRS-UHFFFAOYSA-N	226.707	1.625	10	20	BDCD	
CCN(CCN)Cc1cccc(C)c1O	863644065	INKKIYXGYYJNFG-UHFFFAOYSA-N	208.305	1.481	10	20	BDCD	
CN(C(=O)[C@@]1(C)CCOC1)c1ccc(N)cc1	687355050	IQVVRDMCLKOGCK-ZDUSSCGKSA-N	234.299	1.658	10	20	BDCD	
CCN(CC(=O)O)Cc1ccccc1O	83410920	BZGIIDKHNCKRBB-UHFFFAOYSA-N	209.245	1.299	10	20	BDCD	
CS[C@H](CO)[C@H](C)NCc1ccccc1O	164278890	NPWYYJMMHGATNN-JOYOIKCWSA-N	241.356	1.594	10	20	BDCD	
CS[C@@H](CO)[C@H](C)NCc1ccccc1O	164279133	NPWYYJMMHGATNN-CABZTGNLSA-N	241.356	1.594	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1CCN(C)C1	877019730	QACMBRFMRGQSAU-NSHDSACASA-N	220.316	1.494	10	20	BDCD	
O=C(CC[C@@H]1CCOC1)NCc1ccccc1O	267644390	ZJOGSYMFSSUMTQ-LLVKDONJSA-N	249.310	1.825	10	20	BDCD	
C[C@@H]1NCCC[C@H]1NC(=O)Cc1ccc(N)cc1	193545413	GZDWSNYHEZAOME-GXFFZTMASA-N	247.342	1.068	10	20	BDCD	
Cc1cccc(CN(C)CCCN)c1O	309416879	JIKJWUJRHDTBFN-UHFFFAOYSA-N	208.305	1.481	10	20	BDCD	
COc1cccc(CN[C@H](CO)C2CC2)c1O	734164118	KIMCAFZNXIZKCJ-LLVKDONJSA-N	237.299	1.261	10	20	BDCD	
CCN(CCC(=O)NC)Cc1ccc(N)cc1	51760118	DYTLIRKYRROYND-UHFFFAOYSA-N	235.331	1.227	10	20	BDCD	
CC(C)CNC(=O)CN(C)c1ccc(N)cc1	20374439	QDTHZRZVXOPPDB-UHFFFAOYSA-N	235.331	1.477	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@H]1CCOC1	127042632	UKCTUNZLCHDHGP-JQWIXIFHSA-N	221.300	1.907	10	20	BDCD	
C[C@@H]1OCCN(Cc2ccc(N)cc2)[C@H]1C	380443504	SCMGSQBNQXGIAO-QWRGUYRKSA-N	220.316	1.878	10	20	BDCD	
O=C1CN(Cc2ccccc2O)CN1CC1CC1	279347616	FSYOSRWWWNYEQP-UHFFFAOYSA-N	246.310	1.404	10	20	BDCD	
CN(C(=O)/C=C\c1cccnc1)c1ccn(C)n1	492729320	AMDPBIBTEUUUDA-WAYWQWQTSA-N	242.282	1.491	10	20	BDCD	
Cn1cccc1CNC(=S)NC(C)(C)C	743060878	BIGABKLBAGJZDR-UHFFFAOYSA-N	225.361	1.788	10	20	BDCD	
CN(C[C@@H]1CCC(=O)N1)c1ccc2c(c1)OCO2	844308563	FKBSPUBUVRCVQX-VIFPVBQESA-N	248.282	1.130	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CCO[C@@H]3C[C@H]32)c1	793620585	WZYJIWTYZQWTJF-CHWSQXEVSA-N	233.311	1.982	10	20	BDCD	
C[C@@H](NCc1ccccc1O)[C@H](O)C(F)(F)F	865711767	QIGBYQYMOODXPY-XCBNKYQSSA-N	249.232	1.794	10	20	BDCD	
O=C(NCc1ccccc1O)c1ncccc1O	701158821	YDCCEQIXTZRYQQ-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
C[C@@]1(CNC(=O)Nc2ccc(N)cc2)CCOC1	397113565	FANPINLRUUXLTC-ZDUSSCGKSA-N	249.314	1.817	10	20	BDCD	
COc1ccc(O)c(CNC(=O)[C@H]2C[C@@H]2C)c1	114543227	IPCRGUJBKKEIDR-KWQFWETISA-N	235.283	1.673	10	20	BDCD	
CN(CC(=O)NCC1CC1)Cc1ccccc1O	171926891	FHULLSHNUKKJJW-UHFFFAOYSA-N	248.326	1.350	10	20	BDCD	
C[C@]1(NCc2ccc3c(c2)CCO3)CCOC1	120226187	XYHOMXZXRWNVOJ-AWEZNQCLSA-N	233.311	1.890	10	20	BDCD	
O[C@H](CNCc1ccc2c(c1)CCO2)C1CC1	71302551	ILCXRTBATZWVJX-CYBMUJFWSA-N	233.311	1.482	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC(=O)C(F)F)c1	194775490	AZWRLIIJKCWQEF-ZCFIWIBFSA-N	245.225	1.843	10	20	BDCD	
Cc1cccc(CNC[C@](C)(O)C2CC2)c1O	383612950	SYXXJPIKQFZEQV-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
Cc1cccc(CN2CCN(C)CC2)c1O	162803862	QYXSBJZPLBZRDC-UHFFFAOYSA-N	220.316	1.448	10	20	BDCD	
O=S(=O)(CCCF)NCc1ccccc1O	269735054	SADGGFYNYPJQCR-UHFFFAOYSA-N	247.291	1.171	10	20	BDCD	
O=C(/C=C\c1cccnc1)N1CCn2nccc21	493761696	UJGOJSVAEMOSNQ-ARJAWSKDSA-N	240.266	1.338	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1C[C@@H](O)C1)c1ccccc1O	827957103	SBCNRYHRPVPLFV-BBBLOLIVSA-N	235.283	1.340	10	20	BDCD	
CN1C(=O)CCC[C@@H]1C(=O)Nc1ccc(N)cc1	911660983	QMXVOAQVCHTEPS-LLVKDONJSA-N	247.298	1.218	10	20	BDCD	
CN1CC(=O)N[C@@H]1c1cc(Cl)c(F)cc1O	840806312	ZTCCDLROUWKIJK-JTQLQIEISA-N	244.653	1.245	10	20	BDCD	
Cc1cnc(CNCc2ccccc2O)[nH]1	693496185	TXCBYPZSONUERN-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
C[C@@H]1COCCN1C(=O)NCc1ccc(N)cc1	1338793121	LXOTZNRHEVCNEE-SNVBAGLBSA-N	249.314	1.199	10	20	BDCD	
C[C@H](N[C@H](C)CO)c1cc(C(=O)O)ccc1O	1609747863	YEBWLOHBIWUVIV-SFYZADRCSA-N	239.271	1.122	10	20	BDCD	
NCCCCNCc1cccc(F)c1O	165153679	CUKZVDKRWOOXAN-UHFFFAOYSA-N	212.268	1.360	10	20	BDCD	
C[C@@H]1NCCN(C(=O)Cc2ccc(N)cc2)[C@@H]1C	262804364	PVBNRNAVUQPWHH-WDEREUQCSA-N	247.342	1.020	10	20	BDCD	
Oc1cccc2c1[C@@H](NCCc1cn[nH]c1)CC2	379591835	YLSKMXMGZKVNLR-LBPRGKRZSA-N	243.310	1.935	10	20	BDCD	
Nc1ccc(CN2CC[C@H](C(=O)O)C2)cc1	1601215537	CYEGFRZTFAVBEV-JTQLQIEISA-N	220.272	1.175	10	20	BDCD	
C[C@@H]1OCC[C@H]1NCc1ccc2c(c1)CCO2	120821079	GJLMVLIBOKYEQM-GXFFZTMASA-N	233.311	1.889	10	20	BDCD	
CCN(C)C(=O)CNCc1ccc2c(c1)CCO2	185182599	ZSMAROTZJUFWAQ-UHFFFAOYSA-N	248.326	1.189	10	20	BDCD	
C[C@H](NCC1(CC(N)=O)CC1)c1ccccc1O	817586748	RUNZFEFKRYHTQY-JTQLQIEISA-N	248.326	1.698	10	20	BDCD	
Cc1ccc(C(=O)OCc2ccno2)c(O)c1O	727004994	BTPIFCGKOVJDGR-UHFFFAOYSA-N	249.222	1.751	10	20	BDCD	
COCCOC[C@H](C)NCc1ccccc1O	742377606	WFPZJBKAZDSPMJ-NSHDSACASA-N	239.315	1.533	10	20	BDCD	
Cc1cccc(O)c1CNc1cnn(CCO)c1	877122235	MEMUNKLDUUNYPU-UHFFFAOYSA-N	247.298	1.502	10	20	BDCD	
C[C@H]1C(=O)CCCN1C(=O)c1cc(O)cs1	885053084	DAMQWUYIKRVIHM-ZETCQYMHSA-N	239.296	1.647	10	20	BDCD	
C[C@@H]1C[C@H](O)CN1Cc1ccccc1O	788268582	GKHCDJNANZDBNI-KOLCDFICSA-N	207.273	1.347	10	20	BDCD	
C[C@H](NCc1cc(F)ccc1O)C(=O)N(C)C	191805499	KZXHCEFHDUMGKR-QMMMGPOBSA-N	240.278	1.098	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CC[C@H](CN)C2)cc1	724060887	XVHKWDSERYZAKT-UONOGXRCSA-N	247.386	1.970	10	20	BDCD	
Cc1cccc(CNCCC(C)(C)N)c1O	903938509	FGBKTXHQTLHNBV-UHFFFAOYSA-N	222.332	1.918	10	20	BDCD	
OCCCSCCNCc1ccccc1O	163921964	QVSZLLUKRDUZPT-UHFFFAOYSA-N	241.356	1.597	10	20	BDCD	
O=C(c1cccc(O)c1O)N1O[C@H]2C=C[C@H]1CC2	831519975	AVOGIEHATKZNPF-IUCAKERBSA-N	247.250	1.572	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H](O)C(C)C	877037435	QUGMCFQKSJATEJ-CYBMUJFWSA-N	223.316	1.807	10	20	BDCD	
Nc1ccc(CN2CCOC[C@@H]2C2CC2)cc1	1334775364	XVJVUDHESUKMJI-CQSZACIVSA-N	232.327	1.880	10	20	BDCD	
Cc1ccc(O)c(CN2CCNCC2)c1	70955766	VBWCHVVSZCVMPN-UHFFFAOYSA-N	206.289	1.106	10	20	BDCD	
CC(C)(C)CNC(=O)Cc1ccc(N)cc1	40494360	HDDVVVBUTKVRLX-UHFFFAOYSA-N	220.316	1.974	10	20	BDCD	
CC(C)OCC(=O)NCc1ccc(O)c(O)c1	272278706	FGOWEPVUBDZUBR-UHFFFAOYSA-N	239.271	1.139	10	20	BDCD	
CCCNC(=O)COc1ccc(N(C)C)cc1	289426924	RIIYKAXWTDXVOT-UHFFFAOYSA-N	236.315	1.658	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)[C@@H]1CCCCN1	817957440	MENXUNLKZZBCLJ-DOMZBBRYSA-N	247.386	1.932	10	20	BDCD	
CC[C@H](N[C@H](C)CN)c1ccccc1O	817966342	LUGZHJJYHNTOLY-KOLCDFICSA-N	208.305	1.780	10	20	BDCD	
CC[C@](C)(CO)NC(=O)c1cc(O)cs1	831263117	LWMNUORXSZRZSE-SNVBAGLBSA-N	229.301	1.345	10	20	BDCD	
COCCN1CCN(Cc2ccc(N)cc2)CC1	1356083644	WUNLXHDFKFZGQX-UHFFFAOYSA-N	249.358	1.033	10	20	BDCD	
CCO/C=C/C(=O)NCc1cc(C)ccc1O	862755452	HJBQEKRRMMJTFH-VOTSOKGWSA-N	235.283	1.867	10	20	BDCD	
CC(=O)NC(C)(C)C(=O)N(C)c1ccc(N)cc1	877078634	XNONBNKDQAUFHX-UHFFFAOYSA-N	249.314	1.146	10	20	BDCD	
Nc1ccc(CNC(=O)NC[C@H]2CCOC2)cc1	1335420106	FJXZBUIHEHYXCF-LLVKDONJSA-N	249.314	1.105	10	20	BDCD	
Nc1ccc(CNC(=O)N2CC[C@H]3C[C@H]3C2)cc1	1337070071	HPZGRQMQAPZOBV-RYUDHWBXSA-N	245.326	1.820	10	20	BDCD	
CCOC(=O)[C@@H]1CCN(Cc2ccc(N)cc2)C1	1336284957	FKOYOJXQEQPIEQ-GFCCVEGCSA-N	248.326	1.654	10	20	BDCD	
CC(C)(C(=O)O)C(=O)N1Cc2cccc(O)c2C1	1588611124	GUDXOFQTHWQPLX-UHFFFAOYSA-N	249.266	1.345	10	20	BDCD	
CC[C@@H](O)CCNCc1cc(OC)ccc1O	164767589	DOGUANWAVADDLT-LLVKDONJSA-N	239.315	1.651	10	20	BDCD	
COC(=O)[C@@H](C)CN(C)Cc1ccc(N)cc1	1336286567	SQRDVNMUGCWCBM-JTQLQIEISA-N	236.315	1.510	10	20	BDCD	
CN(C)c1ccc(CNCCn2ccnc2)cc1	41063260	RFOSBOZCONOITI-UHFFFAOYSA-N	244.342	1.739	10	20	BDCD	
COc1ccc(N(C)CC(N)=O)cc1Cl	121973564	BCNYMALWUCZPRM-UHFFFAOYSA-N	228.679	1.270	10	20	BDCD	
C[C@H](O)CCN(C)Cc1cc(F)ccc1O	180170344	OAWOHJLFBNFHAK-VIFPVBQESA-N	227.279	1.734	10	20	BDCD	
COC[C@H](C)CC(=O)N(C)c1ccc(N)cc1	95033744	YTSRVOOAJCTXNS-SNVBAGLBSA-N	236.315	1.904	10	20	BDCD	
CCc1nc(CNCc2cccc(C)c2O)n[nH]1	296115388	SRVIENONOMGFDM-UHFFFAOYSA-N	246.314	1.671	10	20	BDCD	
COc1ccc(CN[C@@H](CO)CCF)cc1C	846097496	PZSVDPZGSDKKHN-GFCCVEGCSA-N	241.306	1.814	10	20	BDCD	
O=C(OCCCF)c1cccc(O)c1O	758574061	ZMQBVOLZROAMBH-UHFFFAOYSA-N	214.192	1.614	10	20	BDCD	
C[C@@H](NCC(=O)N1CCC1)c1ccccc1O	879648993	IQTGZUPRBNGPMF-SNVBAGLBSA-N	234.299	1.275	10	20	BDCD	
COc1cc(C)cc(CN[C@@H]2CC[C@H]2O)c1O	895059457	WGNJDRKWRUUPNA-GHMZBOCLSA-N	237.299	1.322	10	20	BDCD	
C[C@@H]1COC[C@H]1NCc1cc(F)ccc1O	699745852	UQIKLMXBKNDMST-LDYMZIIASA-N	225.263	1.656	10	20	BDCD	
CO[C@H]1CCC[C@@H]1C(=O)NCc1ccccc1O	1353617676	IZHPWCHNKGOHAV-AAEUAGOBSA-N	249.310	1.824	10	20	BDCD	
C[C@@H](CO)N[C@H]1CCc2cccc(O)c21	297126843	YTMGUYXZDVLFDU-WPRPVWTQSA-N	207.273	1.350	10	20	BDCD	
CC(=O)C(=O)COC(=O)CC1CCCC1	808488629	LTDYQEIUYVGFSL-UHFFFAOYSA-N	212.245	1.268	10	20	BDCD	
CC(=O)C(=O)COc1cccc(Cl)c1	808013138	ZVNWLFFZCRYTEQ-UHFFFAOYSA-N	212.632	1.877	10	20	BDCD	
O=C(CCCF)NCc1ccc(O)cc1O	910944146	SGQGLNZPJCQJQC-UHFFFAOYSA-N	227.235	1.464	10	20	BDCD	
O=C1CC[C@H](C(=O)NCc2ccc(O)c(O)c2)C1	843833207	ZNFOLIWLLWHTKK-VIFPVBQESA-N	249.266	1.083	10	20	BDCD	
C[C@H]1C[C@@H](O)CN1Cc1cc(F)cc(F)c1O	894539842	XKDLVCKCFOPKHH-OIBJUYFYSA-N	243.253	1.626	10	20	BDCD	
COc1cccc(CNC[C@H]2CCN2C)c1O	712584554	BNTDMLPIKQZSKJ-LLVKDONJSA-N	236.315	1.195	10	20	BDCD	
COC(=O)[C@]1(C)CCN(Cc2ccc(N)cc2)C1	1334773997	CBHUFAPERVPIBA-CQSZACIVSA-N	248.326	1.654	10	20	BDCD	
CC(=O)N1CCN(Cc2ccc(N)cc2)[C@@H](C)C1	1352788895	REBPURHFZVRIQF-NSHDSACASA-N	247.342	1.321	10	20	BDCD	
CCN1CCOc2cc(N(C)C)ccc21	119953166	NIWRKEBJCLUMKN-UHFFFAOYSA-N	206.289	1.971	10	20	BDCD	
CC[C@@H](CCO)NCc1cccc(C)c1O	162668970	FFFXCDGDOFBEIE-LBPRGKRZSA-N	223.316	1.951	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)[C@H](CN)C1CC1	842511828	YTLATCBVJWTFIE-CYBMUJFWSA-N	247.342	1.007	10	20	BDCD	
Cc1cccc(CN[C@@H](CO)CC2CC2)c1O	776251969	GUMOENMZPYXTFE-CYBMUJFWSA-N	235.327	1.951	10	20	BDCD	
CC[C@@H](O)CNCc1ccc2c(c1)CCCN2C	124480308	LHPIIHRKWZXHPJ-CQSZACIVSA-N	248.370	1.930	10	20	BDCD	
Cn1ncnc1CSc1nccs1	153815222	FBIQOYNPLCQYAA-UHFFFAOYSA-N	212.303	1.564	10	20	BDCD	
Cc1cc(C(=O)NCc2ccccc2O)n(C)n1	133751267	LDGVRJWSIRPFMV-UHFFFAOYSA-N	245.282	1.364	10	20	BDCD	
C[C@@H](CO)NCc1ccc2c(c1)CCCO2	82538506	LUXUAIQORNEFKE-JTQLQIEISA-N	221.300	1.482	10	20	BDCD	
CNC(=O)[C@H](C)N[C@H](C)c1ccc(C)cc1O	42560939	FYXAICNZIWGREL-ZJUUUORDSA-N	236.315	1.486	10	20	BDCD	
OC[C@@H]1[C@H]2CN(Cc3ccccc3O)C[C@H]21	259468672	WNLKYSGLGFBSLT-GDNZZTSVSA-N	219.284	1.062	10	20	BDCD	
C[C@H]1C[C@@H](NC(=O)c2cc(O)cs2)CO1	844152994	JFKIKWBZGZUTLI-NKWVEPMBSA-N	227.285	1.361	10	20	BDCD	
Oc1cccc2c1[C@H](NCCN1CCC1)CC2	697379979	QDCNIDVCPYOHKW-GFCCVEGCSA-N	232.327	1.675	10	20	BDCD	
CC1(O)CN(Cc2c(O)ccc(Cl)c2F)C1	877581190	PVLRUARWEDEGIQ-UHFFFAOYSA-N	245.681	1.751	10	20	BDCD	
CN(C(=O)C1(N)CCCC1)c1ccc(N)cc1	877078908	JDJMXKPRTIXUKV-UHFFFAOYSA-N	233.315	1.503	10	20	BDCD	
CC[C@@H]1NCC[C@H]1C(=O)NCc1ccc(N)cc1	1122535812	IIEQYOQRWWPYLP-OLZOCXBDSA-N	247.342	1.273	10	20	BDCD	
CO[C@H](C)CNCc1cc2c(cc1O)OCO2	191208366	PYIHIPXTZDBWOK-MRVPVSSYSA-N	239.271	1.245	10	20	BDCD	
CN[C@@H]1CCCN(Cc2ccc(N)cc2)C1	1334775456	YHMILKHXUWOLKS-CYBMUJFWSA-N	219.332	1.453	10	20	BDCD	
CCOC(=O)[C@@H](C)NCc1c(C)cccc1O	877470342	CDEMEVMCNWNEMK-SNVBAGLBSA-N	237.299	1.742	10	20	BDCD	
CC[C@@H](N[C@H](C)c1ccccc1O)C(=O)O	820419170	NPDLWPQGACLQKJ-PSASIEDQSA-N	223.272	1.906	10	20	BDCD	
CN(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1	171250560	XNUGUFTXBYVUCG-UHFFFAOYSA-N	249.358	1.273	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C[C@H](N)C2)c1	906508303	LWCRQDCHOVNAAK-XYPYZODXSA-N	206.289	1.280	10	20	BDCD	
CC[C@H](O)[C@H](C)C(=O)NCc1ccccc1O	822576127	JHUGAJSXYYVZLL-ONGXEEELSA-N	237.299	1.415	10	20	BDCD	
CCNC(=N)NCc1c(O)ccc2c1CCCC2	849010928	AWAAQSGNOGXRMI-UHFFFAOYSA-N	247.342	1.905	10	20	BDCD	
C[C@@H]1OCC[C@]1(C)NC(=O)c1cc(O)cs1	753504967	WRQYHMUYSRPBEU-CPCISQLKSA-N	241.312	1.751	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCc2c[nH]nc2C1	750809110	PFDRJYYABQLVMV-UHFFFAOYSA-N	249.295	1.375	10	20	BDCD	
CN(CC1CC1)C(=O)CN(C)c1ccc(N)cc1	863557709	UGNCKMQCXONSCE-UHFFFAOYSA-N	247.342	1.573	10	20	BDCD	
CC[C@@H](C(=O)NCCc1ccc(N)cc1)N(C)C	863585378	XCNSPBIBKQLJNK-ZDUSSCGKSA-N	249.358	1.268	10	20	BDCD	
C[C@H](N)[C@@H](C)C(=O)N[C@H](C)c1ccccc1O	870988340	MTFFTBCUXMCUJH-KXUCPTDWSA-N	236.315	1.553	10	20	BDCD	
C[C@@H](N[C@@H](CO)CCF)c1c(O)cccc1F	886632761	DFWJNPMHJRFDEQ-RKDXNWHRSA-N	245.269	1.902	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1C[C@H](O)C1	877811452	KSIVEDUMGBWBTR-XYPYZODXSA-N	221.300	1.561	10	20	BDCD	
CNC(=O)c1cc(C)n(-c2ccccn2)c1C	119562297	VOZFNABORRFIFS-UHFFFAOYSA-N	229.283	1.849	10	20	BDCD	
CC[C@H]1CCN(C(=O)c2cccc(O)c2O)C1	126539286	NCAFMGNEUDXVCG-VIFPVBQESA-N	235.283	1.970	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C[C@@H](O)C2(C)C)c1	128113103	FVGLOUWQJLPNTB-QWHCGFSZSA-N	235.327	1.950	10	20	BDCD	
COC[C@H]1CCN(Cc2ccc(N)cc2)C1	81041437	VQGOEVMSFADMNQ-LBPRGKRZSA-N	220.316	1.737	10	20	BDCD	
C/C=C\C(=O)NCc1ccc(O)c(O)c1	223432278	OCVFISJOOCQBBA-IHWYPQMZSA-N	207.229	1.290	10	20	BDCD	
COC[C@H](C)CNCc1ccc2c(c1)CCO2	44477940	UEBMIUFERKQLFF-LLVKDONJSA-N	235.327	1.994	10	20	BDCD	
C[C@@H](NC[C@@H]1CNCCO1)c1ccccc1O	817984033	VCIKIOFLHGPVRD-MNOVXSKESA-N	236.315	1.031	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1C[C@H]1F)c1ccccc1O	1347190510	PXIDPBKMOMPXDH-SZEHBUNVSA-N	223.247	1.927	10	20	BDCD	
CCN(Cc1cccc(C)c1O)[C@@H](C)CO	293731288	UVBWGOVPHXIRCM-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
CC[C@@H](NC[C@H](C)N)c1ccc(F)cc1O	817974170	ZXGLGKUJQDQNIF-GZMMTYOYSA-N	226.295	1.919	10	20	BDCD	
CC[C@@H](CNCc1cc(C)ccc1O)C(=O)O	903706652	ZQQLIJOCCAFVCZ-JTQLQIEISA-N	237.299	1.901	10	20	BDCD	
C[C@H](N)C[C@@H](C)NCc1ccccc1O	843129428	OOXYJMCUIMRRDC-VHSXEESVSA-N	208.305	1.608	10	20	BDCD	
COCCN(C)Cc1cc(OC)c(C)cc1O	768441246	XQEPJLJMTJEKHX-UHFFFAOYSA-N	239.315	1.787	10	20	BDCD	
Nc1ccc(NC(=O)C2(F)CCOCC2)cc1	876503683	CPEGDHVROLYVFV-UHFFFAOYSA-N	238.262	1.726	10	20	BDCD	
Cn1nc2c(c1CCN=[N+]=[N-])COCC2	409437267	FKIRDGHYTZLTSX-UHFFFAOYSA-N	207.237	1.346	10	20	BDCD	
CC[C@H](NC(C)=O)C(=O)N(C)c1ccc(N)cc1	708888015	MFWNPCWOCCLWMI-LBPRGKRZSA-N	249.314	1.146	10	20	BDCD	
CC1(CC(=O)NCc2cccc(O)c2O)CC1	1263894490	JAVLCLGTCYDUTP-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CC[C@H](CNCc1c(O)cccc1OC)OC	810175679	AZOWBLQQJVVTEN-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
CC1(C)NCC[C@H]1NCc1ccc2c(c1)CCO2	841086333	NBFNINSPLADPTF-CQSZACIVSA-N	246.354	1.852	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)C[S@@](C)=O	877310526	NQQGBSLUTOYRMO-QLJPJBMISA-N	241.356	1.557	10	20	BDCD	
Cc1ccc(CN[C@@H]2COC[C@H]2C)c(O)c1	896733138	NCEAHIMOJWIHPD-ZYHUDNBSSA-N	221.300	1.825	10	20	BDCD	
CCOc1cccc(CN(C)[C@@H](C)CN)c1O	382998406	NPMVRSBOEMBQLP-JTQLQIEISA-N	238.331	1.570	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1=CCCCO1	182550334	SGXYUYPOKYRANR-UHFFFAOYSA-N	249.266	1.408	10	20	BDCD	
CONC(=O)NCc1ccc(N(C)C)cc1	31729642	KRCDRWRIRPOWMF-UHFFFAOYSA-N	223.276	1.113	10	20	BDCD	
CC(C)(O)CNCc1ccc2c(c1)CCO2	82687417	FBEBITVFFWURSP-UHFFFAOYSA-N	221.300	1.482	10	20	BDCD	
CC(=O)N[C@@H]1CCN(Cc2ccccc2O)C1	228356271	QPOISAZZDOHLSD-GFCCVEGCSA-N	234.299	1.103	10	20	BDCD	
CC(=O)C(=O)CSc1nccn1C(C)C	289557567	GSGVUQPKTOVJAS-UHFFFAOYSA-N	226.301	1.714	10	20	BDCD	
C[C@@H](NC/C=C/CO)c1cc(F)ccc1O	717573891	AIIHKDDQBHZAPC-GKQMSVHHSA-N	225.263	1.730	10	20	BDCD	
NCC1CC(NCCc2ccc(N)cc2)C1	904352794	ASWZZNJAQPXSNY-UHFFFAOYSA-N	219.332	1.138	10	20	BDCD	
C[C@H](O)[C@@H](N)c1cc(Cl)ccc1O	95659546	KCZAICOPPILPEW-SSDLBLMSSA-N	201.653	1.426	10	20	BDCD	
COc1cc(C)cc(CNCc2cocn2)c1O	894276355	RAHYBQRCTVZNNE-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
C[C@@H](NC(=O)CNCC1CC1)c1ccccc1O	870988260	LALLYPXRRAODRE-SNVBAGLBSA-N	248.326	1.569	10	20	BDCD	
C[C@@H](C(=O)NCc1ccccc1O)n1ccnc1	1318162723	GKPRPZZNWJEDOI-JTQLQIEISA-N	245.282	1.466	10	20	BDCD	
CC1(NC(=O)/C=C/c2ccc(O)c(O)c2)CC1	1254338818	OWBGPGKXWSFPKF-HWKANZROSA-N	233.267	1.780	10	20	BDCD	
CC(C)[C@@H](C(=O)NCc1ccc(N)cc1)[C@H](C)N	1515331484	FFDFRQPUJDECCT-GXFFZTMASA-N	249.358	1.504	10	20	BDCD	
Cc1cc(Br)cc(O)c1CN	1525644020	YADVPQHDBFIVLT-UHFFFAOYSA-N	216.078	1.922	10	20	BDCD	
CCN(OC)C(=O)/C=C/c1ccc(O)c(O)c1	1529028161	OXSPWRDXAJBHEY-FNORWQNLSA-N	237.255	1.521	10	20	BDCD	
Cn1cnc(CN[C@H]2CCc3cccc(O)c32)c1	903351112	HGSJBNARLGWKSI-LBPRGKRZSA-N	243.310	1.903	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1C[C@H](O)C1	850417958	SMJONYQAXQIIJP-KYZUINATSA-N	223.272	1.014	10	20	BDCD	
Oc1cccc2c1[C@H](NCCn1ccnc1)CC2	295847758	FYFAORUYZCJYMX-GFCCVEGCSA-N	243.310	1.866	10	20	BDCD	
Cc1cccc(CN[C@@H]2C[C@H]3CC[C@H]2NC3)c1O	530245961	IRBWCKGDJFIJOB-MRVWCRGKSA-N	246.354	1.931	10	20	BDCD	
Cc1n[nH]c(C)c1NC(=O)c1cccc(O)c1O	126259761	NQUHBNABGSYRAE-UHFFFAOYSA-N	247.254	1.690	10	20	BDCD	
COc1cccc(CN2CCSCC2)c1O	126214471	PPGWPRFAKHBCMG-UHFFFAOYSA-N	239.340	1.950	10	20	BDCD	
O=C(NCc1ccno1)c1cccc(O)c1O	229417115	FUTBNTNFUYDQPP-UHFFFAOYSA-N	234.211	1.016	10	20	BDCD	
C[C@H]1CCN(Cc2ccccc2O)C[C@H]1CN	253189194	KFVCFYCSMTYJDP-WCQYABFASA-N	234.343	1.809	10	20	BDCD	
Oc1ccccc1CN1CC[C@@](O)(C2CC2)C1	369677020	UXTNDGUCSCVWOD-AWEZNQCLSA-N	233.311	1.739	10	20	BDCD	
O=C(/C=C/c1cccnc1)N1CCn2nccc21	375601280	UJGOJSVAEMOSNQ-ONEGZZNKSA-N	240.266	1.338	10	20	BDCD	
Oc1ccc(F)cc1CN1CCC[C@@H](O)CC1	293913877	GDWUSTCFANAFFI-GFCCVEGCSA-N	239.290	1.878	10	20	BDCD	
CCOC(=O)[C@H](C)NC(=O)c1cc(O)cs1	731870649	SMBJDTMMNHVGNH-LURJTMIESA-N	243.284	1.135	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](CCN)C2)c1O	904405398	HBWLQDNSLUPFDQ-GFCCVEGCSA-N	234.343	1.871	10	20	BDCD	
Cc1ccc(O)c(CN2CC(O)(C(C)C)C2)c1	839133578	VZVVXKCQXMELSV-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
CC[C@H](N)CNCc1cc(C)ccc1O	841072289	NLGKSRGEWQLZCV-NSHDSACASA-N	208.305	1.528	10	20	BDCD	
COCC[C@@H](C)OC(=O)c1cccc(O)c1O	784787614	KJJMOULDABUITM-MRVPVSSYSA-N	240.255	1.680	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CC[C@@H](CN)C2)cc1	724060886	XVHKWDSERYZAKT-KGLIPLIRSA-N	247.386	1.970	10	20	BDCD	
COc1cccc(O)c1CNC[C@H](O)C1CC1	734844751	UFHRGSRCAPHZSD-LBPRGKRZSA-N	237.299	1.261	10	20	BDCD	
CCOc1ccn(-c2ccc(N)cc2)n1	536952215	BGKOOBOYVZUWAN-UHFFFAOYSA-N	203.245	1.853	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@H]1CCNC1	843049599	SJPWJGGOTJZNNV-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
CCN(CCO)Cc1cc(C)ccc1O	127969602	DYTKMGNAESCNTO-UHFFFAOYSA-N	209.289	1.515	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CCCCO2)cc1	50958553	PSFSXJVUMAOZBQ-NSHDSACASA-N	220.272	1.776	10	20	BDCD	
Cn1ncnc1Sc1ncc([N+](=O)[O-])s1	192548515	XXIOZCQZYQPGBV-UHFFFAOYSA-N	243.273	1.331	10	20	BDCD	
CN(C)c1ccc(CNc2ncnn2C)cc1F	274280831	VNMMRYOFKKJYLL-UHFFFAOYSA-N	249.293	1.632	10	20	BDCD	
CCOc1ccc(N(C)Cc2cnn(C)n2)cc1	809948485	FSNNQHWSCXLVLR-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
Nc1ccc(NC(=O)C2(N)CCCCC2)cc1	294841444	TZSFFVZCIIJRSR-UHFFFAOYSA-N	233.315	1.869	10	20	BDCD	
Cc1noc([C@H](C)NCc2ccccc2O)n1	729684955	YTFPXCIDFURLQN-QMMMGPOBSA-N	233.271	1.934	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CC[C@H](C(=O)O)C2)c1	820968209	UPVVCIXYMOAEKU-NSHDSACASA-N	249.310	1.916	10	20	BDCD	
COc1cccc([C@H](C)NCCN(C)C)c1O	846174756	YXYYVWRGRHSSDE-JTQLQIEISA-N	238.331	1.613	10	20	BDCD	
CN1C(=O)N(c2ccc(N)cc2)CC1(C)C	1898199671	WHRYCWIPAUZFOL-UHFFFAOYSA-N	219.288	1.919	10	20	BDCD	
CO[C@@H]1CCN(C(=O)c2cc(O)cs2)C1	752821003	QWQPCTNVMSBMLK-MRVPVSSYSA-N	227.285	1.315	10	20	BDCD	
CC[C@H]1CN(C(=O)c2cc(O)cs2)C[C@H]1O	760978884	CRLMGALHHGWRGG-IONNQARKSA-N	241.312	1.297	10	20	BDCD	
C[C@H](CCCO)NC(=O)c1cc(O)cs1	760173973	QRBXGTWMSXBZFH-SSDOTTSWSA-N	229.301	1.345	10	20	BDCD	
Cc1cccc(CN2CCC[C@H](C(=O)O)C2)c1O	874044597	GKWDUICGJKVOIN-LBPRGKRZSA-N	249.310	1.997	10	20	BDCD	
CC(C)C[C@H](N)C(=O)NCc1ccc(N)cc1	83362620	ISHBSEHRHSZKFD-LBPRGKRZSA-N	235.331	1.258	10	20	BDCD	
CC(C)(O)CCNCc1ccc2c(c1)CCO2	274765973	QDMJWBDKCSZAOY-UHFFFAOYSA-N	235.327	1.872	10	20	BDCD	
Cc1cc(C(=O)NCc2ccccc2O)ncn1	759607632	FSGATCWNTLERSV-UHFFFAOYSA-N	243.266	1.421	10	20	BDCD	
CC(C)(C)[C@@H](CN)NCc1ccc(N)cc1	1356082692	CHAACYZJRZJSAF-GFCCVEGCSA-N	221.348	1.732	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H]2CC[C@H](C1)N2	873215991	HQMOZPCEINNFID-PHIMTYICSA-N	248.326	1.337	10	20	BDCD	
Cc1ccc(CNC[C@H]2CCN2C)c(O)c1	896594793	DAOGVPZQDGZFEE-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
CC(C)[C@H]1CCN1C(=O)c1cccc(O)c1O	839782015	DUBSCKIAKPZVLL-SNVBAGLBSA-N	235.283	1.968	10	20	BDCD	
CC[C@H](NC)C(=O)N[C@H](C)c1ccccc1O	870988699	XHBZIQBCUZBUSZ-KOLCDFICSA-N	236.315	1.567	10	20	BDCD	
CC(C)[C@@H](N)C(=O)N[C@H](C)c1ccccc1O	870988044	FAIVLJKMSZMUHI-BXKDBHETSA-N	236.315	1.553	10	20	BDCD	
Nc1ccc(CNC(=O)C2CCOCC2)cc1	61671036	IJNNHUPQVIWIOV-UHFFFAOYSA-N	234.299	1.312	10	20	BDCD	
CN(CCC(=O)O)Cc1ccccc1O	83410371	RWTJIBCLZZAASL-UHFFFAOYSA-N	209.245	1.299	10	20	BDCD	
CNCCCN[C@@H]1CCc2cccc(O)c21	817943758	SBBGFHPGUTXSLZ-LLVKDONJSA-N	220.316	1.579	10	20	BDCD	
Oc1c(F)cccc1CN1C[C@H]2CC[C@H]1CN2	817865378	PQOQQGMTXLKMDU-MNOVXSKESA-N	236.290	1.468	10	20	BDCD	
CC(F)(F)C(=O)NCc1ccc(O)cc1O	828912040	GDVBNOMFEKKGOE-UHFFFAOYSA-N	231.198	1.369	10	20	BDCD	
Cc1ccc([C@H](C)NCCCON)c(O)c1	902425357	MQLAJLMEHIBJOY-JTQLQIEISA-N	224.304	1.632	10	20	BDCD	
CC(C)(C)C(=O)CNC(=O)c1cc(O)cs1	831390572	UTOKGCBHLHUYEW-UHFFFAOYSA-N	241.312	1.799	10	20	BDCD	
O=C(NCCc1cccnc1)c1cc(O)cs1	731867328	GBBSMCIXTAHDHQ-UHFFFAOYSA-N	248.307	1.821	10	20	BDCD	
C[C@@H]1C[C@H](NCc2cccc(F)c2O)CCN1	841061166	FRFTWNBXPGAIAV-MWLCHTKSSA-N	238.306	1.761	10	20	BDCD	
Cc1cc(O)c(CNC/C=C/CO)cc1C	850357700	RZAAUSJSMOVPFQ-ONEGZZNKSA-N	221.300	1.647	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@H]2CCC[C@H]2O)cc1	89151026	XFTZOHMUFBZEKM-DGCLKSJQSA-N	248.326	1.089	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOC[C@H]2CCCC[C@@H]21	409435105	SIQVMTCUWUSCED-ZJUUUORDSA-N	238.291	1.714	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2CCCNCC2)cc1	1343472094	DLIBMULPHNQBAN-GFCCVEGCSA-N	247.342	1.275	10	20	BDCD	
CCn1cnc(CNCc2ccc(N)cc2)c1	1578357378	UKKXXBYEODPLAL-UHFFFAOYSA-N	230.315	1.775	10	20	BDCD	
C[C@@H](NCC1(O)CCC1)c1ccccc1O	162199799	NALCOSLGZHQEIT-SNVBAGLBSA-N	221.300	1.958	10	20	BDCD	
NCCCCC(=O)Nc1ccc(N)cc1	390496749	SGRPKHWIDLFOHV-UHFFFAOYSA-N	207.277	1.336	10	20	BDCD	
Cc1ocnc1CNC(=O)c1cccc(O)c1O	398389640	WJXDVFDZHMWPCM-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
CC[C@@H]1C(=O)NCCN1Cc1cccc(C)c1O	180036755	TZLNVVDFGSZKFD-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H]2CCCO2)cc1	33465156	NFGYMQHOUCZLJA-LBPRGKRZSA-N	234.299	1.107	10	20	BDCD	
O=C1C[C@H](NCc2ccccc2O)CCCN1	228415498	CHBZKUSBUJUVSO-LLVKDONJSA-N	234.299	1.151	10	20	BDCD	
CCc1cccc(CN2CCNCC2)c1O	82643139	ACWZRLFTJBIVTE-UHFFFAOYSA-N	220.316	1.360	10	20	BDCD	
CC(=O)C(=O)CSc1nnc(C)n1C(C)C	808034938	ZPDVMSJTVHDUPF-UHFFFAOYSA-N	241.316	1.418	10	20	BDCD	
CC[C@H](N[C@H]1CCCNC1=O)c1ccccc1O	50394199	QGFJNIYGQRQOOX-RYUDHWBXSA-N	248.326	1.712	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(C)cc2O)C[C@@H]1O	876814351	DZQCRRINBWYFHW-FZMZJTMJSA-N	235.327	1.903	10	20	BDCD	
C[C@H]1C[C@@H]1C(=O)NCCc1ccc(O)c(O)c1	98074508	ZHOFPZGAJRBXRE-WPRPVWTQSA-N	235.283	1.413	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@]2(CCCCO2)C1	409426405	HZBRHFJWNNLENF-SNVBAGLBSA-N	224.264	1.468	10	20	BDCD	
O=C(N[C@H]1CC[C@H]1C(=O)O)c1cc(O)cs1	1601571541	OMISALHOBMYMAU-RQJHMYQMSA-N	241.268	1.047	10	20	BDCD	
COCC(=O)NCc1ccc2c(c1)CCCN2C	169809578	JHYTWRZBAQQPAL-UHFFFAOYSA-N	248.326	1.332	10	20	BDCD	
CN1CCN(Cc2ccc(N)cc2)C(C)(C)C1	1356082650	ATHCIGSLXOOJMZ-UHFFFAOYSA-N	233.359	1.795	10	20	BDCD	
COC[C@@H](C)CNC(=O)c1cccc(O)c1O	126366215	RTPRUBKXIYCSBI-QMMMGPOBSA-N	239.271	1.110	10	20	BDCD	
Oc1ccc(Cl)cc1CN1CCCNCC1	38086985	ZGLYXXBVGMMNBK-UHFFFAOYSA-N	240.734	1.841	10	20	BDCD	
Cc1ccc(O)c(CNCC(C)(C)O)c1	78638699	VPZDPDQDCDMTES-UHFFFAOYSA-N	209.289	1.561	10	20	BDCD	
CC[C@H](O)CNCc1ccc2c(c1)CCCN2C	124480090	LHPIIHRKWZXHPJ-AWEZNQCLSA-N	248.370	1.930	10	20	BDCD	
COCC[C@@H](CO)NCc1cccc(C)c1O	281250721	MMUBJFXLMWBYGH-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
NCc1ccc2c(c1)CCCN2C[C@H]1CCCN1	903423212	QMQKKJJOMCQDAA-CQSZACIVSA-N	245.370	1.650	10	20	BDCD	
COCCCOC(=O)c1cc(O)cs1	733497298	SFESUSRPGWUGTN-UHFFFAOYSA-N	216.258	1.647	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2[C@@H]3CNC[C@@H]32)cc1	841078480	RZPXWEUKXZMCLA-WDNDVIMCSA-N	231.343	1.060	10	20	BDCD	
Cc1ccc(O)c(CNCC(F)(F)CN)c1	841059852	KGOPJMLEHZCTBY-UHFFFAOYSA-N	230.258	1.384	10	20	BDCD	
COc1cccc(O)c1CNCC(F)(F)CN	841059437	DLGQATLTDVJMMG-UHFFFAOYSA-N	246.257	1.084	10	20	BDCD	
Cc1cc(CNCc2ccccc2O)on1	44985523	WGABTRBFHVHPMS-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)NC2CC2)c1	858087673	RMZCWTGXDSPGGX-UHFFFAOYSA-N	220.272	1.662	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@H]2CCCC[C@]2(CO)C1	409430792	JAMHTIXHJPZXIK-MWLCHTKSSA-N	238.291	1.308	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCc2cc(CO)ccc21	409430732	IXNJXFIFMQTHJC-UHFFFAOYSA-N	232.243	1.378	10	20	BDCD	
C[C@H](O)[C@H]1CCN(C(=O)c2cc(O)cs2)C1	780803150	IPTYAFWLGCEAAZ-YUMQZZPRSA-N	241.312	1.297	10	20	BDCD	
C[C@@H](NC(=O)C1(C(=O)O)CC1)c1ccccc1O	871596584	RRFZBGVUDMIRLF-MRVPVSSYSA-N	249.266	1.434	10	20	BDCD	
Nc1ccc(NC(=O)N2CCC[C@H](O)CC2)cc1	378676912	QHCCYZBVYIJETI-LBPRGKRZSA-N	249.314	1.648	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1C[C@@H](N)C1)c1ccccc1O	877256474	XAKQJTIXDZJIMU-BBBLOLIVSA-N	234.299	1.307	10	20	BDCD	
Cc1noc(CN(C)Cc2ccccc2O)n1	109769622	GFZRXQJOTAJJQE-UHFFFAOYSA-N	233.271	1.716	10	20	BDCD	
CONC(=O)NCc1ccc(N(C)C)cc1C	115647522	KZZKZVSWHUEJSZ-UHFFFAOYSA-N	237.303	1.422	10	20	BDCD	
COCC[C@H](C)NC(=O)c1cccc(O)c1O	126445755	HLYGXWSMCWEILE-QMMMGPOBSA-N	239.271	1.253	10	20	BDCD	
NCC1(C(=O)Nc2ccc(N)cc2)CCCC1	818556354	NUDHFZVVAADHJO-UHFFFAOYSA-N	233.315	1.726	10	20	BDCD	
O=C(N[C@@H](C(=O)O)C1CC1)c1cc(O)cs1	833123180	IXWYMDIMBYUWOD-MRVPVSSYSA-N	241.268	1.047	10	20	BDCD	
C[C@H]1CNC[C@@H](C)N1Cc1ccccc1O	843066107	SLJGLBGWNXNQHK-PHIMTYICSA-N	220.316	1.574	10	20	BDCD	
Oc1cccc(Cl)c1CNC[C@H]1CCCN1	841035681	JSOXUVIJGJNIHX-SECBINFHSA-N	240.734	1.887	10	20	BDCD	
COc1cccc([C@H](C)NCc2cc[nH]n2)c1O	846148162	XUFGKJLBMGEZGO-VIFPVBQESA-N	247.298	1.975	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CC[C@H](CN)C2)c1	841085172	WBTPIRFYPQIGLQ-WCQYABFASA-N	234.343	1.918	10	20	BDCD	
CC(=O)N1CC[C@@H](N[C@@H](C)c2ccccc2O)C1	857083880	AHIMATTVFKNJIW-CMPLNLGQSA-N	248.326	1.664	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H]3C[C@@]3(CO)C2)c1	783746564	YGLKLWHLSNMBQF-OCCSQVGLSA-N	233.311	1.515	10	20	BDCD	
CC[C@@H](CO)NCc1cc([N+](=O)[O-])ccc1O	83367810	RNIPMANEUGLVHH-VIFPVBQESA-N	240.259	1.161	10	20	BDCD	
CN(CC(=O)N1CCCC1)Cc1ccc(N)cc1	35063921	JGWZWSYTYOLNJQ-UHFFFAOYSA-N	247.342	1.323	10	20	BDCD	
C[C@@H](N)[C@H]1CCN(Cc2ccccc2O)C1	168515131	KXMIPCKVRURRCB-MNOVXSKESA-N	220.316	1.561	10	20	BDCD	
c1cc2c(cc1CNCCN1CCC1)CCCO2	921925675	RWSTXFANCRRIOW-UHFFFAOYSA-N	246.354	1.807	10	20	BDCD	
CCN[C@H](C)C(=O)N[C@H](C)c1ccccc1O	877255648	GMNNGZXJLSKZIH-NXEZZACHSA-N	236.315	1.567	10	20	BDCD	
C[C@@H](O)C1(NCc2cc(F)cc(F)c2O)CC1	895334444	GRPGOQGRQAIIHU-SSDOTTSWSA-N	243.253	1.673	10	20	BDCD	
CCCNC(=O)c1ccc(C)c(O)c1O	177659407	WTDIAJDXYCGHIU-UHFFFAOYSA-N	209.245	1.546	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](C)[C@H](C(=O)O)C2)c1	86774661	IIVOYBJQBHUTEN-ZYHUDNBSSA-N	249.310	1.853	10	20	BDCD	
COCC[C@@H](C)NCc1ccccc1O	82367509	PHQORNODTINBNX-SNVBAGLBSA-N	209.289	1.907	10	20	BDCD	
C[C@@H](N)CC(=O)NCc1ccc(N(C)C)cc1	40825891	BLWIQSJHXUQOLU-SNVBAGLBSA-N	235.331	1.106	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1CCCN1	234330839	OSNSXQKTQIZYCO-GFCCVEGCSA-N	220.316	1.576	10	20	BDCD	
Oc1c(F)cccc1CNCC[C@H]1CCNC1	841035870	JFJBYPVVICXECZ-SNVBAGLBSA-N	238.306	1.621	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](C)CN)c1	841050184	ZABPPGFSXZBWMO-SNVBAGLBSA-N	208.305	1.385	10	20	BDCD	
COC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1	876501227	KZHCEMBQYPXDAL-LLVKDONJSA-N	237.303	1.108	10	20	BDCD	
C[C@@H]1C[C@@H](O)CN1Cc1cc(F)ccc1O	788270030	OIUGDDMGNQZWJU-LDYMZIIASA-N	225.263	1.486	10	20	BDCD	
C[C@@H]1C[C@@H](C(=O)NCc2ccccc2O)CCO1	271910516	ZBWBPGVRAFXHSS-MNOVXSKESA-N	249.310	1.824	10	20	BDCD	
CN(C(=O)C[C@H]1COC(=O)C1)c1ccc(N)cc1	1332981740	OPJICDZNKUYTFH-SECBINFHSA-N	248.282	1.185	10	20	BDCD	
CC1(C)[C@@H](NCc2cccc(F)c2O)C[C@H]1N	1576380057	GHZHYDPRQFBPFX-MNOVXSKESA-N	238.306	1.747	10	20	BDCD	
Cc1ccc(CNCCCOCCO)c(O)c1	877184912	SSEICHBFSNXCPQ-UHFFFAOYSA-N	239.315	1.189	10	20	BDCD	
CC(C)(CO)CNCc1ccccc1O	133525581	WRKGHKSFULQVOR-UHFFFAOYSA-N	209.289	1.500	10	20	BDCD	
C[C@H](CCN)NCc1ccc2c(c1)CCCO2	136140338	QVWRGMHZGVQRTM-LLVKDONJSA-N	234.343	1.839	10	20	BDCD	
Nc1ccc(CN2CCCN3CCC[C@@H]3C2)cc1	62939747	YFFJMQXOWJOMAZ-OAHLLOKOSA-N	245.370	1.939	10	20	BDCD	
C[C@@H](NCc1ccn(C)n1)c1ccccc1O	213218877	BYNNPSIUYNDCQN-SNVBAGLBSA-N	231.299	1.977	10	20	BDCD	
COc1ccc(O)c(CNc2cnn(C)c2)c1	35737473	OMOSQMPLFUZVPB-UHFFFAOYSA-N	233.271	1.746	10	20	BDCD	
CCN(C)Cc1ccc(N2CCOCC2)cc1	71123990	VEMBFXFBCDFTQD-UHFFFAOYSA-N	234.343	1.975	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCSC1	76642623	BRWWFGWLMVPDPZ-SNVBAGLBSA-N	209.314	1.987	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)CCN1	84942849	OYQWNBZSFZTHQY-LBPRGKRZSA-N	233.359	1.546	10	20	BDCD	
CCNCCN[C@H](C)c1ccc(F)cc1O	817952135	NYVGPCGZHLAZMX-SECBINFHSA-N	226.295	1.791	10	20	BDCD	
COc1ccc(N(C)CC[S@](C)=O)cc1F	828041431	SZJATACVDNELSZ-INIZCTEOSA-N	245.319	1.649	10	20	BDCD	
NC1(CNCc2cc(Cl)cc(F)c2O)CC1	904449932	NLGOXMNKADWVOJ-UHFFFAOYSA-N	244.697	1.766	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](O)C1)c1cc(F)cc(F)c1O	834905794	LJEXDUAEJVWNTA-CNUIFLNQSA-N	243.253	1.844	10	20	BDCD	
Oc1ccccc1CN[C@H]1CC12CCNCC2	841079757	NGKJRXXRQGLBMU-ZDUSSCGKSA-N	232.327	1.624	10	20	BDCD	
COc1ccc(O)c(CNC[C@H]2CCCN2)c1	841035043	HFOUWFFLZKNDLJ-LLVKDONJSA-N	236.315	1.242	10	20	BDCD	
CC(C)ONC(=O)NCCc1ccc(N)cc1	841956056	SZLHRSSGYIXAMC-UHFFFAOYSA-N	237.303	1.451	10	20	BDCD	
CCO[C@@H]1C[C@H]1C(=O)N[C@H](C)c1ccccc1O	827930228	FKEOHCMQWMJLFJ-IRUJWGPZSA-N	249.310	1.994	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@H]1C[C@H](O)C1)CC2	720935794	IMZKOUDRTPHHKO-DLOVCJGASA-N	233.311	1.740	10	20	BDCD	
Oc1cc2c(cc1CN1CCO[C@H]3C[C@H]31)CCC2	793618266	KXOJYLMJHJHIQT-HIFRSBDPSA-N	245.322	1.854	10	20	BDCD	
CCc1cccc(CNCc2ccn(C)n2)c1O	691444389	IVIFXRICMJRHGY-UHFFFAOYSA-N	245.326	1.978	10	20	BDCD	
NC[C@H]1CCCN(Cc2ccc(N)cc2)C1	1335285333	NPOJPRKLPHKIQG-GFCCVEGCSA-N	219.332	1.440	10	20	BDCD	
O=C(O)[C@@H](CF)NCc1cc(F)c(F)cc1O	1601650897	RRRYMRRVEUPMPX-MRVPVSSYSA-N	249.188	1.183	10	20	BDCD	
CC[C@H](NCc1c(C)cccc1O)C(=O)NC	877575674	BALJAZZENQENEN-NSHDSACASA-N	236.315	1.315	10	20	BDCD	
CC[C@@H](CO)NCc1ccc2c(c1)CCCO2	921474266	RYXUFDODUCXBEL-ZDUSSCGKSA-N	235.327	1.872	10	20	BDCD	
C[C@H](NCc1nncn1C)c1ccccc1O	38007598	XZDXUDHVSZOJMG-VIFPVBQESA-N	232.287	1.372	10	20	BDCD	
Cc1ccc(O)c(CN2CCOC[C@H]2C)c1	132605422	HTHVMGYXEQOQPS-LLVKDONJSA-N	221.300	1.921	10	20	BDCD	
C[C@H](NCCCCO)c1cc(F)ccc1O	193283028	IXVNBAXJYLILRD-VIFPVBQESA-N	227.279	1.954	10	20	BDCD	
C[C@@H](CN(C)C)N[C@@H]1CCc2cccc(O)c21	297436608	VSOKLPVFGJUDHI-CMPLNLGQSA-N	234.343	1.919	10	20	BDCD	
CC(=O)C(=O)Cn1cc(-c2ccccc2)cn1	808022234	HXMBNHPKCYRFIQ-UHFFFAOYSA-N	228.251	1.708	10	20	BDCD	
CC(C)CNC[C@@H](N)c1ccc(N(C)C)cc1	841046303	ZOIANTYLNDPVTR-CQSZACIVSA-N	235.375	1.998	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2C[C@H]2F)c1	1123941180	WRSYRKRLVBNGEU-VHSXEESVSA-N	223.247	1.675	10	20	BDCD	
Nc1ccc(CN2CCOC[C@@]23CCOC3)cc1	1334774200	GKARWKBIRCUCFC-AWEZNQCLSA-N	248.326	1.260	10	20	BDCD	
Nc1ccc(CNCC2CCOCC2)cc1	258912243	FHKHVNMFKCGOIE-UHFFFAOYSA-N	220.316	1.785	10	20	BDCD	
C[C@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)CCN1	834673849	WUSVVXMYTCYGQE-GXFFZTMASA-N	247.342	1.068	10	20	BDCD	
O=C(O)CCN[C@H]1CCc2cccc(O)c21	309542011	YNDYXJAHJBGXRZ-VIFPVBQESA-N	221.256	1.444	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](O)C2CCC2)c1	316791752	RDCYFKHXZCGUPJ-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCCN(C)C2=O)c1	707762966	QAFOQWGLUKTWJB-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
CCC1(C(=O)NCCc2ccc(N)cc2)COC1	818545337	YUHHWSQWAZXDJM-UHFFFAOYSA-N	248.326	1.354	10	20	BDCD	
CC[C@H](NC(=O)c1cc(O)cs1)C(=O)O	828964902	IRLSCZPLTJUHRI-LURJTMIESA-N	229.257	1.047	10	20	BDCD	
Cc1cc(Cl)cc(CN[C@H](C)C(=O)O)c1O	820976666	QTDIJYHLVVCRNI-SSDOTTSWSA-N	243.690	1.917	10	20	BDCD	
CCN[C@H](C)CNCc1cccc(C)c1O	841064873	DEZQXOCNTCDDJO-LLVKDONJSA-N	222.332	1.788	10	20	BDCD	
CC(C)[C@@H](N)CNCc1ccc2c(c1)CCO2	841028162	BWWRFULMKPIYOZ-ZDUSSCGKSA-N	234.343	1.694	10	20	BDCD	
Cc1cc(CN2CCC[C@@H]2CN)ccc1N(C)C	923291049	AEQPCPQFPBSMKI-CQSZACIVSA-N	247.386	1.984	10	20	BDCD	
Oc1cc2c(cc1CN1CCCC1)[C@@H](O)CO2	768437776	GNZPHTSQAHFVRJ-LBPRGKRZSA-N	235.283	1.414	10	20	BDCD	
Cc1ccc(O)c(CNC2(C)COC2)c1	877691782	WOQHDSDOUNFQMX-UHFFFAOYSA-N	207.273	1.579	10	20	BDCD	
CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1	774015292	CUMICKRZTKFDEA-VIFPVBQESA-N	221.304	1.743	10	20	BDCD	
CC[C@H](C)C[C@H](N)C(=O)N(C)c1ccc(N)cc1	1122172275	BLIHYHPTGDYKMA-GWCFXTLKSA-N	249.358	1.995	10	20	BDCD	
C[C@@H](C(=O)N(C)c1ccc(N)cc1)n1cncn1	702097464	NCAJSVVAIXKRGN-VIFPVBQESA-N	245.286	1.084	10	20	BDCD	
C[C@H](CN)N(C)Cc1ccc(Cl)cc1O	1576006669	VWHKPTXPGPMGBY-MRVPVSSYSA-N	228.723	1.825	10	20	BDCD	
Nc1ccc(CNC(=O)N2C[C@H]3C=C[C@H]2C3)cc1	1262603389	GXVANFILACDTHW-AAEUAGOBSA-N	243.310	1.739	10	20	BDCD	
CN(C)c1ccc(CNc2ncc(O)cn2)cc1	1262671317	ZHGLPUMXCNITBS-UHFFFAOYSA-N	244.298	1.860	10	20	BDCD	
CC[C@H](CCO)NCc1cc(OC)ccc1O	164723388	NGVHWCXBPSNJRQ-LLVKDONJSA-N	239.315	1.651	10	20	BDCD	
COC[C@H](CO)N[C@H](C)c1ccccc1O	234841121	VDEGACKVQUGGBT-ZJUUUORDSA-N	225.288	1.050	10	20	BDCD	
CC(=O)C(=O)COc1ccc(C)c([N+](=O)[O-])c1	289667715	OWNYVYQGNCWLDB-UHFFFAOYSA-N	237.211	1.440	10	20	BDCD	
CCN(Cc1ccccc1O)[C@H](C)CO	292680046	APZYSPPQZJMINS-SNVBAGLBSA-N	209.289	1.595	10	20	BDCD	
NC[C@@H]1CCC[C@H]1NCCc1ccc(N)cc1	817958108	SEEMBMQCGVCCCZ-GXTWGEPZSA-N	233.359	1.528	10	20	BDCD	
C[C@@H](NCCCON)c1ccc(F)cc1O	902425914	PFMZOBLAIYMRNF-MRVPVSSYSA-N	228.267	1.462	10	20	BDCD	
Cc1ccncc1/C=C/C(=O)N(C)c1cn[nH]c1	752503549	SNPHNDJSKZJVAH-ONEGZZNKSA-N	242.282	1.789	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)CC(C)(C)O)c1	862755904	MYJCSDAIXOQWNE-UHFFFAOYSA-N	237.299	1.478	10	20	BDCD	
Cc1cccc(O)c1CN1CC(=O)N[C@@H](C)C1	877567111	GOMOKKHXHKRWPL-JTQLQIEISA-N	234.299	1.021	10	20	BDCD	
CC1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)C1	790236537	HHEPTPUUILTPST-GQCTYLIASA-N	247.294	1.979	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](O)C(C)C)c1	164696528	LZQOXKWXVRTJAS-CYBMUJFWSA-N	239.315	1.507	10	20	BDCD	
COc1ccc(O)c(CNC(C)(C)CCO)c1	164702745	RKEZHKBQDFYASJ-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
OCC1(CNCc2ccc3c(c2)CCCO3)CC1	258852941	GDWPPFCMJOSCGH-UHFFFAOYSA-N	247.338	1.874	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H](CC(N)=O)C1	877534754	GWLQLBDDLDVGNX-LLVKDONJSA-N	248.326	1.398	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2COC[C@@H]2C)c1	710878287	XIEARKWQNSFWOL-JOYOIKCWSA-N	237.299	1.525	10	20	BDCD	
C[C@H](O)[C@@H](C)NCc1ccc2c(c1)CCCN2C	395765770	YEMBGUKDUGOVLH-NEPJUHHUSA-N	248.370	1.928	10	20	BDCD	
CCN(C)C(=O)CNCc1cc(F)ccc1O	187675986	DGAPRCGSBIYFTE-UHFFFAOYSA-N	240.278	1.099	10	20	BDCD	
NC(=O)CCNCc1ccc(N2CCCC2)cc1	37262024	ZXNJOSWAXHMSHA-UHFFFAOYSA-N	247.342	1.252	10	20	BDCD	
Cc1cccc(CN2CCC[C@H]2CO)c1O	132494608	COAOLCAPPABMIQ-LBPRGKRZSA-N	221.300	1.657	10	20	BDCD	
COCCOCCNCc1ccccc1O	44693457	HWGCMIHEOIAAFR-UHFFFAOYSA-N	225.288	1.145	10	20	BDCD	
C[C@H](N[C@H](C)c1ccccc1O)C(=O)O	49353269	APSSINNZPFUMQH-SFYZADRCSA-N	209.245	1.516	10	20	BDCD	
CCOCCCC(=O)NCc1ccccc1O	133755562	PPEJCCHVYDMMJS-UHFFFAOYSA-N	237.299	1.825	10	20	BDCD	
COc1cccc(CN2CC[C@@H](CO)C2)c1O	92764289	XYEWNBROQCPQAN-SNVBAGLBSA-N	237.299	1.215	10	20	BDCD	
CCOc1ccc(CN(C)[C@H](C)CO)c(O)c1	809746746	ZZPIJSBDXLWBIM-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
C[C@]1(NCc2cccc(F)c2O)CCOC1=O	290936469	PJLPAFADVRAFRK-LBPRGKRZSA-N	239.246	1.327	10	20	BDCD	
C[C@@H](CCCCO)NCCc1ccc(N)cc1	817958465	WFYAFYVJKJUHRM-LBPRGKRZSA-N	236.359	1.952	10	20	BDCD	
Cc1cccc(O)c1CN1CCN(C)CC1	876510242	RQTMIXWRCCLQMZ-UHFFFAOYSA-N	220.316	1.448	10	20	BDCD	
COC1CN(Cc2cccc(C)c2O)C1	839131087	MMIQXGGZONQLAU-UHFFFAOYSA-N	207.273	1.531	10	20	BDCD	
CC(C)(O)C1CN(C(=O)c2cc(O)cs2)C1	782077421	CYXFXAQAFDEYFX-UHFFFAOYSA-N	241.312	1.297	10	20	BDCD	
CCOCCNCc1cc(F)cc(F)c1O	708437238	QEOJWEFKSDKAGT-UHFFFAOYSA-N	231.242	1.797	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)C[C@@H]1CN	1205317940	QXLSHAPMSMURMJ-AAEUAGOBSA-N	233.359	1.686	10	20	BDCD	
O=C(OCCF)c1cccc(O)c1O	803441064	YKUOGBARUWSJLF-UHFFFAOYSA-N	200.165	1.224	10	20	BDCD	
O=C1OCC[C@@H]1NCc1cc(Cl)ccc1O	19876509	VNAQZTJQGILREH-VIFPVBQESA-N	241.674	1.451	10	20	BDCD	
C[C@@H](Sc1ncc([N+](=O)[O-])s1)C(=O)O	226765865	RKKYYVZDDNNSTO-GSVOUGTGSA-N	234.258	1.617	10	20	BDCD	
O=C(c1cccc(O)c1O)N(C1CC1)C1CC1	862851169	CJGBUZFRKNUYMG-UHFFFAOYSA-N	233.267	1.865	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC=CCC1	166067619	ABQXYINQLHKZDD-UHFFFAOYSA-N	219.240	1.500	10	20	BDCD	
COc1ccc(N(C)CC(=O)N2CCCC2)cc1	844352693	CRYCXIFUCDBGJQ-UHFFFAOYSA-N	248.326	1.754	10	20	BDCD	
COc1cccc(CNCC[C@H](C)OC)c1O	263831254	VINWYZUYBITWRJ-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
Cc1nnc(CCNCc2ccccc2O)s1	289728224	FZOSRIMLKKHOOE-UHFFFAOYSA-N	249.339	1.884	10	20	BDCD	
COC[C@H]1CCCN1C(=O)Nc1ccc(N)cc1	696512744	QDZIGDQTXVPSFK-GFCCVEGCSA-N	249.314	1.912	10	20	BDCD	
Cc1noc(CN(C)Cc2ccc(N)cc2)n1	1334755168	YRWPNUMYHKENRS-UHFFFAOYSA-N	232.287	1.592	10	20	BDCD	
CN(Cc1ccccc1O)CC1(C(=O)O)CC1	1598530416	FXTWHRNSCVAJDA-UHFFFAOYSA-N	235.283	1.689	10	20	BDCD	
C[C@@H](O)C[C@@H](C)NCc1cc(F)ccc1O	228836350	YJNRWBIHWFAMPE-RKDXNWHRSA-N	227.279	1.780	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCCNCC1	162941512	PZELZDNXQQTQSV-LBPRGKRZSA-N	220.316	1.624	10	20	BDCD	
CNCCN[C@H](C)c1c(C)cc(C)cc1O	817951890	KWIZQGOYILCVAH-LLVKDONJSA-N	222.332	1.879	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC2CNC2)c1	817955480	BUCIRZXNTRQNPH-MRVPVSSYSA-N	222.288	1.023	10	20	BDCD	
Nc1ccc(CCNC[C@@H](N)CC(F)F)cc1	903917350	LLEXJOORUUIPBO-NSHDSACASA-N	243.301	1.383	10	20	BDCD	
Cc1cc(O)c(CN(C)C2CNC2)cc1C	843124987	UZCVHGZSHRGUSJ-UHFFFAOYSA-N	220.316	1.413	10	20	BDCD	
C[C@H](O)CCOc1ccc(N(C)C)cc1	842044119	QRTNTRDFEZTHME-JTQLQIEISA-N	209.289	1.902	10	20	BDCD	
COC[C@H]1CCCN1C(=O)c1cc(O)cs1	752821473	VADCQDGGGMBREF-MRVPVSSYSA-N	241.312	1.705	10	20	BDCD	
CC(=O)C1=NN(c2cc(F)ccc2C)C(=O)C1	871959991	SMZPPNVWLYYVDX-UHFFFAOYSA-N	234.230	1.816	10	20	BDCD	
COc1cc(C)cc(CNC[C@H](C)O)c1O	894359466	PNZGJBMQKBSBHZ-VIFPVBQESA-N	225.288	1.180	10	20	BDCD	
CCOC(=O)CN1CCCc2cc(CN)ccc21	700970491	YVBXJWJKLXCLBI-UHFFFAOYSA-N	248.326	1.461	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)[C@@H](C)CO1	223160666	VEUCBBYBKGZDDZ-QWRGUYRKSA-N	220.316	1.878	10	20	BDCD	
Cc1cccc(CN[C@]2(C)CCOC2)c1O	162714948	SLBMBEVPMVSCRU-CYBMUJFWSA-N	221.300	1.969	10	20	BDCD	
CC(=O)NCCN(C)Cc1c(C)cccc1O	877606377	ZHFOHQVXGNAKNY-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CO[C@H]1COC[C@@H]1NCc1cc(C)ccc1O	289900489	UBRLGSMQOKPAMB-AAEUAGOBSA-N	237.299	1.204	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C[C@H]1CCOC1	180242095	FPOAFWPJMYACFK-SNVBAGLBSA-N	239.290	2.000	10	20	BDCD	
CN[C@H](C)CCNCc1cc(C)ccc1O	1261370419	JABKTMMOERXPPL-LLVKDONJSA-N	222.332	1.788	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@H](C)CN)c1	817966897	YBJFFPQBBAMXQT-ZJUUUORDSA-N	208.305	1.698	10	20	BDCD	
CN(CCCN)Cc1cc(Cl)cc(F)c1O	843051321	WOSXXBJPJOXTPC-UHFFFAOYSA-N	246.713	1.965	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@H](O)C2)cc1F	850417627	GIDDLBATGHDPAM-XYPYZODXSA-N	238.306	1.505	10	20	BDCD	
Cc1ccc(CNC/C=C/CO)c(O)c1	877624060	IFYBJGIXTDUVON-NSCUHMNNSA-N	207.273	1.339	10	20	BDCD	
C[C@H]1C[C@@H](O)CN1Cc1cc(F)ccc1O	788270027	OIUGDDMGNQZWJU-GZMMTYOYSA-N	225.263	1.486	10	20	BDCD	
CCOC[C@H]1CCCN1C(=O)CN=[N+]=[N-]	409424672	CQOKHLHIWUEJSX-MRVPVSSYSA-N	212.253	1.324	10	20	BDCD	
Nc1ccc(CN2CC[C@]3(CCOC3)C2)cc1	707630092	GLFRGMBTGMGIJM-AWEZNQCLSA-N	232.327	1.881	10	20	BDCD	
N[C@H]1CC[C@H](C(=O)NCc2ccccc2O)CC1	710933442	VGTXFGYIJJJKDM-UMSPYCQHSA-N	248.326	1.526	10	20	BDCD	
Cc1ccc(CN2CCn3cnnc3C2)c(O)c1	876708383	OLTNLBDEVBLVIW-UHFFFAOYSA-N	244.298	1.308	10	20	BDCD	
CC(C)NC(=O)CN(C)Cc1ccc(N)cc1	35360386	NGXHTACNJNKSII-UHFFFAOYSA-N	235.331	1.225	10	20	BDCD	
CC[C@@H](O)[C@H](C)C(=O)NCc1ccccc1O	822576124	JHUGAJSXYYVZLL-GXSJLCMTSA-N	237.299	1.415	10	20	BDCD	
CC(=O)N1CC[C@@H](NCc2cccc(C)c2O)C1	857068628	CEXZZVYBYRHXCL-CYBMUJFWSA-N	248.326	1.411	10	20	BDCD	
CCN(CCN)Cc1cc(C)c(C)cc1O	863644576	ATLRNNJDGAZWFS-UHFFFAOYSA-N	222.332	1.790	10	20	BDCD	
C[C@H](N)[C@H](C)C(=O)N[C@H](C)c1ccccc1O	870988341	MTFFTBCUXMCUJH-LPEHRKFASA-N	236.315	1.553	10	20	BDCD	
c1cc2c(cc1CN[C@@H]1CCCNC1)CCO2	84516338	XHDMOMAWLFUTIR-CYBMUJFWSA-N	232.327	1.463	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccc(N)cc2)CCOC1	687356139	DPEVGADFMQHMNC-CYBMUJFWSA-N	234.299	1.312	10	20	BDCD	
Cc1cccc(CN[C@@H](C)CCCO)c1O	162871125	CNYMVTRAUMSNSG-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)C[C@@H](C)N1	201355854	SKSZCTZKEAAKHM-PHIMTYICSA-N	219.332	1.451	10	20	BDCD	
CS[C@@H](C)C(=O)NCCc1ccc(N)cc1	152482274	JVZNEQVUSQFGJO-VIFPVBQESA-N	238.356	1.679	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H](CN)C2)cc1	50245221	AVHGSBPQJOVSIQ-CYBMUJFWSA-N	233.359	1.533	10	20	BDCD	
CCNC(=O)[C@@H](C)N[C@H](C)c1ccccc1O	36795287	XTLQJXHIAIUBPV-NXEZZACHSA-N	236.315	1.567	10	20	BDCD	
COc1cc(C)cc(CN(C)CC(=O)O)c1O	39193020	IFBJUVYBXRKFRE-UHFFFAOYSA-N	239.271	1.226	10	20	BDCD	
CNCC(=O)NCc1ccc(N2CCCC2)cc1	195171597	GBABAMSCOPOBDW-UHFFFAOYSA-N	247.342	1.122	10	20	BDCD	
Cc1cccc(CN2CC[C@H](O)[C@@H](C)C2)c1O	250090621	QDTPTECCMUAFOU-AAEUAGOBSA-N	235.327	1.903	10	20	BDCD	
Cc1cc(O)c(CN(CCO)C2CC2)cc1C	271079218	QEHMFXPSJNDUOD-UHFFFAOYSA-N	235.327	1.966	10	20	BDCD	
N[C@@H](CNCc1cccc(F)c1O)C1CC1	841048559	FDFREPAAMTYVFJ-NSHDSACASA-N	224.279	1.358	10	20	BDCD	
C[C@@H]1CCN[C@@H](C(=O)Nc2ccc(N)cc2)C1	841846293	OYXOIHZAAPBHGV-BXKDBHETSA-N	233.315	1.595	10	20	BDCD	
CC(C)(N)CCNC(=O)Cc1ccc(N)cc1	1353124972	CJVWZPJKUNIOCE-UHFFFAOYSA-N	235.331	1.055	10	20	BDCD	
CC[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@@H]1O	760978879	CRLMGALHHGWRGG-APPZFPTMSA-N	241.312	1.297	10	20	BDCD	
CCOc1ccc(CN2CC(C)(O)C2)c(O)c1	877581115	OCLIVBREHUVDLW-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
C[C@@H]1CCN[C@H](C(=O)N(C)c2ccc(N)cc2)C1	877076703	UDDXLQQQDSQLFI-MFKMUULPSA-N	247.342	1.620	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H](C)[C@@H](O)C1	897684685	VDMZRTZDZTXBSP-SKDRFNHKSA-N	237.299	1.213	10	20	BDCD	
C[C@H]1C[C@H]1C(=O)NCc1ccc(N)cc1	37666215	FVFXTUYJYHSRIN-GZMMTYOYSA-N	204.273	1.541	10	20	BDCD	
C[C@@H](O)[C@H]1CCCN(c2ccc(N)cc2)C1	409434018	ZOWURHCKYJJOEL-MNOVXSKESA-N	220.316	1.866	10	20	BDCD	
C[C@H](N[C@@H]1CCCN(C)C1=O)c1ccccc1O	707764252	ZUKHDPDGGBZLLL-CMPLNLGQSA-N	248.326	1.664	10	20	BDCD	
COC[C@@H](CCO)NCc1cc(F)ccc1O	226610309	XYNOWUGMXRZYGU-LLVKDONJSA-N	243.278	1.018	10	20	BDCD	
N[C@@H]1CCC[C@@H]1C(=O)N1Cc2cccc(O)c2C1	1580375728	CTIFZIGXVJVVQP-CMPLNLGQSA-N	246.310	1.362	10	20	BDCD	
C[C@H]1CNCc2c1cnn2-c1ccc(N)cc1	1898234660	MQRICJSZOOJSAR-VIFPVBQESA-N	228.299	1.661	10	20	BDCD	
COC[C@H](CCO)NCc1ccc(C)cc1O	877050410	ZQQXPGJSUOJOCX-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
Oc1ccc(F)cc1CN1[C@H]2CC[C@H]1COC2	695061446	SYNBLUMIEMVNQP-RYUDHWBXSA-N	237.274	1.895	10	20	BDCD	
Cc1nc([C@H](C)NCc2cccc(C)c2O)n[nH]1	392361925	CCYCOCHYUAFRDC-VIFPVBQESA-N	246.314	1.978	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@H]1C[C@H](O)C1	827827196	QHNCVLLUKRDOEW-KYZUINATSA-N	227.691	1.659	10	20	BDCD	
Nc1ccc(-n2ncc3c2CNCC3)cc1	259321070	JSURFTUAHSQLRS-UHFFFAOYSA-N	214.272	1.100	10	20	BDCD	
COC[C@H](C)NCc1cc(C)ccc1O	70954769	CWBMBRFQIDVQET-JTQLQIEISA-N	209.289	1.825	10	20	BDCD	
O=C(NCC1=CCCOC1)c1cc(O)cs1	807849830	DOVCTTDRZSTSOD-UHFFFAOYSA-N	239.296	1.530	10	20	BDCD	
O=C(O)[C@]1(F)CCN(Cc2ccccc2O)C1	901515403	LVTJNLQQBBPOHG-LBPRGKRZSA-N	239.246	1.391	10	20	BDCD	
CN(C)c1ccc(CNCCCON)cc1F	904457156	PCOUWUCPTRBDFA-UHFFFAOYSA-N	241.310	1.262	10	20	BDCD	
CN(C(=O)C[C@H](N)C1CC1)c1ccc(N)cc1	877077538	MBMLEFOQXLSDIH-LBPRGKRZSA-N	233.315	1.359	10	20	BDCD	
Cc1cccc(O)c1CN1CC(C(=O)O)C1	1605345101	VJZAJFMPUJYAOE-UHFFFAOYSA-N	221.256	1.217	10	20	BDCD	
C[C@H](N[C@H](C)CC(N)=O)c1cc(F)ccc1O	168830413	DSQBONJJNUCYSL-SFYZADRCSA-N	240.278	1.446	10	20	BDCD	
COCCOC(=O)c1cc(O)cs1	308376881	SRPZDBZXTKWSJT-UHFFFAOYSA-N	202.231	1.257	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C[C@H](O)C2)c1	850417524	BLYBOACRYWYIRB-XYPYZODXSA-N	207.273	1.314	10	20	BDCD	
CON(C)CCN[C@@H]1CCc2cccc(O)c21	850476913	CMFSBEBDTQIVHI-LLVKDONJSA-N	236.315	1.462	10	20	BDCD	
O=C(NOC/C=C/Cl)c1cc(O)cs1	812405319	WERRBWZGDWQGIF-OWOJBTEDSA-N	233.676	1.868	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1cc(F)ccc1O	824533277	COGCNRULADXUIM-NSHDSACASA-N	227.279	1.734	10	20	BDCD	
CN(CCOCC(F)F)c1ccc(N)cc1	863558593	OMXJGMCUIVRAMH-UHFFFAOYSA-N	230.258	1.987	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC(CF)CC1	409430652	QYXCTLXHKOFBSA-UHFFFAOYSA-N	200.217	1.505	10	20	BDCD	
O=C(O)c1cnc(SCC(=O)C2CC2)s1	1602537633	YIBLBFKBNGIUQL-UHFFFAOYSA-N	243.309	1.913	10	20	BDCD	
COCc1cc(CNCc2ccc(N)cc2)no1	1579091397	MTFWBCVGYCKQNF-UHFFFAOYSA-N	247.298	1.693	10	20	BDCD	
COC(=O)C1(CNCc2ccccc2O)CC1	188670754	HOJBZJMKQGMEDQ-UHFFFAOYSA-N	235.283	1.435	10	20	BDCD	
COc1ccc(CN[C@H]2CO[C@H](C)C2)c(O)c1	402008146	AHVRCDDEPMPJDJ-MWLCHTKSSA-N	237.299	1.668	10	20	BDCD	
CN1CC[C@@H](N[C@H]2CCc3cccc(O)c32)C1	380211685	HYELYVPSKVIFFA-NEPJUHHUSA-N	232.327	1.673	10	20	BDCD	
OCC[C@@H](NCc1ccccc1O)C(F)(F)F	886371507	NOQCKWODVPXFIW-SNVBAGLBSA-N	249.232	1.795	10	20	BDCD	
Cc1ccc(C(=O)NCCC2CC2)c(O)c1O	182520860	GZOXHLHCRUVSCN-UHFFFAOYSA-N	235.283	1.936	10	20	BDCD	
C[C@@H]1CN(Cc2c(O)cccc2Cl)CCN1	128336814	QDMNEOBDCVAPLN-SECBINFHSA-N	240.734	1.839	10	20	BDCD	
COc1ccc2c(c1)CCCN2CC(=O)O	84781861	ZKHMTXVPZQZSET-UHFFFAOYSA-N	221.256	1.532	10	20	BDCD	
Nc1ccc(CNC(=O)COCC2CC2)cc1	296831827	BFDKGXPFQKEGMJ-UHFFFAOYSA-N	234.299	1.312	10	20	BDCD	
C[C@H](CCCN)NC(=O)Cc1ccc(N)cc1	834812999	BEOONRPPKKSLIP-SNVBAGLBSA-N	235.331	1.055	10	20	BDCD	
C[C@@H](O)CCOc1ccc(N(C)C)cc1	842044121	QRTNTRDFEZTHME-SNVBAGLBSA-N	209.289	1.902	10	20	BDCD	
C[C@H](CCO)N(C)Cc1cc(F)ccc1O	846111579	QVZWXEBWHZCBNT-SECBINFHSA-N	227.279	1.734	10	20	BDCD	
CNC[C@@H](C)CN[C@H]1CCc2cccc(O)c21	1118122433	WTXWLGFKGBANEA-PWSUYJOCSA-N	234.343	1.825	10	20	BDCD	
Nc1ccc(N2CC(F)(F)C[C@H]2CO)cc1	409425170	AAGZARSDXOYBBB-JTQLQIEISA-N	228.242	1.475	10	20	BDCD	
COc1ccc(CN[C@H]2CCCNC2)cc1C	84529865	WSRUNZXHQQNQOR-ZDUSSCGKSA-N	234.343	1.845	10	20	BDCD	
CC(C)(O)CNCc1cc(F)cc(F)c1O	708438593	WXEIKPDGURZYAT-UHFFFAOYSA-N	231.242	1.531	10	20	BDCD	
Nc1ccc(CN2CCC3(CCNC3)CC2)cc1	1337838758	SMOVKVYAMPGRMP-UHFFFAOYSA-N	245.370	1.844	10	20	BDCD	
CC[C@@H](O)CNCc1ccc2c(c1)CCCO2	922246965	YDQJFDRTQJVWJR-CYBMUJFWSA-N	235.327	1.872	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](C(N)=O)C2)c(O)c1	876522912	GGZBIDMQKNNZDW-LLVKDONJSA-N	234.299	1.008	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1ccn(C)n1	383639573	MPZKZMXNLFAATD-UHFFFAOYSA-N	245.282	1.398	10	20	BDCD	
COc1ccc(O)c(CNC2([C@@H](C)O)CC2)c1	827585276	DNBDZOYFMBCWHO-SECBINFHSA-N	237.299	1.404	10	20	BDCD	
COCCC(=O)NCc1cc(OC)ccc1O	114543950	SLXQXQNQEPUHIE-UHFFFAOYSA-N	239.271	1.054	10	20	BDCD	
COc1cccc(CNC(=O)[C@H]2C[C@H]2C)c1O	68488613	YLAVUKZVOIRKRU-SCZZXKLOSA-N	235.283	1.673	10	20	BDCD	
CC[C@H](COC)NCc1ccccc1O	70625070	WCUWUYYMGRCPAH-LLVKDONJSA-N	209.289	1.907	10	20	BDCD	
NC[C@@H]1CCCC[C@H]1NCc1ccccc1O	228406645	RPWJMAPCRFJOJS-WCQYABFASA-N	234.343	1.999	10	20	BDCD	
O=C(NCc1ccccc1O)c1cccc(=O)[nH]1	236562824	QZKBVBUKKHZXEV-UHFFFAOYSA-N	244.250	1.011	10	20	BDCD	
Cc1cccc(CNC[C@H]2CCN2C)c1O	712537581	FEOMFWGMFGZNJF-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
CNCCCN[C@@H](C)c1cc(F)cc(F)c1O	817940460	MTAXKBGKAVSHKL-QMMMGPOBSA-N	244.285	1.931	10	20	BDCD	
COc1cccc(CNC(=N)NC(C)C)c1O	849002923	ZYAWYIKEYAWHCU-UHFFFAOYSA-N	237.303	1.423	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CC12CCNCC2	841079754	NGKJRXXRQGLBMU-CYBMUJFWSA-N	232.327	1.624	10	20	BDCD	
Nc1ccc(NC[C@]23CNC[C@@H]2C3)cc1	853246857	VIAKOCKKIUMRLO-CABZTGNLSA-N	203.289	1.290	10	20	BDCD	
CN(C[C@H]1CCNC1)c1ccc(N)cc1	863556565	UJEIYBCKGXROGI-JTQLQIEISA-N	205.305	1.315	10	20	BDCD	
COC[C@H](O)CN[C@@H](C)c1ccccc1O	70589894	GCLLXKUDJSCVBT-VHSXEESVSA-N	225.288	1.050	10	20	BDCD	
CCCN(Cc1ccccc1O)C[C@H](C)O	194949269	DGHLEDRPVCJGIE-NSHDSACASA-N	223.316	1.985	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@H]1C[C@H]1F	1352304145	ZZRYTVXGKHZTAL-DTWKUNHWSA-N	225.219	1.072	10	20	BDCD	
CC(C)[C@@H](NCc1ccccc1O)C(=O)O	13905691	CNFJXXOHJSQWDI-LLVKDONJSA-N	223.272	1.591	10	20	BDCD	
COc1ccc(O)c(CNCc2cn(C)cn2)c1	808390293	QEVLOACTMAXJQD-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
CCN1C[C@@H](NCc2c(C)cccc2O)CC1=O	877567536	NWDIFXVPPYNSOM-NSHDSACASA-N	248.326	1.411	10	20	BDCD	
COCC[C@H](C)NCc1cccc(OC)c1O	112018149	QYDBBYNGCVVGNN-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
C/C=C/C[C@@H](CO)NCc1ccccc1O	185818603	AZZTZHCQGAJKSE-JDGPPOGSSA-N	221.300	1.809	10	20	BDCD	
CC(C)[C@@H](CO)N[C@H]1CCc2cccc(O)c21	297527032	DJYNSFJEIMFFDT-NWDGAFQWSA-N	235.327	1.986	10	20	BDCD	
O=S1(=O)CC[C@@H](CSc2nccs2)C1	278576240	CXYFPASELFHXAT-ZETCQYMHSA-N	249.382	1.670	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@H](C)CO)cc1C	289473931	PUNBPTHWLOEYEX-LLVKDONJSA-N	223.316	1.822	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNc1ncn(C)n1	840884608	NMTSCIVSRGSFON-UHFFFAOYSA-N	245.330	1.802	10	20	BDCD	
CC[C@@](C)(CO)NCc1cc(F)cc(F)c1O	708486927	STFJFACSQXDOPT-LBPRGKRZSA-N	245.269	1.921	10	20	BDCD	
CN(CCCCCO)C(=O)c1cc(O)cs1	791018909	ZIMZTMAUYAJFJX-UHFFFAOYSA-N	243.328	1.688	10	20	BDCD	
CCc1n[nH]c(NC(=O)c2cc(O)cs2)n1	1333804922	LQEKZEQJGXEFIQ-UHFFFAOYSA-N	238.272	1.387	10	20	BDCD	
CCN[C@@H](C)c1cc(C(=O)O)ccc1O	1596491180	ORWFOEGOAOFRHC-ZETCQYMHSA-N	209.245	1.761	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CCOC2)c1O	162827620	SLYUTELQIVDTRK-NSHDSACASA-N	221.300	1.827	10	20	BDCD	
C[C@@H](NC(=O)C1(N)CCC1)c1ccccc1O	1118992483	KYAVOJGJKGFKOU-SECBINFHSA-N	234.299	1.451	10	20	BDCD	
CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O	134909917	PSCAYKCELQPJHZ-SSDOTTSWSA-N	210.233	1.971	10	20	BDCD	
CONC(=O)NCc1ccc(N2CC=CC2)cc1	125080793	XFWZUGWTCRHTRG-UHFFFAOYSA-N	247.298	1.423	10	20	BDCD	
COCC[C@@H](C)NC(=O)Cc1ccc(N)cc1	81704194	GZPSTYIUYAGJLW-SNVBAGLBSA-N	236.315	1.353	10	20	BDCD	
Cc1ccc(O)c(CNc2n[nH]c(C)n2)c1	295931017	KGZPYKHQTWZQIU-UHFFFAOYSA-N	218.260	1.739	10	20	BDCD	
Cc1cc(C)c(O)c(CN2C[C@H]3C[C@H]2C(=O)O3)c1	840111889	WDAOSHQFBFMMTH-NEPJUHHUSA-N	247.294	1.509	10	20	BDCD	
Cc1cc(O)c(CN2CCNC[C@@H]2C)cc1C	843047843	YLUNOWCAHNRCLW-LBPRGKRZSA-N	234.343	1.803	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCCN1C)c1ccccc1O	827936828	DARVTNUONIKZOJ-ZYHUDNBSSA-N	248.326	1.664	10	20	BDCD	
O=C(OCCCCO)c1cccc(O)c1O	758574018	YDCJYPSWPJQSDP-UHFFFAOYSA-N	226.228	1.027	10	20	BDCD	
O=C(N[C@@H](CCO)C1CC1)c1cc(O)cs1	764707526	WVIGQBUYDSSXIX-VIFPVBQESA-N	241.312	1.345	10	20	BDCD	
Cc1cccc(O)c1CN1CCC[C@H](O)C1	876528376	WHCNWVDMYNRHMO-NSHDSACASA-N	221.300	1.657	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@@H]1CCC[C@H]1O	689861239	JJKUXYAEPRIDKJ-GXTWGEPZSA-N	234.343	1.862	10	20	BDCD	
CC[C@H](OC)C(=O)NCc1cccc(O)c1O	1349079215	MGCZHCYAUCIOJE-JTQLQIEISA-N	239.271	1.139	10	20	BDCD	
CC[C@@H](F)C(=O)NCc1ccccc1O	1353616816	CWEHQKMSVFCUBS-SECBINFHSA-N	211.236	1.757	10	20	BDCD	
CN(C(=O)[C@H]1CCCCCN1)c1ccc(N)cc1	1352849741	MGUWZEWCXUZAEN-CYBMUJFWSA-N	247.342	1.764	10	20	BDCD	
O=C(NCc1ccccc1O)c1cncnc1	230903471	LUAQZTNUVZYMFF-UHFFFAOYSA-N	229.239	1.112	10	20	BDCD	
CC1(C)CN(C(=O)c2cccc(O)c2O)C1	309711553	KDDBOFDFVVLLON-UHFFFAOYSA-N	221.256	1.580	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@@H]2C[C@@H]2C1	699172572	JUTQLVFGCSXLKO-RKDXNWHRSA-N	233.267	1.580	10	20	BDCD	
C[C@H](NCC(F)(F)CO)c1ccccc1O	184699837	KDYHHEOWCGIOPK-QMMMGPOBSA-N	231.242	1.670	10	20	BDCD	
CN[C@@H]1CCN(Cc2cccc(OC)c2O)C1	128903347	QESXCKGNCGGCAM-LLVKDONJSA-N	236.315	1.195	10	20	BDCD	
COC[C@@H](C)CC(=O)Nc1ccc(N)cc1	87420390	KLSYFFRDIGKJMJ-VIFPVBQESA-N	222.288	1.880	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)CC[C@H]1O	249958453	JKRKDOHPOANPPD-CMPLNLGQSA-N	221.300	1.595	10	20	BDCD	
C[C@H](NC/C=C\CO)c1ccc(F)cc1O	717573926	ARGBCTVUMZFPOI-XADBCAIWSA-N	225.263	1.730	10	20	BDCD	
Cc1cc(O)c(CNC[C@H](C)O)cc1Cl	825378644	CQRBNXJOESQWQA-QMMMGPOBSA-N	229.707	1.824	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)[C@H]1CCN1	828144993	RRUQHDWUJSBWGS-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H]1[C@@H]2CNC[C@@H]21	841078955	FOKJTFPIYNUGMM-FICVDOATSA-N	245.370	1.368	10	20	BDCD	
Cc1c(NC(=O)c2cc(O)cs2)cnn1C	757436620	FXGVCLMDBWCXIA-UHFFFAOYSA-N	237.284	1.748	10	20	BDCD	
Cc1ccc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)c(O)c1	895780124	BNUHBMHTIXSZJB-YUTCNCBUSA-N	247.338	1.903	10	20	BDCD	
CS(=O)(=O)CCCSc1nccs1	102972277	JLHLIJYIHSGVAM-UHFFFAOYSA-N	237.371	1.670	10	20	BDCD	
Cc1nonc1CNCc1ccc2c(c1)CCO2	809744340	GZVYXBCWSLNVEX-UHFFFAOYSA-N	245.282	1.603	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H]1CC[C@@H](O)C1	877468776	MPXKOIGQVHSBHJ-VXGBXAGGSA-N	235.327	1.951	10	20	BDCD	
CC(F)(F)CCNC(=O)c1cccc(O)c1O	294097119	BQGXZMOCTNOEBZ-UHFFFAOYSA-N	245.225	1.873	10	20	BDCD	
COc1ccc(N(C)CC(C)=O)c(OC)c1	258891430	JNDXQBSYGLVJOI-UHFFFAOYSA-N	223.272	1.729	10	20	BDCD	
CO[C@H]1COC[C@@H]1N[C@@H](C)c1ccccc1O	290214427	QFSQDXWWDBEWHG-GAFUQQFSSA-N	237.299	1.457	10	20	BDCD	
COc1cccc(O)c1CNCc1nonc1C	809744366	HXTAOYGKUSEMPV-UHFFFAOYSA-N	249.270	1.382	10	20	BDCD	
C[C@H](NC[C@H](C)CN)c1cc(F)cc(F)c1O	817961664	BXTVQJUKHQXSBW-SFYZADRCSA-N	244.285	1.916	10	20	BDCD	
C/C(=C/CN(C)Cc1ccccc1O)C(=O)O	825729642	JAUUHHGQXQKYNT-YFHOEESVSA-N	235.283	1.855	10	20	BDCD	
C/C(=C/CN(C)c1ccc2c(c1)OCO2)C(=O)O	833382803	LQYWQJBSVMOTMS-UITAMQMPSA-N	249.266	1.882	10	20	BDCD	
OC[C@@H](CCF)NCc1cc(F)ccc1O	846097096	DNBFWFRWSDIUOO-SNVBAGLBSA-N	231.242	1.341	10	20	BDCD	
COC[C@@H](C)N1CCCc2cc(CN)ccc21	700879615	OJKQPAWWOHWKSY-LLVKDONJSA-N	234.343	1.933	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC(C(F)F)C1	764731675	LIJGGQUUOLAOSZ-UHFFFAOYSA-N	233.239	1.791	10	20	BDCD	
CC[C@H]1NCC[C@H]1C(=O)NCc1ccc(N)cc1	1122535811	IIEQYOQRWWPYLP-CHWSQXEVSA-N	247.342	1.273	10	20	BDCD	
CCN[C@H](CC)c1cccc(-c2nn[nH]n2)c1O	1590745657	LOSFDXKRSYHGHU-SNVBAGLBSA-N	247.302	1.633	10	20	BDCD	
Cc1cc(-c2cccnc2)cc(=O)n1C	536949396	ANQLIRRRBYWTMW-UHFFFAOYSA-N	200.241	1.756	10	20	BDCD	
CCn1cc(CNCc2cc(C)ccc2O)nn1	404485447	AZPSVURHFMYBGN-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
CC[C@@H](OC)C(=O)N[C@H](C)c1ccccc1O	827930896	UDTIBDRRXQPHFU-BXKDBHETSA-N	237.299	1.994	10	20	BDCD	
COC(=O)CN(C)Cc1cccc(OC)c1O	179395942	AWYSHDCUVIAGTD-UHFFFAOYSA-N	239.271	1.006	10	20	BDCD	
C/C=C\C(=O)NCc1ccc(N(C)C)cc1	211389473	PCPXLEODDNWHLT-PLNGDYQASA-N	218.300	1.945	10	20	BDCD	
C[C@@H](CN1CCCC1=O)NCc1ccccc1O	37782333	ZXBFRHASXCVETB-NSHDSACASA-N	248.326	1.493	10	20	BDCD	
CC[C@@](C)(OC)C(=O)NCc1ccccc1O	233989014	MCNSOXGKJOQSGG-CYBMUJFWSA-N	237.299	1.824	10	20	BDCD	
CN(Cc1ccccc1O)CC(C)(C)CO	294766636	JRXPFICBGJMXAV-UHFFFAOYSA-N	223.316	1.843	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H]1O	271353992	QACQIIMMPJLHIZ-ZFWWWQNUSA-N	248.370	1.955	10	20	BDCD	
CC[C@H]1CN(Cc2cc(C)ccc2O)C[C@H]1O	271408762	WZSGUNHIKIWNIY-SMDDNHRTSA-N	235.327	1.903	10	20	BDCD	
Oc1ccc(F)cc1CN1CC2(CCOC2)C1	293933996	HQVVTPIXNJVJTD-UHFFFAOYSA-N	237.274	1.754	10	20	BDCD	
O=C(NCc1cc[nH]n1)c1cc(O)cs1	732270426	CFNFHELRLUKQEK-UHFFFAOYSA-N	223.257	1.107	10	20	BDCD	
CC(=O)C(=O)CSc1ncc(C)cc1C	849989657	SZKVCOOGXKZFDL-UHFFFAOYSA-N	223.297	1.949	10	20	BDCD	
COc1cccc([C@@H](C)NCC(C)(C)O)c1O	846148191	YBHUZFSEMVBQDK-SECBINFHSA-N	239.315	1.822	10	20	BDCD	
CC(C)OCCOC(=O)c1cccc(O)c1O	779466929	YWBCNFYCWGLWJC-UHFFFAOYSA-N	240.255	1.680	10	20	BDCD	
C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1O	897684876	YHTRMTLNWXJSSK-PRHODGIISA-N	241.718	1.858	10	20	BDCD	
C[C@@H]1CN(c2ccc(N)cc2)C[C@@H]1CO	409433728	ZBTSKTOTORIABK-NXEZZACHSA-N	206.289	1.333	10	20	BDCD	
Cc1nnc(CN[C@H](C)c2ccccc2O)o1	718882458	SYGQHINQRYGFSM-MRVPVSSYSA-N	233.271	1.934	10	20	BDCD	
CCc1cccc(CNCC(C)(C)O)c1O	691482731	OJYFILSCVKRJQA-UHFFFAOYSA-N	223.316	1.815	10	20	BDCD	
Cc1noc(C)c1C(=O)NCc1ccccc1O	133795133	YBJWHLFVPAPQDG-UHFFFAOYSA-N	246.266	1.927	10	20	BDCD	
Cc1cccc(O)c1CNCC(C)(C)C(=O)O	1600543443	WVQOGVXKDXNJKS-UHFFFAOYSA-N	237.299	1.901	10	20	BDCD	
CO[C@H]1CC[C@H](NC(=O)Cc2ccc(N)cc2)C1	234822083	DFSQQNWBROWMNB-STQMWFEESA-N	248.326	1.495	10	20	BDCD	
CO[C@@H]1CC[C@@H](NC(=O)Cc2ccc(N)cc2)C1	234815370	DFSQQNWBROWMNB-CHWSQXEVSA-N	248.326	1.495	10	20	BDCD	
C[C@H](NC(=O)NCCc1ccc(N)cc1)C1CC1	841506325	SCLRCTPKPMUNDO-JTQLQIEISA-N	247.342	1.909	10	20	BDCD	
Oc1ccccc1CN1CCC2(CCNCC2)C1	843120191	PUHSEXGTIYMWMT-UHFFFAOYSA-N	246.354	1.968	10	20	BDCD	
CC(C)[C@@H](Sc1nccs1)C(N)=O	308135126	DWRCOGQHCAJPMT-ZCFIWIBFSA-N	216.331	1.745	10	20	BDCD	
C[C@H](NCCN1CCCC1=O)c1ccccc1O	405402194	NNKRCBUEXIEPRO-NSHDSACASA-N	248.326	1.665	10	20	BDCD	
COc1cccc(CN[C@@H](C)C[C@@H](C)O)c1O	228085198	FFGGOSLVOCDFME-VHSXEESVSA-N	239.315	1.650	10	20	BDCD	
C[C@@]1(CO)CCCN(Cc2ccccc2O)C1	305744799	MDRXIMQYHDNWIN-CQSZACIVSA-N	235.327	1.987	10	20	BDCD	
Cc1cc(O)c(CN2CCNC(=O)[C@@H]2C)cc1C	123439667	MZOLEOIKMNEBCH-NSHDSACASA-N	248.326	1.329	10	20	BDCD	
CCOc1cccc(CN[C@H]2CCOC2)c1O	131160017	LXOCWNOPANIRLM-NSHDSACASA-N	237.299	1.669	10	20	BDCD	
CCO[C@H](C)C(=O)NCc1ccc(O)c(O)c1	269057948	AKRPWNQCXNOFSP-MRVPVSSYSA-N	239.271	1.139	10	20	BDCD	
CCN(CC(N)=O)Cc1ccc(N(C)C)c(C)c1	294649854	QMDUPFHHTRPRAG-UHFFFAOYSA-N	249.358	1.368	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC/C=C\CO)c1	717532690	OPYSXNVWTCHTFU-BYCRGOAPSA-N	221.300	1.900	10	20	BDCD	
Cc1cc(C)c([C@H](C)NCCCON)c(O)c1	902424170	JRQNQIOPCVSJNK-NSHDSACASA-N	238.331	1.940	10	20	BDCD	
CCOc1ccc(O)c(CN(C)[C@H](C)CN)c1	843051759	LKCFMTOOAMJHNS-SNVBAGLBSA-N	238.331	1.570	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@H](N)C2)cc1C	843047349	RKRZXGSWNKEHDR-LBPRGKRZSA-N	220.316	1.542	10	20	BDCD	
C[C@@H](O)[C@@H](N)c1cc(Cl)ccc1O	95659547	KCZAICOPPILPEW-MLUIRONXSA-N	201.653	1.426	10	20	BDCD	
NC1CN(Cc2cc(Cl)ccc2O)C1	83634592	YTJWSYKBCCNTNA-UHFFFAOYSA-N	212.680	1.189	10	20	BDCD	
CO[C@H]1CN(CCN=[N+]=[N-])C[C@H]1n1ccnc1	409435573	VLLSPEQZZXTPKS-ZJUUUORDSA-N	236.279	1.065	10	20	BDCD	
C[C@@H](N)[C@H]1CCCCN1Cc1ccc(N)cc1	1356082908	HMAWKOXSCSYRIL-BXUZGUMPSA-N	233.359	1.971	10	20	BDCD	
CC(C)[C@H](F)C(=O)NCc1cccc(O)c1O	1350300756	YAJOYWGMQUSVKD-JTQLQIEISA-N	241.262	1.708	10	20	BDCD	
O=C(O)c1cnc(SCCCCO)s1	1608979196	OEAJCMQDKZPGIW-UHFFFAOYSA-N	233.314	1.706	10	20	BDCD	
CC1(C)C[C@@H]1NC(=O)c1cccc(O)c1O	163273061	BNDBTGJYVSNQDC-VIFPVBQESA-N	221.256	1.626	10	20	BDCD	
CN(C)C(=O)CCNCc1ccc(N(C)C)cc1	37751397	MKMNWYBDLDQKAY-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@H]1CCOC1	401389266	RNLPPZXWDYUMJN-LLVKDONJSA-N	249.310	1.777	10	20	BDCD	
C[C@H](CNCc1ccccc1O)N(C)C1CC1	105488257	VBNXYEUSZNCLRU-LLVKDONJSA-N	234.343	1.965	10	20	BDCD	
NC(=O)COc1ccc(N2CCCC2)cc1	178191878	GGBGCEWEEXOXIZ-UHFFFAOYSA-N	220.272	1.151	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)CF)c1	290279744	YYWRAWUWYAAKBK-MRVPVSSYSA-N	213.252	1.848	10	20	BDCD	
CCOCC[C@H](O)CNc1ccccc1OC	819393721	HCFOBWYTEGGATQ-NSHDSACASA-N	239.315	1.895	10	20	BDCD	
C[C@@H]1CCN(C(=O)c2cc(O)cs2)C1	732283345	HOHUJMYTOWAUCT-SSDOTTSWSA-N	211.286	1.936	10	20	BDCD	
CC(C)OC(=O)CNC(=O)c1cc(O)cs1	732286976	KOPDBWIAFLMNEN-UHFFFAOYSA-N	243.284	1.135	10	20	BDCD	
C[C@H](CNC(=O)c1cc(O)cs1)CN(C)C	832565106	PGFXLJBKFQQFLM-MRVPVSSYSA-N	242.344	1.381	10	20	BDCD	
CC1(C)NCC[C@H]1NCc1cccc(F)c1O	841085447	CPAXBLWNDOXTIG-LLVKDONJSA-N	238.306	1.761	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@@H]1CC1(F)F	910943397	BOLMVGSKAIKCHK-QMMMGPOBSA-N	243.209	1.369	10	20	BDCD	
Cc1ccc(CN(C)CC2CC(O)C2)c(O)c1	877466113	XWLZLBVBXHWJSC-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
CN(Cc1ccccc1O)C[C@](C)(O)C(F)F	886064866	KDPAYUFCLGENJN-LBPRGKRZSA-N	245.269	1.840	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@H]2[C@@H](O)CC[C@H]2C1	895781279	MEXIJQXUBGQZBU-LNSITVRQSA-N	247.338	1.903	10	20	BDCD	
Oc1ccccc1CNC[C@H]1C[C@@H](O)C1	720907083	IZZMTCXTFOXUJU-JGZJWPJOSA-N	207.273	1.253	10	20	BDCD	
CCc1cccc(CN[C@H](C)CC(N)=O)c1O	691493317	JIBJZJSDJGUQKR-SECBINFHSA-N	236.315	1.308	10	20	BDCD	
CC(C)CNCC(=O)NCc1ccc(N)cc1	1515331748	GMCKJQGJYBNXOH-UHFFFAOYSA-N	235.331	1.131	10	20	BDCD	
NC(=O)C1(NCc2ccc3c(c2)CCCO3)CC1	893554349	VDCVFMQLUKBFFU-UHFFFAOYSA-N	246.310	1.119	10	20	BDCD	
Cc1cccc(CN[C@@H]2CO[C@@H](C)C2)c1O	402145568	NKGUQNRZVJWDFQ-JQWIXIFHSA-N	221.300	1.968	10	20	BDCD	
C[C@@H]1OCC[C@@H]1NCc1ccc2c(c1)CCO2	120821369	GJLMVLIBOKYEQM-GWCFXTLKSA-N	233.311	1.889	10	20	BDCD	
Cc1ccc(O)c(CNCCC(=O)N(C)C)c1	71408033	NIMKMVZRBGHSQL-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCCCO)c1	35628919	SKGOBVOLVAGQKA-SNVBAGLBSA-N	209.289	1.734	10	20	BDCD	
CC[C@H](N)C(=O)NCc1ccc(N(C)C)cc1	40825881	IXCMILYGPWOQQA-LBPRGKRZSA-N	235.331	1.106	10	20	BDCD	
Nc1ccc(CNC(=O)C2[C@@H]3CCC[C@@H]23)cc1	161546455	KOTBDPMCRMBPNV-VXGBXAGGSA-N	230.311	1.931	10	20	BDCD	
C[C@H](N[C@H]1CCN(C)C1)c1cc(F)ccc1O	94617859	QZUUWIWSDVNAGL-ONGXEEELSA-N	238.306	1.886	10	20	BDCD	
OCCCCN[C@H]1CCc2cccc(O)c21	296616447	YVRWHDKGTTXUQO-NSHDSACASA-N	221.300	1.742	10	20	BDCD	
CC[C@@H](C)NC(=O)c1c(F)ccc(O)c1O	276782995	ZRUNTPNMZPRFCF-ZCFIWIBFSA-N	227.235	1.765	10	20	BDCD	
CCN(CC)c1ccc(CN[C@@H]2CCNC2)cc1	841045618	ZCDZYVYGMCYQOM-CQSZACIVSA-N	247.386	1.984	10	20	BDCD	
Cc1cc(CN2CC[C@H](N)C2)ccc1N(C)C	923281768	PIRVMLVQUQQEEL-ZDUSSCGKSA-N	233.359	1.594	10	20	BDCD	
COc1ccc(N(C)Cc2cnon2)c(OC)c1	851864632	GKCOURIQMYZMPJ-UHFFFAOYSA-N	249.270	1.723	10	20	BDCD	
Cc1ccc(CN(C)Cc2nc[nH]n2)c(O)c1	876750356	VPUDTWROMXKCJT-UHFFFAOYSA-N	232.287	1.451	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@H](CO)C2(CCCC2)C1	409428936	HATBMZIFAIKERV-SECBINFHSA-N	238.291	1.308	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H]1CC[C@@H](O)C1	187985603	OAXBFHIXOVXFMX-BXKDBHETSA-N	239.290	1.782	10	20	BDCD	
CN(Cc1cc(F)cc(F)c1O)C1CNC1	708481666	SOWUKSRGVQZVHS-UHFFFAOYSA-N	228.242	1.074	10	20	BDCD	
C[C@H](CC(N)=O)NCc1ccc2c(c1)CCCO2	921863397	VGXVIWIVTBWWOJ-SNVBAGLBSA-N	248.326	1.365	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H]2CNC[C@H]2C1	876818588	WKZRCUCCIKCTFL-RYUDHWBXSA-N	232.327	1.352	10	20	BDCD	
CCn1cc(CNCc2ccc(C)cc2O)nn1	877627177	LBXMQOXYQXVWOY-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2COC[C@H]2C)c1	710878289	XIEARKWQNSFWOL-SKDRFNHKSA-N	237.299	1.525	10	20	BDCD	
COc1ccc(O)c(CNCc2n[nH]cc2C)c1	716455876	DNRVMVIMHNNPPE-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
c1cc2c(cc1CNCCCNC1CC1)CCO2	228410074	XXEHQVNOGKAMJZ-UHFFFAOYSA-N	246.354	1.853	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H]([C@H](C)N)C2)c1	228150968	RIACFKIKJZPWHG-NWDGAFQWSA-N	234.343	1.870	10	20	BDCD	
CN(C(=O)C[C@@H]1CCCO1)c1ccc(N)cc1	87205576	PFIKGDYIMDAEPF-LBPRGKRZSA-N	234.299	1.801	10	20	BDCD	
O=C1CN(Cc2ccccc2O)CN1C1CC1	280353186	BZRROWJLWYNSOY-UHFFFAOYSA-N	232.283	1.156	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CCCOC2)c1	103960265	MKXYBDJHMZQYRY-NSHDSACASA-N	237.299	1.669	10	20	BDCD	
CN(C)C(=O)CNCc1ccc2c(c1)CCCO2	921488574	AIQLEKWYCPPCTM-UHFFFAOYSA-N	248.326	1.189	10	20	BDCD	
C[C@@H](CN(C)Cc1cccc(F)c1O)C(=O)O	1589033779	CXOQKNZVBKFKRW-QMMMGPOBSA-N	241.262	1.684	10	20	BDCD	
C[C@@H](NCc1ccc2c(c1)CCO2)C1CNC1	817902010	GPSPWEHLIQSBMW-SNVBAGLBSA-N	232.327	1.319	10	20	BDCD	
CN(C)c1ccc(CNC(=S)NC2CC2)cc1	18165343	DSIZDLFPWNUYDT-UHFFFAOYSA-N	249.383	1.879	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)c1ccnn1C	1578378116	HNZVKVIRYZIIOY-UHFFFAOYSA-N	244.298	1.208	10	20	BDCD	
C[C@H](NCCO)c1cc(Cl)ccc1O	134910547	UIBUDCOAVONEEH-ZETCQYMHSA-N	215.680	1.689	10	20	BDCD	
CCn1ccnc1C(=O)NCc1ccccc1O	813489439	ZNWBVWZGRGJANE-UHFFFAOYSA-N	245.282	1.539	10	20	BDCD	
CC1=NO[C@H](C(=O)N[C@H](C)c2ccccc2O)C1	827952069	FNSDGPYNVXWEON-SKDRFNHKSA-N	248.282	1.734	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@@H]1CC12CCC2	910950855	KYWZDFVXYLRHID-NSHDSACASA-N	247.294	1.904	10	20	BDCD	
Cc1cccc(CNC2(C)CCNCC2)c1O	841065725	TZCQUMYWJAQZRZ-UHFFFAOYSA-N	234.343	1.932	10	20	BDCD	
C[C@@H](NCCCCN)c1ccc(F)cc1O	62747665	YGKWSIMZICHLIR-SECBINFHSA-N	226.295	1.921	10	20	BDCD	
C[C@@H]1C[C@H](O)CN1C(=O)c1cc(O)cs1	788592312	QCIVDCWNTLVIST-RQJHMYQMSA-N	227.285	1.049	10	20	BDCD	
O=C(Cc1cncs1)NCc1ccccc1O	783676747	NMZMUWPNGFCLPA-UHFFFAOYSA-N	248.307	1.708	10	20	BDCD	
COc1ccc(N2CCC[C@@H]2CN)cc1	20439488	WBHBKXBFFQVCFD-LLVKDONJSA-N	206.289	1.623	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCCN2C)[C@@H](C)O	395765772	YEMBGUKDUGOVLH-NWDGAFQWSA-N	248.370	1.928	10	20	BDCD	
COC(=O)[C@H](C)NCc1cccc(OC)c1O	37074021	HAAPXFRDLPBRIG-QMMMGPOBSA-N	239.271	1.052	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1CCCN1C	211616724	ZBWWOXIZBDPEGS-ZDUSSCGKSA-N	234.343	1.918	10	20	BDCD	
COCCOCCN[C@@H](C)c1ccccc1O	44693511	SMVIPYYKWBPBOO-NSHDSACASA-N	239.315	1.706	10	20	BDCD	
C[C@@H](N[C@H]1CCOC1)c1cc(F)ccc1O	87784335	ZROBVWDEYMQABN-SCZZXKLOSA-N	225.263	1.971	10	20	BDCD	
Cc1c[nH]ccc1=NC(=O)c1cc(O)cs1	732289014	AZQFKTCBJIUNSJ-UHFFFAOYSA-N	234.280	1.831	10	20	BDCD	
COc1cccc([C@@H](C)N[C@H]2CCOC2)c1O	846158498	ZWTBGEHJIMZEKJ-ZJUUUORDSA-N	237.299	1.840	10	20	BDCD	
C[C@H]1C[C@@H]1CNC(=O)NCCc1ccc(N)cc1	841710698	HTUMGHPMUDYQAV-CMPLNLGQSA-N	247.342	1.767	10	20	BDCD	
CC(C)NCC(=O)N(C)c1ccc(N)cc1	877074899	VBRAHAVGFJYINX-UHFFFAOYSA-N	221.304	1.230	10	20	BDCD	
C[C@@H](NC[C@@H]1CCC(=O)O1)c1ccccc1O	879649575	WIOLWSFETJTVBO-ZJUUUORDSA-N	235.283	1.748	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H]3C[C@]3(CO)C2)c1	783746558	YGLKLWHLSNMBQF-GXTWGEPZSA-N	233.311	1.515	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@H]1C[C@@H](O)C1	708438151	VIFAMMOPPXTNMH-WKFQBHICSA-N	243.253	1.531	10	20	BDCD	
Oc1c(F)cc(F)cc1CN[C@H]1CCC[C@@H]1O	708536312	ZOHXHLFRMOJOJD-QWRGUYRKSA-N	243.253	1.673	10	20	BDCD	
Nc1ccc(CC(=O)N2CC[C@@H]3C[C@@H]3C2)cc1	699143449	CAEQMBTXMMUKPR-VXGBXAGGSA-N	230.311	1.680	10	20	BDCD	
C[C@H](NCCCSc1nccs1)[C@@H](C)O	1327976843	AOTJTOWCOATBFE-DTWKUNHWSA-N	246.401	1.984	10	20	BDCD	
CCN1CC[C@H]1C(=O)NCCc1ccc(N)cc1	1577767026	GGPWFXSFZKJTHX-ZDUSSCGKSA-N	247.342	1.022	10	20	BDCD	
CC[C@@H](C)C(=O)NCc1ccc(O)c(O)c1	158929782	ZRQNYMYHLHMDJR-MRVPVSSYSA-N	223.272	1.760	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCC[C@H]2N)cc1	1343473129	LDRMDAISYYDJME-NWDGAFQWSA-N	233.315	1.012	10	20	BDCD	
Cc1ccc(C(=O)Nc2cnn(C)c2)c(O)c1O	177671267	QLFHEYWTQAVJLQ-UHFFFAOYSA-N	247.254	1.392	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCOC1	588408560	BYHKQNLRRVMKAS-WUWIAWFRSA-N	249.266	1.016	10	20	BDCD	
Oc1c(F)cc(F)cc1CN[C@H]1C[C@@H](O)C1	883139689	WJPLZQDAZIGSER-DTORHVGOSA-N	229.226	1.283	10	20	BDCD	
C[C@@H](O)CCCOC(=O)c1cc(O)cs1	795503603	AXXOGDWTSWHXTR-SSDOTTSWSA-N	230.285	1.772	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1C[C@@]12CCOC2	764251181	QBEHQKIRUCHMGI-SMDDNHRTSA-N	247.294	1.435	10	20	BDCD	
C[C@H]1C[C@H]1C(=O)N(C)c1ccc(N)cc1	34939056	DJUZRUTYVGXMKQ-GZMMTYOYSA-N	204.273	1.888	10	20	BDCD	
Oc1c(F)cccc1CNCC1[C@H]2CNC[C@H]12	1580888755	YCFLRXGSPZQERU-GHMZBOCLSA-N	236.290	1.086	10	20	BDCD	
CC(C)NC(=O)[C@H](C)NCc1ccccc1O	167879192	MASLDVGJXUUWIF-JTQLQIEISA-N	236.315	1.395	10	20	BDCD	
C[C@H](O)CNCc1cc(Cl)ccc1O	35601823	IXRWRDXAAPLSNP-ZETCQYMHSA-N	215.680	1.516	10	20	BDCD	
COC[C@H](CO)N[C@H](C)c1ccc(F)cc1O	234839433	BTGOLSAUKLMKSA-SCZZXKLOSA-N	243.278	1.189	10	20	BDCD	
Cc1ccc(CN[C@H](C)C[C@H](C)O)c(O)c1	877195861	PBDIYTNQKWHZFV-MNOVXSKESA-N	223.316	1.950	10	20	BDCD	
C[C@@H](NCCN1CCCC1=O)c1ccccc1O	405402193	NNKRCBUEXIEPRO-LLVKDONJSA-N	248.326	1.665	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC[C@@H]2C[C@H]21	804300709	ZJEZVANOECOHDL-PSASIEDQSA-N	233.267	1.722	10	20	BDCD	
NCC[C@H]1CCN(Cc2cc(F)ccc2O)C1	723670796	PBNLBSPZXOHZMW-JTQLQIEISA-N	238.306	1.702	10	20	BDCD	
Cc1ccc(C(=O)NCC2CCC2)c(O)c1O	177671500	OMVYQSKDXSITPS-UHFFFAOYSA-N	235.283	1.936	10	20	BDCD	
CC(C)OCC(=O)NCCc1ccc(N)cc1	123216812	NEDAGAGENYDVKS-UHFFFAOYSA-N	236.315	1.353	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccon1	136333988	QTAJSFFPYCPLRO-UHFFFAOYSA-N	218.212	1.310	10	20	BDCD	
CC(C)N(CC(N)=O)Cc1ccccc1O	132693700	YOBKEXFFGUNUIE-UHFFFAOYSA-N	222.288	1.088	10	20	BDCD	
CCN(C)Cc1cc2c(cc1O)OCO2	96810804	ZQIQVTGJWSRKSB-UHFFFAOYSA-N	209.245	1.573	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1CC1	269085756	JVORLTOSKJXWON-UHFFFAOYSA-N	207.229	1.124	10	20	BDCD	
C[C@]1(NCc2ccc3c(c2)CCO3)CCOC1=O	289910252	USTAMMWBKNQTIZ-AWEZNQCLSA-N	247.294	1.417	10	20	BDCD	
O=C1NCC[C@H]1CCSc1nccs1	821078418	QFZNEUBRVKYKSS-ZETCQYMHSA-N	228.342	1.761	10	20	BDCD	
Cc1ncc(NC(=O)c2cc(O)cs2)cn1	732286057	OHLTVFPQJLSMRB-UHFFFAOYSA-N	235.268	1.804	10	20	BDCD	
COC[C@H](C)NC(=O)c1cc(O)cs1	731864536	ZXHBWNOZMLBADL-LURJTMIESA-N	215.274	1.218	10	20	BDCD	
CC1(NC(=O)c2cc(O)cs2)CCOCC1	831003032	RHXATQRCCRHWSB-UHFFFAOYSA-N	241.312	1.753	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCOCC1	840908751	WNBREUCIGOXVGP-UHFFFAOYSA-N	234.343	1.893	10	20	BDCD	
COc1cccc([C@@H](C)NCC[C@H](C)O)c1O	846147949	WFSPZEKLITUWHP-VHSXEESVSA-N	239.315	1.822	10	20	BDCD	
CO[C@@H](C(=O)NCc1cc(C)ccc1O)C1CC1	862756083	PKSKJTLAHUVQJC-CYBMUJFWSA-N	249.310	1.742	10	20	BDCD	
COc1cccc2c1CCN2C(=O)CN=[N+]=[N-]	409433585	YNCYRAUMOBXIMT-UHFFFAOYSA-N	232.243	1.895	10	20	BDCD	
COc1ccc(CNC(=O)C2CC2)c(O)c1	794378826	IKNPFMLDVRRCQD-UHFFFAOYSA-N	221.256	1.427	10	20	BDCD	
C[C@H](Sc1nccs1)C(=O)N(C)C	64661160	NZSIFDCRWFHASX-LURJTMIESA-N	216.331	1.712	10	20	BDCD	
CCCN(CC(=O)O)Cc1c(C)cccc1O	1595855216	HJWGDKJWGIAVIE-UHFFFAOYSA-N	237.299	1.997	10	20	BDCD	
Nc1ccc(CNCC[C@@H]2CCNC2)cc1	1352790068	OGDLJPKMAZGBIV-GFCCVEGCSA-N	219.332	1.358	10	20	BDCD	
C[C@H](NCc1cc(Cl)c(F)cc1O)C(=O)O	1594240834	GEPXAOQPVYAVBQ-YFKPBYRVSA-N	247.653	1.747	10	20	BDCD	
C[C@H](N)[C@H](C)C(=O)N(C)Cc1ccccc1O	156655024	AONQCUZCVVNYFQ-UWVGGRQHSA-N	236.315	1.334	10	20	BDCD	
CC[C@H](N[C@@H](CO)COC)c1ccccc1O	234028614	KESVOTAXZBYOJP-JQWIXIFHSA-N	239.315	1.440	10	20	BDCD	
Cc1ccc(CNCCOCCF)c(O)c1	877644732	RUYVOUVQWSCGTK-UHFFFAOYSA-N	227.279	1.776	10	20	BDCD	
CCN(CCN)Cc1c(O)cccc1Cl	300868168	WROYKGCUFJLMLZ-UHFFFAOYSA-N	228.723	1.826	10	20	BDCD	
CO[C@@H](CNC(=O)Nc1ccc(N)cc1)C1CC1	378715196	YFAGLKOKOQYSNH-LBPRGKRZSA-N	249.314	1.815	10	20	BDCD	
CCN(C)CCNCc1cc(OC)ccc1O	54110038	KWZSUBWUUTWEMZ-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)[C@H](C)CO1	35782346	RXBTWGKUODNCHA-GHMZBOCLSA-N	248.326	1.447	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CCOC2)c1	87416134	FVRYQPUOCPWYCW-JTQLQIEISA-N	223.272	1.279	10	20	BDCD	
CN(C)c1ccc(CNC(C)(C)CC(N)=O)cc1	193555501	YPILYNYYNBRPEQ-UHFFFAOYSA-N	249.358	1.496	10	20	BDCD	
Cc1ccc(CNCCCCCO)c(O)c1	83352855	BOXKHKZSEMKJKF-UHFFFAOYSA-N	223.316	1.953	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@H](OC)C2)c1	234891114	RQGDNTRCNHMSOP-LBPRGKRZSA-N	237.299	1.622	10	20	BDCD	
CNCCN[C@H](C)c1cc(OC)ccc1O	817951401	FKLAJPWYEURIGL-SECBINFHSA-N	224.304	1.271	10	20	BDCD	
Nc1ccc(Cc2nc(C3(N)CCC3)no2)cc1	842617511	UHUAUVIVJAGRAT-UHFFFAOYSA-N	244.298	1.581	10	20	BDCD	
Nc1ccc(Cc2noc([C@@H]3CCOC3)n2)cc1	843159018	KRZQQHPIWAEQHQ-SNVBAGLBSA-N	245.282	1.747	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@@H]1COCO1	894891071	XXALMZFFBNHMMU-SECBINFHSA-N	245.225	1.133	10	20	BDCD	
CC1=NO[C@H](CNCc2c(C)cccc2O)C1	895305425	SDZBIJAWKCSQKB-NSHDSACASA-N	234.299	1.955	10	20	BDCD	
C[C@@H](O)CCCOC(=O)c1cccc(O)c1O	795595978	XYALWSAXCNZBGV-MRVPVSSYSA-N	240.255	1.416	10	20	BDCD	
CN(CCCF)C(=O)NCc1ccc(N)cc1	1357792433	XOJDLKUTEOBZCR-UHFFFAOYSA-N	239.294	1.770	10	20	BDCD	
Cc1ccc(CN2CCCCN2)c(O)c1	1579691678	GQDBLLDOOZYOJL-UHFFFAOYSA-N	206.289	1.801	10	20	BDCD	
CC1(C)CN(C(=O)Nc2ccc(N)cc2)CCO1	36232856	UBXVGUSLXHJYSM-UHFFFAOYSA-N	249.314	1.912	10	20	BDCD	
Cc1cc(NCCc2ccc(O)c(O)c2)ncn1	301551084	GZOBAAGVAGZIKJ-UHFFFAOYSA-N	245.282	1.851	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)c2n[nH]c(C)n2)c1	392370905	LGKSHBYDPJSUPE-VIFPVBQESA-N	246.314	1.978	10	20	BDCD	
Cc1ccc(C(=O)Nc2ccn(C)n2)c(O)c1O	177663587	UUXWIAIHWQKEFT-UHFFFAOYSA-N	247.254	1.392	10	20	BDCD	
CN(CCn1cccn1)c1ccc2c(c1)OCO2	178878305	RWIYTYABTXGEQV-UHFFFAOYSA-N	245.282	1.748	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCO[C@@H]2C)c1	134245912	VFKZRPZJNYHXJG-PWSUYJOCSA-N	221.300	1.968	10	20	BDCD	
COCCCC(=O)NCc1ccc(N)cc1	87420402	LHJHEPQSWVIKEQ-UHFFFAOYSA-N	222.288	1.312	10	20	BDCD	
CC(=O)C(=O)COC(=O)C[C@@H](C)c1ccccc1	808484169	LNJAYUGXCJYQDV-SNVBAGLBSA-N	248.278	1.882	10	20	BDCD	
CC[C@@H](NCCCON)c1ccccc1O	902425887	OSBMAPAVTITKDN-LLVKDONJSA-N	224.304	1.713	10	20	BDCD	
OC[C@H]1CCN1Cc1cc2c(cc1O)CCC2	902630577	PCFRLYJCHBJPJW-CYBMUJFWSA-N	233.311	1.448	10	20	BDCD	
O=C(O)NCCCSc1nccs1	739972218	JUPSSAKSMZPNJH-UHFFFAOYSA-N	218.303	1.893	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1=CCCC1	910950794	INIUYAMAKTWKGS-UHFFFAOYSA-N	233.267	1.824	10	20	BDCD	
Cc1cccc(CN[C@H]2C(=O)NCC2(C)C)c1O	895317499	WLWUOPPKKIMOCB-LBPRGKRZSA-N	248.326	1.315	10	20	BDCD	
C[C@@H]1C[C@@H]1C(=O)NCCc1ccc(O)c(O)c1	98074507	ZHOFPZGAJRBXRE-SCZZXKLOSA-N	235.283	1.413	10	20	BDCD	
O=C1CC[C@H](C(=O)NCc2cccc(O)c2O)C1	1521850831	ADPHPLFKQMGWAV-QMMMGPOBSA-N	249.266	1.083	10	20	BDCD	
C[C@@H](NCCC(=O)O)c1cc(F)cc(F)c1O	1589127053	UTLUHPHEFYGGPD-ZCFIWIBFSA-N	245.225	1.796	10	20	BDCD	
CC(C)(N)CCNCc1ccc2c(c1)CCO2	258995928	WIWLESMIQVOMRJ-UHFFFAOYSA-N	234.343	1.839	10	20	BDCD	
COc1cccc(CNCC23CC(CO2)C3)c1O	527790849	WDNJZFQMOVWCRR-UHFFFAOYSA-N	249.310	1.669	10	20	BDCD	
C[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O	49358136	DQIPLPMWERRABJ-MRVPVSSYSA-N	221.256	1.184	10	20	BDCD	
C[C@H]1CN[C@H](C)CN1Cc1cccc(F)c1O	843120085	VJHDWKKQDMBRSF-ZJUUUORDSA-N	238.306	1.714	10	20	BDCD	
N[C@H](CNCc1ccccc1O)C1CC1	841050652	RQGWAYCEVQBBLD-LLVKDONJSA-N	206.289	1.219	10	20	BDCD	
C[C@@]1(NC(=O)c2cc(O)cs2)CCOC1	765234084	ILIZSIBBDNIYHL-SNVBAGLBSA-N	227.285	1.363	10	20	BDCD	
C[C@@H](NC(=O)[C@H](C)[C@@H](C)N)c1ccccc1O	870988342	MTFFTBCUXMCUJH-OPRDCNLKSA-N	236.315	1.553	10	20	BDCD	
CC[C@@H](C)[C@H](N)C(=O)N(C)c1ccc(N)cc1	877077997	YMBCGDRHKCAELM-SKDRFNHKSA-N	235.331	1.605	10	20	BDCD	
COC[C@H](O)CN[C@H](C)c1ccccc1O	70589895	GCLLXKUDJSCVBT-NXEZZACHSA-N	225.288	1.050	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H](C)[C@H](O)C2)c1	897681366	SQYCQZDEEOPFET-TVQRCGJNSA-N	237.299	1.213	10	20	BDCD	
C[C@H]1C[C@H](NCc2ccc(N)cc2)CCN1	1246168547	FKPTUKBFTVHBBK-GXFFZTMASA-N	219.332	1.499	10	20	BDCD	
C[C@@H]1C[C@H]1C(=O)NCc1ccc(O)c(O)c1	158898379	FRQQLKZUSDGAPU-VXNVDRBHSA-N	221.256	1.370	10	20	BDCD	
O=C(O)CCNCc1c(O)cccc1Cl	127250463	NQZJJZIOBNRNEF-UHFFFAOYSA-N	229.663	1.610	10	20	BDCD	
COc1ccc(O)c(CNC2(C)COC2)c1	877691930	XRFYHIPDWOFOQG-UHFFFAOYSA-N	223.272	1.279	10	20	BDCD	
N[C@@H]1CCN(Cc2cccc(F)c2O)C1	309559479	NYCQOIBPNHCUNS-SECBINFHSA-N	210.252	1.064	10	20	BDCD	
C[C@H]1CN(Cc2cccc(F)c2O)CCN1	309828579	XWPSNDGTKIIDCI-VIFPVBQESA-N	224.279	1.325	10	20	BDCD	
CCNC(=O)C(C)(C)NCc1ccccc1O	312835332	ZPISKDNGVSEGGW-UHFFFAOYSA-N	236.315	1.397	10	20	BDCD	
CCn1nncc1CNCc1ccccc1O	527725160	DTYVJIYLMYQHHR-UHFFFAOYSA-N	232.287	1.293	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NCc1cc(F)cc(F)c1O	708556373	UQDNPCYLYQDZNF-PWSUYJOCSA-N	243.253	1.937	10	20	BDCD	
Oc1ccccc1CNCC1CC2(C1)OCCO2	922798995	NTNOVYVCFUWTNA-UHFFFAOYSA-N	249.310	1.635	10	20	BDCD	
N[C@@H]1CCC[C@@H]1C(=O)NCc1ccccc1O	228422987	OULKMMQTVNJWPV-WDEREUQCSA-N	234.299	1.136	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1=COCCO1	53914786	XUFOSULOUAEOTD-UHFFFAOYSA-N	249.266	1.239	10	20	BDCD	
CNCCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21	817952587	RULDXIWTMGXGDA-SCZZXKLOSA-N	238.306	1.889	10	20	BDCD	
C[C@@H]1[C@H](O)CCN1Cc1ccccc1O	825104422	WPZVEHSJRPGVEZ-MWLCHTKSSA-N	207.273	1.347	10	20	BDCD	
COCC[C@H](C)NC(=O)c1cc(O)cs1	732283650	RODIORLMRQDIGP-ZETCQYMHSA-N	229.301	1.609	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)[C@@H](C)CN	843051907	MFZLYNZXLHRZJN-LBPRGKRZSA-N	235.375	1.840	10	20	BDCD	
CCc1cccc(CN2C[C@H](O)C[C@H]2C)c1O	848905980	OTRSUNDXEVTQFS-ZWNOBZJWSA-N	235.327	1.910	10	20	BDCD	
CC(=O)C1=NN(c2ccc(C)c(F)c2)C(=O)C1	871960416	ZPJMTGZUESTWLC-UHFFFAOYSA-N	234.230	1.816	10	20	BDCD	
CCN(C)c1ccc(CN2C[C@@H](O)[C@H](C)C2)cc1	773819064	OBLFKLCHNAKRMB-IUODEOHRSA-N	248.370	1.955	10	20	BDCD	
CCNC(=O)CN(C)Cc1ccc(N(C)C)cc1	726980535	AMIWYGCPSOVWPJ-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
C[C@@H](CN[C@H](C)c1ccccc1O)C(=O)O	1603193485	WLPQCKSZVQSPEQ-DTWKUNHWSA-N	223.272	1.764	10	20	BDCD	
COc1ccc(O)c(CNCCCN(C)C)c1	20091909	VDVQDFFQVLSDFH-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NCC1CC1	180621319	YGTUBDVBICHMIR-GQCTYLIASA-N	233.267	1.637	10	20	BDCD	
Cn1nccc1NC(=O)c1cccc(O)c1O	126353751	RCBQAQFUJMMMEE-UHFFFAOYSA-N	233.227	1.084	10	20	BDCD	
CC[C@H](NC[C@H](C)O)c1ccccc1O	35601761	GLPQHFJETHNBNS-ONGXEEELSA-N	209.289	1.814	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C(C)(C)CN	123007393	HLUGSKGEUKDIJZ-UHFFFAOYSA-N	236.315	1.336	10	20	BDCD	
COc1ccc(O)c(CN(C)C[C@H](C)O)c1	130695219	NTARVJUBXJIWQJ-VIFPVBQESA-N	225.288	1.213	10	20	BDCD	
O=C(N[C@@H]1CCSC1)c1cccc(O)c1O	231355715	JLULPOGAJATHLI-SSDOTTSWSA-N	239.296	1.333	10	20	BDCD	
CC[C@@H](N)CN[C@H](C)c1ccc(F)cc1O	817980956	YOMMZIUDLFVWSL-PSASIEDQSA-N	226.295	1.919	10	20	BDCD	
CC[C@@H](NCCNC)c1ccc(C)cc1O	817953289	YUFDFXMVLAVGMP-GFCCVEGCSA-N	222.332	1.961	10	20	BDCD	
OC[C@H](CCF)NCc1cc(F)ccc1O	846097095	DNBFWFRWSDIUOO-JTQLQIEISA-N	231.242	1.341	10	20	BDCD	
CN(CCN)Cc1ccc(N(C)C)cc1	54416867	SBHSTCKRDKDAQJ-UHFFFAOYSA-N	207.321	1.143	10	20	BDCD	
Oc1cc2c(cc1CN1CC=CCC1)OCO2	778577778	XSQSWFLYAHHPHM-UHFFFAOYSA-N	233.267	1.883	10	20	BDCD	
Cc1nccc(NCCc2ccc(O)c(O)c2)n1	85689428	ISZQFDWWDUNZAD-UHFFFAOYSA-N	245.282	1.851	10	20	BDCD	
Cc1cc(O)ccc1NS(=O)(=O)C1CC1	70909263	VATQPVHTKSBQIU-UHFFFAOYSA-N	227.285	1.605	10	20	BDCD	
COCC1(C(=O)NCc2ccccc2O)CC1	778914361	NBDBGIRKILCSLU-UHFFFAOYSA-N	235.283	1.435	10	20	BDCD	
CCn1cc(CN[C@@H](C)c2ccccc2O)nn1	404505072	LBGIEHFYDLMDPH-JTQLQIEISA-N	246.314	1.854	10	20	BDCD	
C[C@]1(CO)CCCN(Cc2ccccc2O)C1	305744798	MDRXIMQYHDNWIN-AWEZNQCLSA-N	235.327	1.987	10	20	BDCD	
CCOCCN(C)c1ccc2c(c1)OCO2	121241213	CCJYSQUSFGEGTD-UHFFFAOYSA-N	223.272	1.888	10	20	BDCD	
Cc1cccc(CN[C@H]2CCCCNC2=O)c1O	124696833	BKMNULVYKJKWOA-LBPRGKRZSA-N	248.326	1.459	10	20	BDCD	
Oc1ccccc1CN1CCOC[C@]12CCOC2	195009717	LKXXWLYXCOJVOG-CQSZACIVSA-N	249.310	1.384	10	20	BDCD	
Cc1cc(Cl)cc(CNCCC(=O)O)c1O	820976943	WXJRLZURAYISEE-UHFFFAOYSA-N	243.690	1.918	10	20	BDCD	
C[C@@H]1CNCCN1Cc1cccc(F)c1O	843046873	CUMYLOWIZDPXHQ-SECBINFHSA-N	224.279	1.325	10	20	BDCD	
COc1cccc(CN(C)[C@H](C)CCO)c1O	846108572	BLAJYDWSRNXJHO-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
Cc1cc(CN(C)CCCN)ccc1N(C)C	923292129	UGDDWWNSNRXWOG-UHFFFAOYSA-N	235.375	1.842	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)N2CCC2)o1	1537962593	PYPAGGGVRNXLBN-UHFFFAOYSA-N	206.205	1.936	10	20	BDCD	
CC(=O)C1=NN(c2cc(C)ccc2C)C(=O)C1	871940127	NHDRTEWBEFUWQM-UHFFFAOYSA-N	230.267	1.985	10	20	BDCD	
Cc1ncoc1C(=O)NCc1ccc(O)c(O)c1	778927739	UJERTCYCLDDFSP-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
C[C@H](O)[C@@H]1CCCN(c2ccc(N)cc2)C1	409434023	ZOWURHCKYJJOEL-WDEREUQCSA-N	220.316	1.866	10	20	BDCD	
Nc1ccc(N2C[C@@H]3CCC[C@]3(CO)C2)cc1	409432344	LDJJQSPCVCVCAF-SMDDNHRTSA-N	232.327	1.868	10	20	BDCD	
CNC[C@H](C)C(=O)N(C)Cc1ccccc1O	92134793	CFIJWDGWPCHNNF-JTQLQIEISA-N	236.315	1.206	10	20	BDCD	
Oc1ccccc1CNc1cnccn1	84830991	KOWMGAGAYCPASB-UHFFFAOYSA-N	201.229	1.794	10	20	BDCD	
COc1ccc(CN[C@@H](C)[C@@H](C)OC)c(O)c1	189109030	PRSUEIAYVYYFIK-VHSXEESVSA-N	239.315	1.914	10	20	BDCD	
CO[C@H](C)CNCc1cc(C)ccc1O	191205055	DPOQFEUKSBWGDX-SNVBAGLBSA-N	209.289	1.825	10	20	BDCD	
O=C(O)CCCC(=O)N1Cc2cccc(O)c2C1	1601978351	CNDUEQKURJHUDE-UHFFFAOYSA-N	249.266	1.489	10	20	BDCD	
COCC[C@H](CO)NCc1ccc(C)cc1O	877501014	KYVMISZWHJSKOR-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
CCOCC(=O)N[C@H](C)c1ccccc1O	827917136	LHQBFDHDSYWETG-SECBINFHSA-N	223.272	1.606	10	20	BDCD	
CO[C@@H]1CCN(Cc2cc(F)ccc2O)C1	300334417	NTCSXYVSZNTXQR-LLVKDONJSA-N	225.263	1.752	10	20	BDCD	
COc1ccc(O)c(CN2CCC[C@@H](O)C2)c1	271774462	FWYQXFKCDSMKSD-LLVKDONJSA-N	237.299	1.358	10	20	BDCD	
CC[C@@H]1CN(Cc2ccccc2O)C[C@@H]1O	272378026	HIESWTNHJVMHHW-MFKMUULPSA-N	221.300	1.595	10	20	BDCD	
C[C@@H](NC1CCNCC1)c1cc(F)ccc1O	817937526	XHVOKUADSBDDCM-SECBINFHSA-N	238.306	1.934	10	20	BDCD	
COc1cccc([C@@H](C)NC[C@@H](C)O)c1O	846138307	QEOVCYYSVFFBJN-RKDXNWHRSA-N	225.288	1.432	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H](N)C2)cc1F	843045194	OWYCOWJILIBLTD-LLVKDONJSA-N	237.322	1.425	10	20	BDCD	
Oc1c(F)cc(F)cc1CNCCOCCF	708394205	SCLDXYWIPXEECL-UHFFFAOYSA-N	249.232	1.746	10	20	BDCD	
C[C@@H](N)C1CCN(Cc2ccc(N)cc2)CC1	1356082931	HZJPLMHFHCAXPF-LLVKDONJSA-N	233.359	1.828	10	20	BDCD	
CC(C)C1(C(=O)N(C)c2ccc(N)cc2)COC1	1575474551	FCFBCUSQYZOTAZ-UHFFFAOYSA-N	248.326	1.904	10	20	BDCD	
C[C@@H](NCc1nc[nH]n1)c1ccccc1O	37919377	JJUZMFLRXJNNAU-MRVPVSSYSA-N	218.260	1.361	10	20	BDCD	
CC[C@H](C)N(CC(=O)O)Cc1ccc(N)cc1	1604961342	ITLOMPQXXUYBCC-JTQLQIEISA-N	236.315	1.954	10	20	BDCD	
COc1ccc(O)c(CNCc2c[nH]nc2C)c1	38011222	QTSGLRZVZPWXOR-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
CC(C)[C@@H](CO)NCc1ccc(N(C)C)cc1	80789158	VFSMQKHUDQYHBW-CQSZACIVSA-N	236.359	1.859	10	20	BDCD	
CC(=O)C(=O)COc1ccc(C(C)=O)cc1	289816735	ZSWNGTHVSSOZNS-UHFFFAOYSA-N	220.224	1.426	10	20	BDCD	
OC/C=C\CNCc1cc(Cl)c(F)cc1O	826941302	HXLJXGSXTJFGGA-UPHRSURJSA-N	245.681	1.823	10	20	BDCD	
CN1CC(=O)N[C@H]1c1cc(Cl)c(F)cc1O	840806313	ZTCCDLROUWKIJK-SNVBAGLBSA-N	244.653	1.245	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1CCC1	910953509	CMIPKRZQOYHVTH-UHFFFAOYSA-N	221.256	1.514	10	20	BDCD	
COc1cccc(CNC[C@H](N)C2CC2)c1O	841049685	MTXCWEIXTDTYOB-NSHDSACASA-N	236.315	1.228	10	20	BDCD	
C[C@@H]1NCCC[C@H]1NCCc1ccc(N)cc1	925689555	BXKNOEXKDGFNJK-SMDDNHRTSA-N	233.359	1.541	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@](C)(O)C2CC2)c1	862755047	BCUNKKYALIMLBY-CQSZACIVSA-N	249.310	1.478	10	20	BDCD	
CC(C)(O)CCOC(=O)c1cc(O)cs1	765473525	LUUDWYZQKVAQCH-UHFFFAOYSA-N	230.285	1.772	10	20	BDCD	
CNC[C@@H](C)CNCc1c(O)cccc1OC	1117953178	BVPVGQPXMPHNRD-SNVBAGLBSA-N	238.331	1.346	10	20	BDCD	
COc1cccc(CN[C@@H](C)CCCO)c1O	94942276	FYYHIWWCFFITPV-JTQLQIEISA-N	239.315	1.651	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cnc[nH]1	701173772	AKFZIHUPDPMBCH-UHFFFAOYSA-N	231.255	1.388	10	20	BDCD	
O=C(NCCCF)c1cccc(O)c1O	189910311	ODRQRDKXURDRDW-UHFFFAOYSA-N	213.208	1.187	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)[C@H](C)OC)c1	191696029	PXTOBBFHUTZBGK-UWVGGRQHSA-N	239.315	1.914	10	20	BDCD	
CC1=NO[C@H](C(=O)NCc2ccc(N)cc2)C1	1524018479	LUTTUJUGHXIOLE-NSHDSACASA-N	233.271	1.050	10	20	BDCD	
CC1(C)[C@H](N)C[C@H]1NCc1cccc(F)c1O	1576380056	GHZHYDPRQFBPFX-GHMZBOCLSA-N	238.306	1.747	10	20	BDCD	
OCCOc1ccc(N2CCCC2)cc1	160010810	SJARMXKAELDLGK-UHFFFAOYSA-N	207.273	1.658	10	20	BDCD	
CC[C@@H](N)CNCc1ccc2c(c1)CCO2	841070566	QXPFVTKLYAQGEF-GFCCVEGCSA-N	220.316	1.448	10	20	BDCD	
Cc1cccc(O)c1CNCCCn1cncn1	877011551	FRWQLAIWRVTJOR-UHFFFAOYSA-N	246.314	1.472	10	20	BDCD	
CN(CC(F)(F)F)C(=O)Cc1ccc(N)cc1	37663755	FGSRUGFWWBXHKK-UHFFFAOYSA-N	246.232	1.832	10	20	BDCD	
CC(C)=CC(=O)NCCc1ccc(O)c(O)c1	156666680	UXTGSYKAMSHHJX-UHFFFAOYSA-N	235.283	1.723	10	20	BDCD	
Cn1nncc1CNCc1ccc2c(c1)CCO2	267509764	JTLRLBVNTIHEFR-UHFFFAOYSA-N	244.298	1.040	10	20	BDCD	
CC[C@H]1CN(Cc2ccccc2O)CC[C@H]1N	251901748	WXJLLGPQUSDMTL-WCQYABFASA-N	234.343	1.951	10	20	BDCD	
CCN(CC)c1ccc(CNC(=O)CNC)cc1	178712009	JBZQRIRNTVUOKH-UHFFFAOYSA-N	249.358	1.368	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCC(F)(F)CO)c1	184686695	RUPJKDOVZVQWHP-VIFPVBQESA-N	245.269	1.979	10	20	BDCD	
C[C@@H](CO)N[C@@H](C)c1ccc(N(C)C)cc1	37258353	BWVNROJIOMNVKB-QWRGUYRKSA-N	222.332	1.784	10	20	BDCD	
C[C@H](O)C[C@@H](C)NCc1cc(F)ccc1O	228836361	YJNRWBIHWFAMPE-BDAKNGLRSA-N	227.279	1.780	10	20	BDCD	
CC[C@@H](NC[C@H](C)O)c1ccc(F)cc1O	285842137	XKYSEVOQHSJKLN-GZMMTYOYSA-N	227.279	1.953	10	20	BDCD	
OCCCN[C@H]1CCc2cccc(O)c21	296009497	OTEOSLNJOJNZKX-JTQLQIEISA-N	207.273	1.352	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CC[C@H]2O)cc1F	818231027	NEIHUOBKQHRTNI-DGCLKSJQSA-N	238.306	1.505	10	20	BDCD	
CCN(CC[S@@](C)=O)c1ccc(OC)cc1	828172891	UZJQNUJXJUJZEK-MRXNPFEDSA-N	241.356	1.900	10	20	BDCD	
CCCNCCNCc1cc(F)ccc1O	841046567	HKTVHHXYZANDFO-UHFFFAOYSA-N	226.295	1.621	10	20	BDCD	
C[C@@H]1C[C@@H](NC(=O)c2cc(O)cs2)CCO1	770412785	WIDSQZNTGGLKHJ-SFYZADRCSA-N	241.312	1.751	10	20	BDCD	
CON(C)c1nnc(-c2sccc2O)n1C	1121273746	JQTJRGHQCBOSGL-UHFFFAOYSA-N	240.288	1.247	10	20	BDCD	
COc1cccc(O)c1CN[C@H](C)C[C@@H](C)O	782977464	FXFSVXNQGGFYMZ-NXEZZACHSA-N	239.315	1.650	10	20	BDCD	
COc1cc(C)c(CN[C@@H](C)C(=O)O)c(O)c1	1594054122	HWIPXWFCCQIIRK-QMMMGPOBSA-N	239.271	1.272	10	20	BDCD	
C[C@@H]1CCNC[C@H]1NCc1ccc2c(c1)CCO2	841058002	DPJGAQOAFIYNQC-BXUZGUMPSA-N	246.354	1.709	10	20	BDCD	
CCN(C[C@H](C)N)c1ccc(OC)cc1	20239635	OUNMXRNTNMYRPX-JTQLQIEISA-N	208.305	1.869	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H](O)C1CCC1	315809646	XKCWAUGVBWXAIB-ZDUSSCGKSA-N	239.290	1.782	10	20	BDCD	
O=C(O)CNCc1ccc(N2CCCCC2)cc1	36722837	VUYYEMBVXQAUKA-UHFFFAOYSA-N	248.326	1.851	10	20	BDCD	
CC[C@@H](O)CNCc1ccc(N(C)C)cc1	229966357	GZZXFXRHFIXTBU-CYBMUJFWSA-N	222.332	1.613	10	20	BDCD	
CN(Cc1cc(F)ccc1O)CC1CC(O)C1	191164283	FHTSAFFATJAPKS-UHFFFAOYSA-N	239.290	1.734	10	20	BDCD	
Nc1ccc(CN2CCC(CCO)CC2)cc1	146385578	HLHMDSSVCDMDCY-UHFFFAOYSA-N	234.343	1.863	10	20	BDCD	
Cn1ccc(CCNCc2ccccc2O)n1	230880441	POGQVHCOTZDSPJ-UHFFFAOYSA-N	231.299	1.458	10	20	BDCD	
Oc1c(F)cc(Cl)cc1CN1CCNCC1	96879591	LKBPQDODDZUTSV-UHFFFAOYSA-N	244.697	1.590	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H](C)CN)c1	817966264	JXHWLARLVXZPLP-BDAKNGLRSA-N	224.304	1.399	10	20	BDCD	
C[C@H]1C[C@@H](C(=O)NCc2ccc(N)cc2)CCO1	1341922894	GPVQFZUWEUVJJI-JQWIXIFHSA-N	248.326	1.700	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)N1CCCCN1	854428934	ZZNVEROJEZXXFR-XQRVVYSFSA-N	248.282	1.238	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2cccnc2Cl)C1	409422085	AKWSOVFAYQZCLQ-UHFFFAOYSA-N	237.650	1.870	10	20	BDCD	
COc1cc(C)cc(CN[C@H]2C[C@H](O)C2)c1O	895351156	QCYWLVWVPOJQHQ-XYPYZODXSA-N	237.299	1.322	10	20	BDCD	
C[C@H](NC[C@@H](C)O)c1ccc(F)c(F)c1O	187813766	ONJAIXBLYYSIQM-RQJHMYQMSA-N	231.242	1.702	10	20	BDCD	
COc1cccc(O)c1CNCC(F)(F)CO	767194305	JEIMYXCSFHJUKQ-UHFFFAOYSA-N	247.241	1.118	10	20	BDCD	
O=C1CCC[C@@H]([C@H]2CCCCCN2)C1=O	164514727	FFXRYYXWSUOTDV-VHSXEESVSA-N	209.289	1.457	10	20	BDCD	
CN(C)C(=O)/C=C\c1ccc(O)c(O)c1	204972246	RSIUTQOYCFICQH-XQRVVYSFSA-N	207.229	1.199	10	20	BDCD	
O[C@H](CNCc1ccc2c(c1)CCCO2)C1CC1	921742622	XAZQAGMDSKFWPT-CQSZACIVSA-N	247.338	1.872	10	20	BDCD	
Cc1ccc(CN[C@@H](C)c2nncn2C)c(O)c1	877016426	GHWJWPJHWPQQDF-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
Oc1ccc(Cl)c(F)c1CN[C@@H]1CC[C@H]1O	378670471	CUWBCCLDSSWHKR-PSASIEDQSA-N	245.681	1.798	10	20	BDCD	
Cn1cnc(CNCc2ccc3c(c2)CCO3)n1	92852464	JQPCZNDTCWIJGA-UHFFFAOYSA-N	244.298	1.040	10	20	BDCD	
Oc1ccccc1CN1CCC[C@@H](O)CC1	294231193	ZHWQKDQCQYOXFT-GFCCVEGCSA-N	221.300	1.739	10	20	BDCD	
O=C(NCCC1(O)CCC1)c1cc(O)cs1	807563356	GYJQBZYMQNBHPQ-UHFFFAOYSA-N	241.312	1.489	10	20	BDCD	
C[C@@H](O)CNc1ccccc1OCCF	819488184	KXQQXAIXCFHIKG-SECBINFHSA-N	213.252	1.828	10	20	BDCD	
CNCCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21	817952596	RULDXIWTMGXGDA-WPRPVWTQSA-N	238.306	1.889	10	20	BDCD	
Oc1cc(F)c(Cl)cc1CN[C@@H]1CC[C@H]1O	822503538	IHDMSOBNOVJUNS-NXEZZACHSA-N	245.681	1.798	10	20	BDCD	
Cc1cc(N(C)C)ccc1[C@H]1NC(=O)CN1C	840804624	NINUHEVGPWLXKQ-ZDUSSCGKSA-N	233.315	1.121	10	20	BDCD	
CC[C@H](CCO)CNC(=O)c1cc(O)cs1	762832794	NSTHGXNNMGCFTA-MRVPVSSYSA-N	243.328	1.592	10	20	BDCD	
C[C@@H](N[C@H]1CCOC1)c1ccccc1O	87783056	SJLIJQFCALURPS-ZJUUUORDSA-N	207.273	1.832	10	20	BDCD	
CCN[C@@H](C)c1cccc(-c2nn[nH]n2)c1O	1590745062	AMVWOLGALUIVJT-ZETCQYMHSA-N	233.275	1.243	10	20	BDCD	
CNC(=O)C[C@H](C)NCc1cc(C)ccc1O	322748325	CZMXZMNLGZEVOO-JTQLQIEISA-N	236.315	1.315	10	20	BDCD	
CC[C@@H](NCc1c(O)cccc1OC)[C@@H](C)O	1325133331	PIVRNMDTXAPWHX-MWLCHTKSSA-N	239.315	1.650	10	20	BDCD	
COc1ccc(O)c(CN(CCO)C2CC2)c1	305780348	SUWPLWTUOAZEJX-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
OCC1CCN(Cc2ccccc2O)CC1	128550513	PXKLOIBMPVTPIE-UHFFFAOYSA-N	221.300	1.597	10	20	BDCD	
CC[C@H](CO)NCc1cc(C)ccc1O	70955056	UGYSWHDGXQEKOV-LLVKDONJSA-N	209.289	1.561	10	20	BDCD	
NC[C@H]1CCCCN1C(=O)Cc1ccc(N)cc1	237948320	CGLDZCIHOVNEGA-CYBMUJFWSA-N	247.342	1.151	10	20	BDCD	
CC1(C(=O)NCc2ccc(O)c(O)c2)CC1	182548363	DLAVHDXVVIKKFL-UHFFFAOYSA-N	221.256	1.514	10	20	BDCD	
COC[C@@H](C)CNC(=O)Nc1ccc(N)cc1	45647922	IUMQNIMKSXNPBG-VIFPVBQESA-N	237.303	1.673	10	20	BDCD	
CCNC(=O)CN(C)Cc1cc(F)ccc1O	226562610	DVJYEMGIRACPTM-UHFFFAOYSA-N	240.278	1.099	10	20	BDCD	
CC1(C(=O)NCc2ccccc2O)COC1	273122715	YHUSDCRWFORMLD-UHFFFAOYSA-N	221.256	1.045	10	20	BDCD	
CC1CC(NC(=O)c2c(F)ccc(O)c2O)C1	295137578	IRUXVXHQUXTVTB-UHFFFAOYSA-N	239.246	1.765	10	20	BDCD	
COc1ccccc1NC[C@@H](O)CSC	819394353	ZPEHCBLREHPFRJ-SECBINFHSA-N	227.329	1.831	10	20	BDCD	
CO[C@H](C)[C@H](C)NCCc1ccc(N)cc1	817956323	WJAPVKXGDPGUNU-WDEREUQCSA-N	222.332	1.824	10	20	BDCD	
OC/C=C/CNCc1cc(Cl)c(F)cc1O	826941300	HXLJXGSXTJFGGA-OWOJBTEDSA-N	245.681	1.823	10	20	BDCD	
CC1(O)CN(Cc2cc(Cl)ccc2O)C1	877580650	FPUGSYUYCBTXKD-UHFFFAOYSA-N	227.691	1.612	10	20	BDCD	
CN(C(=O)[C@H]1C[C@]12CCNC2)c1ccc(N)cc1	877077684	QVYSMSKSXUFYON-OCCSQVGLSA-N	245.326	1.231	10	20	BDCD	
COc1ccc(O)c(CNC(=N)NCC2CC2)c1	887355189	HCMIZNIXKPRZMT-UHFFFAOYSA-N	249.314	1.425	10	20	BDCD	
CC[C@H](NCc1cccc(C)c1O)[C@@H](C)O	386737654	XHQXRQRBRPRZTQ-PWSUYJOCSA-N	223.316	1.950	10	20	BDCD	
CO[C@H]1C[C@H](NCc2cc(C)ccc2O)C1	706547458	XPDOVUZQTIUJQW-HAQNSBGRSA-N	221.300	1.968	10	20	BDCD	
NC[C@]12CCC[C@H]1CN(Cc1ccc(N)cc1)C2	1334775135	SSVMIXYFSMVROL-ZFWWWQNUSA-N	245.370	1.830	10	20	BDCD	
O=C(O)C1(C(=O)N2Cc3cccc(O)c3C2)CC1	1605917006	IQDHFEAARMXCTO-UHFFFAOYSA-N	247.250	1.099	10	20	BDCD	
C[C@H](N[C@@H]1CCCNC1)c1ccccc1O	817939749	BMYSOVIDKKVCGA-WDEREUQCSA-N	220.316	1.795	10	20	BDCD	
C[C@@H](N[C@H]1CCc2cccc(O)c21)C(=O)N(C)C	310868096	PHRCNGIOLKTTJG-KOLCDFICSA-N	248.326	1.446	10	20	BDCD	
C[C@@H]1[C@@H](CO)CCN1C(=O)Cc1ccc(N)cc1	385964780	ZIXICMMDTUAGQM-ZYHUDNBSSA-N	248.326	1.041	10	20	BDCD	
COc1ccc(CNCc2cn(C)nn2)cc1C	389821924	LBOMQWDBSQKGRY-UHFFFAOYSA-N	246.314	1.422	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H]2CCCCO2)cc1	50958887	NKZOQPYMCAKNBI-CYBMUJFWSA-N	248.326	1.497	10	20	BDCD	
Cc1ccc([C@@H](C)NCC(F)(F)CO)c(O)c1	184705191	XJRIBXJGNHLPCH-SECBINFHSA-N	245.269	1.979	10	20	BDCD	
CN[C@@H]1CCN(Cc2ccccc2O)C1	150072458	IDSHHPOBDOBUNO-LLVKDONJSA-N	206.289	1.186	10	20	BDCD	
CCN1CCCN(Cc2ccccc2O)CC1=O	191544032	DILJTHXSIXMVSY-UHFFFAOYSA-N	248.326	1.446	10	20	BDCD	
Cc1nnc(NC(=O)Cc2ccc(N)cc2)s1	82698182	PRNMQQRBPKPVPN-UHFFFAOYSA-N	248.311	1.610	10	20	BDCD	
COc1ccc(CNCC(C)(C)O)cc1C	82687376	TZIXOODSURALQY-UHFFFAOYSA-N	223.316	1.864	10	20	BDCD	
Cc1ccc(O)c(CNCCCCCO)c1	83352854	RWSJVVZKUBECCF-UHFFFAOYSA-N	223.316	1.953	10	20	BDCD	
CN(C)C(=O)CSc1ncc(Cl)s1	829531542	NHAHLRKDWKPBPB-UHFFFAOYSA-N	236.749	1.977	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@@H]1[C@H]2CCC[C@H]21	910950463	FTSSQFVYMLINEQ-PJXYFTJBSA-N	247.294	1.760	10	20	BDCD	
Cc1cccc(CN2CC[C@]3(CCNC3)C2)c1O	843120442	KRPNTNIKKMOGJX-HNNXBMFYSA-N	246.354	1.886	10	20	BDCD	
CC(C)(CO)NCc1c(O)cccc1Cl	83662485	CJORJINNMXASBF-UHFFFAOYSA-N	229.707	1.906	10	20	BDCD	
NCCCCCCC(=O)NCc1ccc(N)cc1	1263303975	OIVXJPJELLDFNC-UHFFFAOYSA-N	249.358	1.794	10	20	BDCD	
CCN(C)CCNCc1cccc(F)c1O	165160703	NCWYZEBKPAOLAF-UHFFFAOYSA-N	226.295	1.573	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1csnn1	383649689	POCZJOOEDVKAAA-UHFFFAOYSA-N	249.295	1.516	10	20	BDCD	
COc1cccc(CN(C)C2CC(N)C2)c1O	385090306	XURDTTTUARWOIS-UHFFFAOYSA-N	236.315	1.322	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)CCO1	21958509	XLDBUJCIQVZWBZ-JTQLQIEISA-N	234.299	1.059	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C(C)(C)CN)cc1	123081302	GTBUJRVWGWCUOG-UHFFFAOYSA-N	249.358	1.354	10	20	BDCD	
Oc1ccccc1CNC[C@H]1CCN(C2CC2)C1	37649359	CCJQMMIYKDCWTQ-GFCCVEGCSA-N	246.354	1.966	10	20	BDCD	
CNC(=O)CN(C)Cc1cc(Cl)ccc1O	132592461	KLFBRQQTFQDWHB-UHFFFAOYSA-N	242.706	1.223	10	20	BDCD	
CC[C@@H](O)CNCc1ccc2c(c1)CCO2	229964590	XNYISUZYZDPDII-GFCCVEGCSA-N	221.300	1.482	10	20	BDCD	
CN(Cc1cccc(F)c1O)CC(C)(C)CN	843056441	KAUDENMQMOCDFL-UHFFFAOYSA-N	240.322	1.948	10	20	BDCD	
CCOc1ccc(O)c(CNC2CSC2)c1	877635318	MCACFYCGLFHTNZ-UHFFFAOYSA-N	239.340	1.996	10	20	BDCD	
CC(C)[C@H](C(=O)N(C)c1ccc(N)cc1)[C@H](C)N	877076067	LUVAQDZZBUPXEE-GWCFXTLKSA-N	249.358	1.851	10	20	BDCD	
CCN(C)C(=O)NCc1ccc(N)cc1	85964727	ZGDFYTLUDKJYFG-UHFFFAOYSA-N	207.277	1.430	10	20	BDCD	
Cc1cccc(CN[C@H](C)CC(N)=O)c1O	162704813	ZIQVBPYOGJWKIE-SECBINFHSA-N	222.288	1.054	10	20	BDCD	
C[C@H]1OCC[C@@H]1C(=O)NCc1ccccc1O	163138675	ZHECCSVZLJFIQE-KOLCDFICSA-N	235.283	1.433	10	20	BDCD	
Cc1cccc(CN[C@H]2CCN[C@H](C)C2)c1O	841061560	KCIHKRWJMGXLTK-YPMHNXCESA-N	234.343	1.931	10	20	BDCD	
COC[C@@](C)(O)CNCc1c(C)cccc1O	877026281	BMEQLRQNCMLZFI-ZDUSSCGKSA-N	239.315	1.188	10	20	BDCD	
Cc1cccc(O)c1CNCc1ccon1	877075774	HECVSSUQIXTWGM-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
C[C@@H](N)[C@@H](C)C(=O)Nc1ccc(N)cc1	294873979	CQOFXJYUUJXALP-HTQZYQBOSA-N	207.277	1.191	10	20	BDCD	
C[C@@H](CCO)CN[C@@H]1CCc2cccc(O)c21	297529341	DLRNSVXYGKQESH-CMPLNLGQSA-N	235.327	1.988	10	20	BDCD	
Cc1ccc(O)c(CNCC[C@@H](O)C2CC2)c1	898203490	VVEQWTVZBSUZNT-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
CCn1nncc1CNCc1cccc(C)c1O	529639929	STGDNQYLLJLZRZ-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
CO[C@H](C)CS(=O)(=O)Nc1ccc(O)cc1	193109342	MLZBXMDSSQZKGQ-MRVPVSSYSA-N	245.300	1.169	10	20	BDCD	
Cc1cc(O)c(CN2C[C@H]3C[C@H]2C(=O)O3)cc1C	294697191	CUFZSVISSXSWBU-NEPJUHHUSA-N	247.294	1.509	10	20	BDCD	
CC[C@@H](NCC1CNC1)c1ccc(F)cc1O	817964944	KBSKADQNZIZHQQ-GFCCVEGCSA-N	238.306	1.791	10	20	BDCD	
C[C@@H](NCc1cc(Cl)cc(F)c1O)C(=O)O	820917369	DESXGTMMGVEOOI-RXMQYKEDSA-N	247.653	1.747	10	20	BDCD	
O=C(NCc1ccncc1)c1cc(O)cs1	731866319	LRIABFSTVDLUDC-UHFFFAOYSA-N	234.280	1.779	10	20	BDCD	
Cc1cccc(CNC[C@]2(C)CCC(=O)N2)c1O	835061142	QGFLAKXMNHZZFQ-AWEZNQCLSA-N	248.326	1.459	10	20	BDCD	
Nc1ccc(CCN[C@H]2CCCNCC2)cc1	841037908	CRKSWPLLSJDFBS-AWEZNQCLSA-N	233.359	1.543	10	20	BDCD	
Cc1cccc(CN[C@H](CO)CCF)c1O	846098392	AYBOKINOVNCRCC-NSHDSACASA-N	227.279	1.511	10	20	BDCD	
O=C(N[C@@H]1C=CCC1)c1c(F)ccc(O)c1O	857309260	XWXSTHVOGVSHPX-SSDOTTSWSA-N	237.230	1.685	10	20	BDCD	
COc1cccc(O)c1CN(C)Cc1cn[nH]c1	769423665	GEVLWGZKKSQKKX-UHFFFAOYSA-N	247.298	1.756	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3C[C@]3(CO)C2)c1O	783744652	SXYJTZBFYABHGH-GXTWGEPZSA-N	233.311	1.515	10	20	BDCD	
CCOC(=O)[C@H](C)NCc1cc(F)ccc1O	83369145	YRDNYMVSAKCAQN-QMMMGPOBSA-N	241.262	1.573	10	20	BDCD	
COCC1CN(Cc2cc(C)ccc2O)C1	895971957	YUHCRXSXXOARJO-UHFFFAOYSA-N	221.300	1.779	10	20	BDCD	
Cc1cn(C)nc1CNCc1ccc(N)cc1	1579818024	BYSVWVJLOSUNRI-UHFFFAOYSA-N	230.315	1.601	10	20	BDCD	
COC(=O)[C@H](C)NCc1cccc(C)c1O	165151727	TUPHZTZUPIFTGT-VIFPVBQESA-N	223.272	1.352	10	20	BDCD	
CCCNC(=O)NCc1ccc(N(C)C)cc1	31726764	BZDXVTSQWJOXHV-UHFFFAOYSA-N	235.331	1.962	10	20	BDCD	
Oc1ccccc1CN1CC[C@H]2NCC[C@H]2C1	383862454	ODYOVAZMJFDTFD-WCQYABFASA-N	232.327	1.576	10	20	BDCD	
COC(C)(C)CNCc1ccccc1O	133023453	QSVCDZUVZKGSSS-UHFFFAOYSA-N	209.289	1.907	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2cccnc2)C1	409422207	BWYUTTXJJKGJHK-UHFFFAOYSA-N	203.205	1.216	10	20	BDCD	
NC[C@]12CCC[C@H]1CN(Cc1ccccc1O)C2	310824630	CESRDABOXUMKSB-ZFWWWQNUSA-N	246.354	1.953	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](CN)C[C@@H]2C)c1	215985044	XTAJWQDQEKRHGU-NWDGAFQWSA-N	234.343	1.870	10	20	BDCD	
CCN(CCN)Cc1ccc(N(C)C)cc1	76610951	HAEZIULAKGTYBM-UHFFFAOYSA-N	221.348	1.533	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCCCNC2=O)c1	71407443	AMBMKQXXHNFUFY-LBPRGKRZSA-N	248.326	1.459	10	20	BDCD	
CC(C)[C@@H](N)C(=O)NCc1ccc(N(C)C)cc1	40825818	WZZBIVWNRLYLBZ-CYBMUJFWSA-N	249.358	1.352	10	20	BDCD	
C[C@H](O)CN[C@@H](C)c1cc(F)cc(F)c1O	134899842	OCEFYCUWARQNOH-BQBZGAKWSA-N	231.242	1.702	10	20	BDCD	
C[C@@]1(CNC(=O)Cc2ccc(N)cc2)CCCO1	83946112	VJXFLRQGSUKOAG-AWEZNQCLSA-N	248.326	1.497	10	20	BDCD	
CCOc1cccc(CN[C@@H](C)CN)c1O	841063204	JYCGMTQGPCZUOA-VIFPVBQESA-N	224.304	1.228	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)C[C@@H](C)N)c1	843129855	SDSCVKFENJCSOT-ZJUUUORDSA-N	238.331	1.616	10	20	BDCD	
CC[C@H](C(=O)NCc1ccccc1O)[C@H](C)O	842230019	OXGFCCMLTQUKCC-ONGXEEELSA-N	237.299	1.415	10	20	BDCD	
CCCNC(=O)NCc1cc(C)ccc1O	858103292	NXLSWHGYEICWGE-UHFFFAOYSA-N	222.288	1.910	10	20	BDCD	
COCCN(C)Cc1cc2c(cc1O)OCO2	68960638	WFGRSQDKOROOJB-UHFFFAOYSA-N	239.271	1.199	10	20	BDCD	
C[C@H](CN)NC(=O)N[C@H](C)c1ccccc1O	892062817	VSRCXCPRGJAOOB-RKDXNWHRSA-N	237.303	1.100	10	20	BDCD	
COc1ccc(CNC(C)C)c(O)c1OC	892501083	FGDCZSBHRXDZEK-UHFFFAOYSA-N	225.288	1.907	10	20	BDCD	
c1cc2c(cc1CNC1CCNCC1)CCO2	84516337	HHWMNLGQEDHRCH-UHFFFAOYSA-N	232.327	1.463	10	20	BDCD	
Cc1cccc(CN[C@H]2COC[C@H]2C)c1O	710997378	HLRWBJGEOAMDLB-PWSUYJOCSA-N	221.300	1.825	10	20	BDCD	
O=C(NC1CC=CC1)c1cccc(O)c1O	163278464	ORSWKGIISMZGGY-UHFFFAOYSA-N	219.240	1.546	10	20	BDCD	
CCO[C@H](C)C(=O)Nc1ccc(N)cc1	22165678	DXSFFLYTQTUAMM-MRVPVSSYSA-N	208.261	1.632	10	20	BDCD	
CCCC(=O)NCc1cccc(OC)c1O	105653069	CETFUNAACGLJDB-UHFFFAOYSA-N	223.272	1.817	10	20	BDCD	
COCCN[C@H](C)c1ccc(C)cc1O	20085590	YARDXGAUZIHGPV-SNVBAGLBSA-N	209.289	1.998	10	20	BDCD	
CCN(CC(N)=O)Cc1cccc(Cl)c1O	188466456	BUCNDRWIEYPEQP-UHFFFAOYSA-N	242.706	1.353	10	20	BDCD	
CC1(CNC(=O)Cc2ccc(N)cc2)CC1	226372771	QMKMJPGTVULPTG-UHFFFAOYSA-N	218.300	1.728	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](C(=O)O)[C@@H]2C)c1	92942042	XHSUJZLWULQOQJ-CMPLNLGQSA-N	249.310	1.996	10	20	BDCD	
C[C@@H](CN)CN[C@H](C)c1ccccc1O	817961785	CHXFIXBAVWZMKV-VHSXEESVSA-N	208.305	1.638	10	20	BDCD	
Cc1cc(Cl)cc(CN(C)CC(=O)O)c1O	820976330	BBEBYLGGZGKILD-UHFFFAOYSA-N	243.690	1.870	10	20	BDCD	
N[C@H]1C[C@H](NCc2cc(Cl)cc(F)c2O)C1	906518395	YHJOKKWEURQRIP-KYZUINATSA-N	244.697	1.764	10	20	BDCD	
CCN[C@H](C)CNCc1ccc2c(c1)CCO2	841064246	AEZRQUGPISVACW-LLVKDONJSA-N	234.343	1.709	10	20	BDCD	
CN(Cc1nncs1)c1ccc2c(c1)OCO2	930093068	IWWCQZBAYAUXJW-UHFFFAOYSA-N	249.295	1.903	10	20	BDCD	
C[C@@H]1[C@H](C(=O)N(C)c2ccc(N)cc2)CCN1C	877076117	MHXGCAJYIJRRDS-ZWNOBZJWSA-N	247.342	1.572	10	20	BDCD	
COc1ccc2c(c1)CCCN2Cn1cnnc1	776761666	GDYCHAUOESNQNJ-UHFFFAOYSA-N	244.298	1.697	10	20	BDCD	
C[C@@H](NCC[S@@](C)=O)c1ccccc1O	163980617	JBMCWKXQRIBUDW-PSLIRLAXSA-N	227.329	1.421	10	20	BDCD	
CC1(NC(=O)Cc2ccc(N)cc2)CCNCC1	193369558	KXCVKDMFWIIPMQ-UHFFFAOYSA-N	247.342	1.070	10	20	BDCD	
CC[C@H](C)C(=O)NCc1cccc(O)c1O	1349077907	FOIGEIJBGFXQRM-QMMMGPOBSA-N	223.272	1.760	10	20	BDCD	
Cc1ccc(O)c(CNCC2(CO)CCC2)c1	184372496	LWGDIUBQUNJBEI-UHFFFAOYSA-N	235.327	1.953	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@H]1COCCO1)CC2	386534193	PRSZTEAAHPQUPJ-NWDGAFQWSA-N	249.310	1.385	10	20	BDCD	
CC[C@@H](N[C@@H](C)c1ccccc1O)C(=O)O	820419171	NPDLWPQGACLQKJ-WCBMZHEXSA-N	223.272	1.906	10	20	BDCD	
CCOCCOCCNCc1ccccc1O	922941987	RXHMAQGEFBHBRB-UHFFFAOYSA-N	239.315	1.535	10	20	BDCD	
CCNC(=O)[C@H](C)NCc1cccc(C)c1O	127869491	QHKIFUIRJYYHID-JTQLQIEISA-N	236.315	1.315	10	20	BDCD	
C[C@H]1C[C@@H](C)CN1C(=O)c1cccc(O)c1O	126567793	FSAXBSXBFGIVAZ-BDAKNGLRSA-N	235.283	1.968	10	20	BDCD	
CN[C@H]1CCN(Cc2cccc(OC)c2O)C1	128903564	QESXCKGNCGGCAM-NSHDSACASA-N	236.315	1.195	10	20	BDCD	
C[C@@H]1C[C@H](N)CCN1Cc1cc(F)ccc1O	220334486	FZIMEWAYARIGJQ-BXKDBHETSA-N	238.306	1.843	10	20	BDCD	
C[C@@H](CCO)N[C@H](C)c1cc(F)ccc1O	132546972	AKKOQATZGVEWMQ-DTWKUNHWSA-N	227.279	1.953	10	20	BDCD	
COC(=O)[C@H](NCc1cc(C)ccc1O)C1CC1	276451719	JYMATRFIKQBKKL-CYBMUJFWSA-N	249.310	1.742	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1CCCCO1	295191995	LEXUAHYTWAFZPH-UHFFFAOYSA-N	241.218	1.405	10	20	BDCD	
C[C@H](N)CCN[C@@H]1CCc2cccc(O)c21	817952336	JWCOFQFGKHQQRH-GXSJLCMTSA-N	220.316	1.706	10	20	BDCD	
CN(C(=O)/C=C/c1cccnc1)c1ccn(C)n1	492729314	AMDPBIBTEUUUDA-AATRIKPKSA-N	242.282	1.491	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCCNCC1	162941402	PZELZDNXQQTQSV-GFCCVEGCSA-N	220.316	1.624	10	20	BDCD	
O=C(NC[C@H]1C=CCC1)c1cccc(O)c1O	711703387	KWOLIAXQOFVEJW-VIFPVBQESA-N	233.267	1.794	10	20	BDCD	
OC[C@@H](CC(F)F)NCc1cc(F)ccc1O	717712903	KQNCLTIOOHRVGU-SECBINFHSA-N	249.232	1.637	10	20	BDCD	
Cn1cc(CSc2nccs2)nn1	307702642	PQNHJHXLEFRNGQ-UHFFFAOYSA-N	212.303	1.564	10	20	BDCD	
COc1cccc(CNC[C@H](C)N(C)C)c1O	38088870	XBVMRTKZODUYEA-JTQLQIEISA-N	238.331	1.441	10	20	BDCD	
CC(C)CNC(=O)/C=C\c1ccc(O)c(O)c1	210385609	RNZWOGIRBNBORU-XQRVVYSFSA-N	235.283	1.883	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@H](CN)C2)cc1	44527754	MBRGPNPEIUXUBT-CQSZACIVSA-N	247.386	1.923	10	20	BDCD	
C[C@H](N[C@@H]1CCOC1)c1cc(F)ccc1O	87784328	ZROBVWDEYMQABN-WCBMZHEXSA-N	225.263	1.971	10	20	BDCD	
CC[C@@H](C)OCC(=O)NCc1ccccc1O	269852687	YEPUCSQVTLKDEN-SNVBAGLBSA-N	237.299	1.824	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1	368351291	DIGYKMACIXAGDB-ITGUQSILSA-N	233.311	1.371	10	20	BDCD	
CC1(C)NCC[C@H]1NCc1cc(F)ccc1O	841086077	LTIUWEVYQAPQQJ-GFCCVEGCSA-N	238.306	1.761	10	20	BDCD	
CCc1cccc(CN2CC(C(=O)NC)C2)c1O	848916534	HZMFEUKSLGVVFF-UHFFFAOYSA-N	248.326	1.132	10	20	BDCD	
CC(C)CONC(=O)NCc1ccc(N)cc1	1120527230	PCXZVHLWHKFIKG-UHFFFAOYSA-N	237.303	1.656	10	20	BDCD	
C[C@H]1COC[C@@H]1NCc1ccccc1O	688046042	GWKYORWWPOBGNY-ONGXEEELSA-N	207.273	1.517	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C(F)(F)F)cc1	70266834	BOMPEMYMESNBGK-UHFFFAOYSA-N	246.232	1.931	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(N)cc2)CC[C@H]1N	1336286195	OLRAFEYBVLLPBU-GXTWGEPZSA-N	233.359	1.828	10	20	BDCD	
C[C@@H](CCCO)CNC(=O)c1cc(O)cs1	1347775486	LHGQNYVTQPVLMM-QMMMGPOBSA-N	243.328	1.592	10	20	BDCD	
COC(=O)N1CC(C)(NCc2ccc(N)cc2)C1	1578823378	ZWNUEROIKVKBSM-UHFFFAOYSA-N	249.314	1.199	10	20	BDCD	
CCN(CC(F)F)C(=O)c1cccc(O)c1O	193162211	ZLDHBACCWMBWNR-UHFFFAOYSA-N	245.225	1.825	10	20	BDCD	
C[C@H](N[C@@H]1CC[C@H]1O)c1ccc(N(C)C)cc1	818357725	JUMHREUCNPUGDH-ZLKJLUDKSA-N	234.343	1.927	10	20	BDCD	
CO[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1	151884577	ATFFQTXXQNSZEN-ZDUSSCGKSA-N	248.326	1.449	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1=CCCC1	182522524	NDGHUGOFLOMWAP-UHFFFAOYSA-N	233.267	1.824	10	20	BDCD	
COc1cccc(CNC(C)(C)CCO)c1O	135228005	FUOCXRTZQUGFEE-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
O=C(OCCCF)c1cc(O)cs1	388346830	MNCXSFBQFMCIOG-UHFFFAOYSA-N	204.222	1.970	10	20	BDCD	
CN(C)c1ccc(CN(C(=O)CO)C2CC2)cc1	294257041	GHIIEMSYUFLWGE-UHFFFAOYSA-N	248.326	1.236	10	20	BDCD	
C[C@H](N)C[C@H](C)NCc1ccc2c(c1)CCO2	817902095	HZLRPDIFJKBNBF-QWRGUYRKSA-N	234.343	1.837	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H](O)C2)cc1Cl	824548854	SJZRSAKIEJIOKM-SNVBAGLBSA-N	241.718	1.921	10	20	BDCD	
COCC(=O)N[C@H](C)c1ccccc1O	827917700	PFKHTROWXSQUEV-MRVPVSSYSA-N	209.245	1.216	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](C)CN)c1	841048325	HJXSOXWEKGXZCJ-SECBINFHSA-N	224.304	1.085	10	20	BDCD	
COc1cccc(CNCC(C)(C)N)c1O	841030381	GUDAXTDKCYBUTG-UHFFFAOYSA-N	224.304	1.228	10	20	BDCD	
CC[C@@H](COC)NCCc1ccc(N)cc1	841034586	HXSGKCLZDYVNHO-ZDUSSCGKSA-N	222.332	1.826	10	20	BDCD	
C[C@H](NC[C@H]1C[C@H](N)C1)c1cc(F)ccc1O	873258740	VSDALQXVAIZWDZ-QXEWZRGKSA-N	238.306	1.919	10	20	BDCD	
COC(=O)[C@H]1CCN(Cc2ccccc2O)[C@@H]1C	787420566	IYECOHSCTKIPNA-PWSUYJOCSA-N	249.310	1.776	10	20	BDCD	
CC1(N)CCN(Cc2ccccc2O)CC1	704570533	BSWLJYPKUHIJQZ-UHFFFAOYSA-N	220.316	1.705	10	20	BDCD	
CO[C@H]1C[C@H](NCc2cccc(C)c2O)C1	706547660	ZQGUCGHKRDNBRG-HAQNSBGRSA-N	221.300	1.968	10	20	BDCD	
COC1(C(=O)N(C)Cc2ccccc2O)CCC1	782010859	FKIKBNUGEFBFGW-UHFFFAOYSA-N	249.310	1.920	10	20	BDCD	
C[C@H](O)CCSc1ncc(C(=O)O)s1	1609788694	XUCXBNFSWRUCRK-YFKPBYRVSA-N	233.314	1.704	10	20	BDCD	
CC(C)[C@@H](CCO)NCc1ccccc1O	164859694	WXQBMMVYGOVYEV-GFCCVEGCSA-N	223.316	1.889	10	20	BDCD	
CN(CC(=O)NC1CCCC1)c1ccc(N)cc1	20374601	FNHCBJFAIDQLPV-UHFFFAOYSA-N	247.342	1.764	10	20	BDCD	
Cc1cccc(CN[C@@H]2C[C@@H](O)C2(C)C)c1O	128233416	XMQCEBJYXGJSSU-VXGBXAGGSA-N	235.327	1.950	10	20	BDCD	
CCN(CC(N)=O)Cc1cc(Cl)ccc1O	188466351	PKQBXDKRPOWBJT-UHFFFAOYSA-N	242.706	1.353	10	20	BDCD	
C[C@H](O)[C@@H]1CCN(Cc2ccccc2O)C1	134735118	AKKCRFDCTQIEJJ-WDEREUQCSA-N	221.300	1.595	10	20	BDCD	
Cc1ccc(O)c(CN2CCN[C@H](C)C2)c1	83814060	JFWZSKPYFWRNAJ-LLVKDONJSA-N	220.316	1.494	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@H]1N	251658206	GTFRCGNUOGDCCG-IUODEOHRSA-N	247.386	1.922	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CN1CCCC1	820880282	ZLKAKQHBDBMDTK-UHFFFAOYSA-N	248.326	1.446	10	20	BDCD	
CCn1c(C)nnc1N(C)Cc1ccccc1O	290978170	JMHWFESYEFXOGL-UHFFFAOYSA-N	246.314	1.948	10	20	BDCD	
C[C@H]1COCC[C@H]1NCCc1ccc(N)cc1	817957639	NHBJGIHSTBYUOL-SMDDNHRTSA-N	234.343	1.826	10	20	BDCD	
COc1cccc([C@H](C)N[C@@H](C)CCO)c1O	846148455	ZQIAZJMAXXYUFA-UWVGGRQHSA-N	239.315	1.822	10	20	BDCD	
CN(CC(C)(C)O)C(=O)c1cc(O)cs1	748420025	UWZLAUTZZSKZMB-UHFFFAOYSA-N	229.301	1.297	10	20	BDCD	
CC(C)C[C@H](CN)NCc1cc(F)ccc1O	841038020	FVOINLQXOPXSSC-GFCCVEGCSA-N	240.322	1.994	10	20	BDCD	
COc1ccc2c(c1)CCCN2C[C@@H](C)O	799112285	OBXFXFPSYJGXEV-SNVBAGLBSA-N	221.300	1.829	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@@H]1CCCO1	708446124	ZMWUBLSIHCFXPV-JTQLQIEISA-N	243.253	1.939	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H]2CNC[C@@H]2C1	876818589	WKZRCUCCIKCTFL-TXEJJXNPSA-N	232.327	1.352	10	20	BDCD	
CCCS(=O)(=O)N[C@H](C)c1ccccc1O	867834983	YKCZOEAWKNTHRA-SECBINFHSA-N	243.328	1.783	10	20	BDCD	
C[C@H](NCCO)c1cc2c(cc1O)CCCC2	184890308	QGPDCQOMGHNUME-JTQLQIEISA-N	235.327	1.914	10	20	BDCD	
OCC1(CNCc2ccc3c(c2)CCO3)CC1	80246436	LFRHXFPIDNEARO-UHFFFAOYSA-N	233.311	1.484	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCCNC1	162938085	BEESRBDQLYDCGZ-LLVKDONJSA-N	206.289	1.234	10	20	BDCD	
C[C@H](N[C@H](C)CN)c1cc([N+](=O)[O-])ccc1O	817966165	HSBGQOJGUUCJRH-SFYZADRCSA-N	239.275	1.298	10	20	BDCD	
Cc1noc(C(=O)N[C@H](C)c2ccccc2O)n1	866161722	UWHHXGFLMHMERC-SSDOTTSWSA-N	247.254	1.575	10	20	BDCD	
C[C@@H](NCCN(C)C)c1c(O)cccc1F	886608898	HXODKUUYGCNURP-SECBINFHSA-N	226.295	1.744	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)N	37807402	SKTUTFUYNOTGAT-LLVKDONJSA-N	249.358	1.448	10	20	BDCD	
Nc1ccc(CN2CC(=O)N(CC3CC3)C2)cc1	1336286965	UYKAPWUBFJWDNF-UHFFFAOYSA-N	245.326	1.281	10	20	BDCD	
CN(CC1CCNCC1)c1ccc(N)cc1	863556114	MHGBALNPDLHFLQ-UHFFFAOYSA-N	219.332	1.705	10	20	BDCD	
CO[C@H](C)C(=O)N(C)c1ccc(N)cc1	163761748	UJOQHYNEHPGTCL-MRVPVSSYSA-N	208.261	1.267	10	20	BDCD	
Cc1ccc(CN[C@H](CO)C2CC2)c(O)c1	877045539	XWRNEMMBAPFGGD-GFCCVEGCSA-N	221.300	1.561	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cnco1	759382370	ZXIKYFSZNJBUAL-UHFFFAOYSA-N	232.239	1.652	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCO[C@@H]1C)c1ccccc1O	827940332	AWBVTEWEMKHXSR-CKYFFXLPSA-N	249.310	1.994	10	20	BDCD	
C[C@@H](CO)CSc1ncc(C(=O)O)s1	308460121	FJZLARGCUGIYEW-YFKPBYRVSA-N	233.314	1.562	10	20	BDCD	
OCCNCc1ccc2c(c1)CCCO2	82532866	MHPBNWXOYOXNQB-UHFFFAOYSA-N	207.273	1.094	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](C(=O)O)[C@H]2C)c1	227582305	XHSUJZLWULQOQJ-PWSUYJOCSA-N	249.310	1.996	10	20	BDCD	
C[C@@H](N)CN[C@H]1CCc2cccc(O)c21	817971822	HJPICKYIAZJNQD-SCZZXKLOSA-N	206.289	1.316	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1[C@H]2CCC[C@H]12	910950464	FTSSQFVYMLINEQ-QWRGUYRKSA-N	247.294	1.760	10	20	BDCD	
CN(Cc1ccon1)C(=O)c1cc(O)cs1	740141987	CQOLARHFHOREEA-UHFFFAOYSA-N	238.268	1.714	10	20	BDCD	
CCOc1ccc(O)c(CN(C)CCN)c1	841099356	ITLWYAXVIYUVHU-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
O=C(NCCC1CC1)c1cc(O)cs1	743733889	SDXDMQMGBTWHCK-UHFFFAOYSA-N	211.286	1.984	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2C[C@@H]3CC[C@H]2N3)cc1	911661902	ZLSZKVGZXIYDKE-QJPTWQEYSA-N	231.299	1.348	10	20	BDCD	
O=C(N[C@H]1CCCC[C@@H]1O)c1cc(O)cs1	757904118	FUGUVIWVVHRKIM-IUCAKERBSA-N	241.312	1.487	10	20	BDCD	
CCOc1ccc(CN(C)CCO)c(O)c1	768136697	BSZLZHHYXVHDRC-UHFFFAOYSA-N	225.288	1.215	10	20	BDCD	
CC(=O)OC[C@@H](C)NCc1ccc2c(c1)CCO2	892793021	KIOAHMCMPNJZNB-SNVBAGLBSA-N	249.310	1.663	10	20	BDCD	
COc1cc(C)cc(CN[C@H](C)CO)c1O	894201280	XHWAIIJNOIMFND-SECBINFHSA-N	225.288	1.180	10	20	BDCD	
[N-]=[N+]=NCCN1CCN([C@H]2CCSC2)CC1	409429989	PSTFECXCVICWFP-JTQLQIEISA-N	241.364	1.420	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC[C@H](CF)C1	409429081	NTJDMKFZIQLKLX-SSDOTTSWSA-N	200.217	1.505	10	20	BDCD	
OCCCNCc1cc(F)cc(F)c1O	708388899	JKNYENYIPKVPFP-UHFFFAOYSA-N	217.215	1.142	10	20	BDCD	
COc1cccc(O)c1CNCCN1CCC1	752106988	NCTYDBDCNJUGDF-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H]2C[C@@H]2F)cc1	1263063232	PPYKCVZKBOTWTH-QWRGUYRKSA-N	222.263	1.286	10	20	BDCD	
C[C@H]1C[C@H](NCc2cc(F)ccc2O)CO1	402183636	BQCFVGZFAGROPQ-KWQFWETISA-N	225.263	1.798	10	20	BDCD	
OCC1(CN[C@H]2CCc3cccc(O)c32)CC1	383842227	KOHJYVZSIDRCRA-NSHDSACASA-N	233.311	1.742	10	20	BDCD	
Oc1ccc(Cl)cc1CN1CCNCC1	38086717	RSXKMPXCUPCYIC-UHFFFAOYSA-N	226.707	1.451	10	20	BDCD	
Oc1ccccc1CNC[C@H](O)C1CC1	70880277	RTNHHAZPHGGSJN-LBPRGKRZSA-N	207.273	1.253	10	20	BDCD	
COc1cccc(CN(C)[C@H](C)CO)c1O	809745923	NOSJZYNRDPJJKG-SECBINFHSA-N	225.288	1.213	10	20	BDCD	
CCNCCN[C@H](C)c1ccccc1O	817953297	ZGIVZFLPOSXBMT-SNVBAGLBSA-N	208.305	1.652	10	20	BDCD	
Cc1ccc(CNC2CCOCC2)c(O)c1	876949611	SUEOMWUGFHKYLC-UHFFFAOYSA-N	221.300	1.969	10	20	BDCD	
CCOc1cccc(CN2CC(OC)C2)c1O	839128687	SBUTUEIZLVQVHE-UHFFFAOYSA-N	237.299	1.622	10	20	BDCD	
COC[C@H](NC(=O)c1cc(O)cs1)C(C)C	743623055	VIWCVHPICCSUNG-VIFPVBQESA-N	243.328	1.855	10	20	BDCD	
CN(C(=O)[C@H]1NCC1(C)C)c1ccc(N)cc1	877077623	OZHRDYWUQSXPSH-LLVKDONJSA-N	233.315	1.230	10	20	BDCD	
C[C@@H](N[C@@H]1CCOC[C@H]1O)c1ccccc1O	872141369	UCYPRVWXPPAQMV-IRUJWGPZSA-N	237.299	1.193	10	20	BDCD	
COC1(C(=O)NCc2ccccc2O)CCC1	272736974	BQFYVYVTCVDTGI-UHFFFAOYSA-N	235.283	1.578	10	20	BDCD	
Cc1cc(O)c(CNCC(C)(C)O)cc1C	164538968	BENFXBWTXVBMCF-UHFFFAOYSA-N	223.316	1.870	10	20	BDCD	
CCN(C)C(=O)CNCc1c(C)cccc1O	877423314	XINUWXRSCVQUEE-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)[C@@H](C(=O)O)C1	1604754416	VZBPKHHLDCEGMG-ZWNOBZJWSA-N	248.326	1.954	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](O)C(C)C)c1	123905624	AFVPJOOCPKZNFD-ZDUSSCGKSA-N	223.316	1.807	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@@H]2CC[C@H]2O)c1	378731504	LDPTXKMFSKMGMB-IRUJWGPZSA-N	221.300	1.875	10	20	BDCD	
COC(=O)CN(Cc1ccc(N)cc1)C1CC1	35366010	WKEBAWWVMXLLON-UHFFFAOYSA-N	234.299	1.406	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)[C@H]1CCOC1	135262191	XCLBHFWCVFETKH-LBPRGKRZSA-N	234.299	1.059	10	20	BDCD	
CC[C@H](N)CN[C@@H](C)c1cc(OC)ccc1O	817980864	XQJKKTRMAGGVFJ-UWVGGRQHSA-N	238.331	1.789	10	20	BDCD	
Cc1cccc(CN(C)Cc2cn(C)nn2)c1O	827305706	XGDROUZRYXNEDI-UHFFFAOYSA-N	246.314	1.461	10	20	BDCD	
Cc1ccc([C@@H](C)NCC2(N)CC2)c(O)c1	902405633	JMHBXZONJBZZPX-SNVBAGLBSA-N	220.316	1.843	10	20	BDCD	
COc1cc(C)cc(CN(C)OC)c1O	917065024	YOAHAJAMANTHTF-UHFFFAOYSA-N	211.261	1.702	10	20	BDCD	
C[C@@H](C[C@@H](C)N)NC(=O)Cc1ccc(N)cc1	843503280	JTDPUANMNLLOTO-ZJUUUORDSA-N	235.331	1.053	10	20	BDCD	
COC(=O)C1(C)CN(Cc2c(C)cccc2O)C1	877599655	CPEFLVIILHYYSZ-UHFFFAOYSA-N	249.310	1.696	10	20	BDCD	
C[C@@H](NC/C=C\CO)c1c(O)cccc1F	886636071	FSWKWNILDIJVJU-PKRMOACSSA-N	225.263	1.730	10	20	BDCD	
CC[C@H](C)C[C@@H](N)C(=O)N(C)c1ccc(N)cc1	1122172276	BLIHYHPTGDYKMA-GXFFZTMASA-N	249.358	1.995	10	20	BDCD	
C[C@H](N[C@@H](C)c1ccccc1O)c1ncn(C)n1	275622492	AGEAIVBPEAGZBE-UWVGGRQHSA-N	246.314	1.933	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)C[C@@H](C)O	877195271	FWVZDSPZDRFHBD-WDEREUQCSA-N	223.316	1.950	10	20	BDCD	
CN1CCC[C@H]1C(=O)NCc1ccccc1O	299580197	SXNOQNAHWCFXDX-NSHDSACASA-N	234.299	1.103	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCCN1C	299548731	QFVFSXDECYYDOV-GFCCVEGCSA-N	248.326	1.445	10	20	BDCD	
C[C@H]1NCCC[C@H]1NC(=O)Cc1ccc(N)cc1	193545398	GZDWSNYHEZAOME-ZWNOBZJWSA-N	247.342	1.068	10	20	BDCD	
C[C@H](O)[C@@H]1CCCN(Cc2ccc(N)cc2)C1	688874709	GFDFBBNTYGUYBJ-WCQYABFASA-N	234.343	1.862	10	20	BDCD	
CCOC1CN(C(=O)Nc2ccc(N)cc2)C1	382757734	RJODBAVYIMDPLT-UHFFFAOYSA-N	235.287	1.521	10	20	BDCD	
O=C(CCCCO)NCc1ccccc1O	228430397	GIKVDLDIVLKEOR-UHFFFAOYSA-N	223.272	1.171	10	20	BDCD	
COc1ccc(N(C)C[C@H](C)O)cc1OC	49820095	DENFMTMCHCMYTK-VIFPVBQESA-N	225.288	1.521	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H]1CO	191718164	MMPJQHKRSRBNEX-KOLCDFICSA-N	239.290	1.592	10	20	BDCD	
CC[C@H](N)CN[C@@H](C)c1ccc(F)cc1O	817980963	YOMMZIUDLFVWSL-WPRPVWTQSA-N	226.295	1.919	10	20	BDCD	
O=C(CC1(O)CCCC1)NCc1ccccc1O	735856035	CGRGAQOGEMACCF-UHFFFAOYSA-N	249.310	1.704	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2cnc[nH]2)c1	734018723	GQKNFZKVUAMOBI-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
Nc1ccc(CCNC[C@@H]2CCCOC2)cc1	841035084	KFLRFWTWLXPAOY-ZDUSSCGKSA-N	234.343	1.828	10	20	BDCD	
C[C@H]1C[C@H](NCc2cccc(F)c2O)CCN1	841061164	FRFTWNBXPGAIAV-GXSJLCMTSA-N	238.306	1.761	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](CN)C2CC2)c1	841027774	FXVQMQJGRDOLAB-LBPRGKRZSA-N	220.316	1.528	10	20	BDCD	
CN[C@H]1CCN(Cc2cccc(C)c2O)C1	843045468	SHSZDWHBORMNLE-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
O=C(NCc1ccccc1O)NC1CC=CC1	759786866	LCFFAGQCUFCYHU-UHFFFAOYSA-N	232.283	1.910	10	20	BDCD	
Cc1nonc1CN[C@H]1CCc2cccc(O)c21	872135297	DYSWCPKLFRMTQJ-JTQLQIEISA-N	245.282	1.861	10	20	BDCD	
Cc1ccc(CN2CC(=O)N[C@H](C)C2)c(O)c1	877568096	XKFKPGYBFXNBCC-SNVBAGLBSA-N	234.299	1.021	10	20	BDCD	
CCOC(=O)CN(C)c1ccc(OC)c(F)c1	121748793	DOFWQWSFOFIPPP-UHFFFAOYSA-N	241.262	1.834	10	20	BDCD	
C[C@@H]1C[C@@H](CN)CN1C(=O)Cc1ccc(N)cc1	834361294	HLSQBNXQQPUVST-PWSUYJOCSA-N	247.342	1.007	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)CCO	877052245	UDADQXSWWMXIOQ-SNVBAGLBSA-N	209.289	1.561	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCCCCN2)cc1	1343474698	XRIQTHWCCKXYOG-CYBMUJFWSA-N	247.342	1.417	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@]1(C)CCNC1	62896291	LDNAYBUZFZROHY-AWEZNQCLSA-N	248.326	1.350	10	20	BDCD	
CC1(C)[C@H](O)C[C@H]1NCc1cc(F)ccc1O	189967872	RISCGNHGUPMMPW-VXGBXAGGSA-N	239.290	1.780	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H]2CCCO2)cc1	33465157	NFGYMQHOUCZLJA-GFCCVEGCSA-N	234.299	1.107	10	20	BDCD	
Nc1ccc(CC(=O)NCC2CCC2)cc1	37179163	PHKPEEAOKDXENK-UHFFFAOYSA-N	218.300	1.728	10	20	BDCD	
COCCCNCc1cc(F)ccc1O	83347384	XHMUTIXIZGMASG-UHFFFAOYSA-N	213.252	1.657	10	20	BDCD	
CN(C)c1ccc(Cn2ccnc2)cc1	193412716	IAGPJOCZGMRNNT-UHFFFAOYSA-N	201.273	1.997	10	20	BDCD	
CC(C)[C@@H]1NCC[C@H]1C(=O)Nc1ccc(N)cc1	294785019	OATZHPNBOJRRKX-OLZOCXBDSA-N	247.342	1.841	10	20	BDCD	
C[C@@H](N[C@H](CN)C1CC1)c1ccc(F)cc1O	817961264	VZZJHPDNXHVHIR-PRHODGIISA-N	238.306	1.919	10	20	BDCD	
COc1cc(O)ccc1NS(=O)(=O)C1CC1	901704325	QPNBSLAQXOFOOX-UHFFFAOYSA-N	243.284	1.305	10	20	BDCD	
CC(=O)C[C@@H](C)NC(=O)c1cc(O)cs1	830873448	OJZXJVVRPVQFGZ-ZCFIWIBFSA-N	227.285	1.551	10	20	BDCD	
C[C@]1(NC(=O)c2cc(O)cs2)CCCOC1	831646012	RPVVFOSFWAAOOK-NSHDSACASA-N	241.312	1.753	10	20	BDCD	
COc1ccc(O)c(CNCC(F)(F)CN)c1	841060383	XTPVWJIZWHGLDL-UHFFFAOYSA-N	246.257	1.084	10	20	BDCD	
C/C=C(/C)C(=O)NCc1ccc(O)cc1O	910950040	AUXBBDCFGUXLIE-BAQGIRSFSA-N	221.256	1.680	10	20	BDCD	
Cc1cc(O)c(CNC[C@@H](C)C(=O)O)cc1C	848637331	FTTTYPGMAVBSBG-SNVBAGLBSA-N	237.299	1.819	10	20	BDCD	
N[C@@H]1CCC[C@@H](NCc2cccc(F)c2O)C1	841058258	RJWQTQKSDMQWMA-GHMZBOCLSA-N	238.306	1.891	10	20	BDCD	
CCNCCNCc1c(O)cccc1Cl	841038125	WUDJHUPOPLYHKP-UHFFFAOYSA-N	228.723	1.745	10	20	BDCD	
O=C(O)[C@H](C(=O)NCc1ccccc1O)C1CC1	852942564	KBOHDPXKFASPDM-NSHDSACASA-N	249.266	1.119	10	20	BDCD	
Cc1cc(COC(=O)c2cccc(O)c2O)on1	758547885	NWXPMMPWHPSUGJ-UHFFFAOYSA-N	249.222	1.751	10	20	BDCD	
COc1cccc(O)c1CN1CCC[C@H](O)C1	768141390	ZSUNBYHWTVMPIE-JTQLQIEISA-N	237.299	1.358	10	20	BDCD	
CC1(C)CN(Cc2cccc(F)c2O)CCN1	779003810	QFGDXSMHVVQGSP-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
COc1cccc(CNC(=N)NCC2CC2)c1O	887352991	XNBSQAXWZFCODN-UHFFFAOYSA-N	249.314	1.425	10	20	BDCD	
COc1cccc(O)c1CNCC(C)(C)O	390459119	FBZMZLXARQSHPV-UHFFFAOYSA-N	225.288	1.261	10	20	BDCD	
Nc1ccc(CNCCC[C@H]2CCCN2)cc1	1334774491	JZLQYSTWUJVOHP-AWEZNQCLSA-N	233.359	1.891	10	20	BDCD	
Nc1ccc(N2CCN3C=CC[C@H]3C2)cc1	514264391	COFRMFJWCPHYMJ-ZDUSSCGKSA-N	215.300	1.677	10	20	BDCD	
COc1ccc(N(C)C[C@H](C)N)cc1F	258648323	AIKJTILNOSBOTM-QMMMGPOBSA-N	212.268	1.618	10	20	BDCD	
Cc1ccc(CN[C@@H](CO)CC(F)F)c(O)c1	877479306	UYPUWOUVDCGYRT-SNVBAGLBSA-N	245.269	1.806	10	20	BDCD	
Cc1nc(CCN[C@H](C)c2ccccc2O)n[nH]1	272872764	PDAYLXFRXONCDA-SECBINFHSA-N	246.314	1.712	10	20	BDCD	
C[C@@H](CO)N[C@@H](C)c1ccc(F)cc1O	62745816	PNPUWQFNRGTZNU-YUMQZZPRSA-N	213.252	1.563	10	20	BDCD	
Nc1ccc(NC(=O)CCN2CCCC2=O)cc1	22173607	ZDUXWUFAJQLZKA-UHFFFAOYSA-N	247.298	1.220	10	20	BDCD	
C=CC(=O)N(C)Cc1ccc(N(C)C)cc1	37828887	NICLGQUHHWLCRO-UHFFFAOYSA-N	218.300	1.897	10	20	BDCD	
COC(=O)CCCN[C@H](C)c1ccccc1O	37417077	TULYAOTUAKHNAS-SNVBAGLBSA-N	237.299	1.996	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCc2cn[nH]c2)c1	38005754	FNZRITCLDWSHPB-SECBINFHSA-N	247.298	1.975	10	20	BDCD	
CCN(CCOC)Cc1cc(F)ccc1O	226562191	VHWIFYBREUBDMY-UHFFFAOYSA-N	227.279	2.000	10	20	BDCD	
COc1ccc(CN[C@@H](C(=O)O)C2CC2)cc1C	86758447	YSHCRMLZSNXJLQ-CYBMUJFWSA-N	249.310	1.956	10	20	BDCD	
CCN(C)C(=O)CSc1nccs1	298834175	YAWDBWVNYPVBAL-UHFFFAOYSA-N	216.331	1.714	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@H](C)CO)c1	289458011	OCCWTBIWFOASJU-SECBINFHSA-N	225.288	1.213	10	20	BDCD	
COC(=O)c1cnc(S[C@@H]2CCOC2)s1	295426454	YSSMWDJPQHCPQB-ZCFIWIBFSA-N	245.325	1.811	10	20	BDCD	
CCN(Cc1cccc(OC)c1O)[C@H](C)CO	292774905	KVNIHMUVAAKQAL-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CCN2C)c1	712537291	CTSVVDAIMDPOTD-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
C[C@H](NCC1CNC1)c1cc(F)cc(F)c1O	817964892	IPPLOYFJABWOTR-ZETCQYMHSA-N	242.269	1.540	10	20	BDCD	
C[C@H]1C[C@H](NCCc2ccc(N)cc2)CCN1C	817956274	VNRNFJXPDVJFOF-SWLSCSKDSA-N	247.386	1.884	10	20	BDCD	
NOCCCNCc1cccc(Cl)c1O	904455813	BUGGLHIVWCVJMJ-UHFFFAOYSA-N	230.695	1.416	10	20	BDCD	
COC(=O)/C=C(/C)CN(C)Cc1ccccc1O	929969864	FEEILKSVDCICMG-FLIBITNWSA-N	249.310	1.943	10	20	BDCD	
CCOC(=O)[C@H](C)NCc1ccccc1O	49368551	HZXCUGQLDBFLNO-VIFPVBQESA-N	223.272	1.433	10	20	BDCD	
Cc1ccc(O)c(CNCc2ccn(C)n2)c1	213179911	LSOGRFUPJVPSNA-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
COc1cccc(O)c1CNC[C@H](C)OC	390661154	SFVGKMOXWWMZQS-VIFPVBQESA-N	225.288	1.525	10	20	BDCD	
CC1(CC(=O)NCCc2ccc(O)c(O)c2)CC1	760455032	ORGYLABUKAIQLI-UHFFFAOYSA-N	249.310	1.947	10	20	BDCD	
C[C@H]1COCCN1C(=O)NCc1ccc(N)cc1	1336290369	LXOTZNRHEVCNEE-JTQLQIEISA-N	249.314	1.199	10	20	BDCD	
CNC(=O)C[C@@H](C)NCc1cc(F)ccc1O	323039838	OIXZRNTXKFKLBG-MRVPVSSYSA-N	240.278	1.146	10	20	BDCD	
CNC(=O)NCc1ccc(N2CC=CC2)cc1	172589408	KIVLEASSRLMWSY-UHFFFAOYSA-N	231.299	1.492	10	20	BDCD	
CCNC(=O)NCc1ccc(N2CC=CC2)cc1	125069883	AOEHZGSEGYOGLF-UHFFFAOYSA-N	245.326	1.882	10	20	BDCD	
CC[C@H](COC)NC(=O)Nc1ccc(N)cc1	79769059	ZIVJSFUFELBBEN-SNVBAGLBSA-N	237.303	1.815	10	20	BDCD	
CC1(C)CNCC[C@H]1NCc1ccccc1O	379860828	ROCXDMOCNXJGPV-CYBMUJFWSA-N	234.343	1.870	10	20	BDCD	
COc1ccc(O)c(CNCc2nonc2C)c1	809745059	LJPPAFOOGWAHDE-UHFFFAOYSA-N	249.270	1.382	10	20	BDCD	
CC[C@H](N)CN[C@@H](C)c1cc(F)ccc1O	817979281	JMLJGCGPIZNPGV-WPRPVWTQSA-N	226.295	1.919	10	20	BDCD	
CNCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O	817953871	VOZGGIFPNRLIQY-QMMMGPOBSA-N	239.275	1.170	10	20	BDCD	
CCN(C[C@@H](C)OC)C(=O)c1cc(O)cs1	812778145	HAFKFLDLQFREMO-MRVPVSSYSA-N	243.328	1.951	10	20	BDCD	
CC(C)N1CC(NC(=O)c2cc(O)cs2)C1	839730915	OFPNUWGFOCAEIJ-UHFFFAOYSA-N	240.328	1.276	10	20	BDCD	
OCCOCCSc1ncc(Cl)s1	849999104	NVCYHEHDRWQQFV-UHFFFAOYSA-N	239.749	1.898	10	20	BDCD	
Oc1ccc(F)cc1CN1C[C@H]2C[C@H]2C1	862444135	YIYXIXXHYZJRPP-DTORHVGOSA-N	207.248	1.983	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C[C@@H]2CCOC2)c1	862759553	GDVIKKJQMNRHKO-NSHDSACASA-N	249.310	1.743	10	20	BDCD	
Cc1ccc(CNC[C@@H]2COCO2)c(O)c1	894888912	MEKVLHSAPVZBLY-LLVKDONJSA-N	223.272	1.163	10	20	BDCD	
COC[C@H]1CCN(c2ccc(N)cc2)C1	81040949	BJLWLLZLQIWKOI-JTQLQIEISA-N	206.289	1.742	10	20	BDCD	
CN=c1nc(Nc2ccc(N)cc2)cc(C)[nH]1	409430956	XQBFDPURADQWRA-UHFFFAOYSA-N	229.287	1.574	10	20	BDCD	
N[C@@H]1CCC[C@H](NCc2ccccc2O)C1	162936775	YDQXZJVSTSZHGZ-NEPJUHHUSA-N	220.316	1.752	10	20	BDCD	
COc1cccc(O)c1CN1CCC[C@@H](N)C1	843043831	JPZHSFXFFDEUHK-SNVBAGLBSA-N	236.315	1.324	10	20	BDCD	
CN(C(=O)[C@H]1C[C@H]2CC[C@H]1O2)c1ccc(N)cc1	387086216	AGBAMSHGZSXLGS-FRRDWIJNSA-N	246.310	1.799	10	20	BDCD	
CCCOCC(=O)N[C@H](C)c1ccccc1O	827930647	OGLOCONGQGIDFN-SNVBAGLBSA-N	237.299	1.996	10	20	BDCD	
CCOC(=O)NC(=O)c1ccsc1N	100969121	MTQFKEBUNBNDNU-UHFFFAOYSA-N	214.246	1.217	10	20	BDCD	
CC[C@@H](CO)NCc1cc(OC)ccc1O	20196165	GWSXSDQVXBPGMQ-JTQLQIEISA-N	225.288	1.261	10	20	BDCD	
Cc1ccc(O)c(CN2CCC(N)CC2)c1	70955763	SMFLLOMGBAPMGT-UHFFFAOYSA-N	220.316	1.624	10	20	BDCD	
CN(C)c1ccc(OCc2cn(C)nn2)cc1	810001509	FNKCQMZMMMOFGD-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
CC[C@H](NCCNC)c1ccc(F)cc1O	817953275	YHGLUSDNJWNEQV-NSHDSACASA-N	226.295	1.791	10	20	BDCD	
COCCCOc1ccccc1NC[C@@H](C)O	819422381	VEKCRDWOCDKKTO-LLVKDONJSA-N	239.315	1.895	10	20	BDCD	
O=C(O)[C@H]1CCCN1C(=O)c1cc(O)cs1	821508655	CYWJBOFIXATSHO-SSDOTTSWSA-N	241.268	1.143	10	20	BDCD	
C[C@@H](CCO)N(C)Cc1ccc(N(C)C)cc1	844448563	GDZHGKDGVKHMMC-LBPRGKRZSA-N	236.359	1.955	10	20	BDCD	
CCN(C(=O)Cc1ccc(N)cc1)[C@@H]1CCNC1	1332095511	MTLAFVCFLZLYEY-CYBMUJFWSA-N	247.342	1.022	10	20	BDCD	
NC(=O)CCCCSc1nccs1	131448982	WWFICDYQOAVQSY-UHFFFAOYSA-N	216.331	1.891	10	20	BDCD	
C[C@@H]1NCCC[C@@H]1NCCc1ccc(N)cc1	925689553	BXKNOEXKDGFNJK-FZMZJTMJSA-N	233.359	1.541	10	20	BDCD	
COC[C@@H](O)CN[C@H](C)c1ccc(C)cc1O	71264960	YVMWENYSVJPPTL-MNOVXSKESA-N	239.315	1.359	10	20	BDCD	
[N-]=[N+]=NCCn1nc(-c2cccnc2)cc1O	409437766	IMSUYOKGALPBJK-UHFFFAOYSA-N	230.231	1.961	10	20	BDCD	
CN(Cc1ccccc1O)c1ncccn1	89635460	XJOSUXRPBJFSIO-UHFFFAOYSA-N	215.256	1.819	10	20	BDCD	
COc1ccc(CNCc2ncc(C)[nH]2)c(O)c1	693491454	FEGIQRIBNRJCTP-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
CC[C@@H](OC)C(=O)N(C)Cc1ccccc1O	68429712	FZPJIRHRLWMEPH-GFCCVEGCSA-N	237.299	1.776	10	20	BDCD	
OC[C@@H](NCc1cc(F)ccc1O)C1CC1	309580577	QFZIMLMKUJXIER-LLVKDONJSA-N	225.263	1.392	10	20	BDCD	
C[C@@H](N[C@@H]1CCNC(=O)CC1)c1ccccc1O	396670722	YNNYPGLOUXRISB-MNOVXSKESA-N	248.326	1.712	10	20	BDCD	
CO[C@@H]1CCC[C@H]1NC(=O)Nc1ccc(N)cc1	50375920	WPYADLMSVVRMDS-VXGBXAGGSA-N	249.314	1.958	10	20	BDCD	
COC(=O)CN(C)Cc1cc(OC)ccc1O	179710234	MBKVQFUNGSBFLJ-UHFFFAOYSA-N	239.271	1.006	10	20	BDCD	
CCCN(C)C(=O)c1ccc(C)c(O)c1O	177677194	KMHWANUECVKDHK-UHFFFAOYSA-N	223.272	1.888	10	20	BDCD	
Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCO	20596942	HWDQENKAAFHSPS-VHSXEESVSA-N	221.300	1.831	10	20	BDCD	
CC[C@@H](O)CN(C)c1ccc(OC)cc1	49971027	NKLUSZQXZDRKTI-LLVKDONJSA-N	209.289	1.902	10	20	BDCD	
Cc1ccc(O)c(CNCCC[C@@H](C)O)c1	227952030	NNIQNFQNPIBZAY-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
CC[C@@](C)(CO)NC(=O)c1cc(O)cs1	831263115	LWMNUORXSZRZSE-JTQLQIEISA-N	229.301	1.345	10	20	BDCD	
Cc1ccc(CN[C@@H]2CCOC2)c(O)c1	877113015	XXDWDGNXMUHVKK-LLVKDONJSA-N	207.273	1.579	10	20	BDCD	
C[C@@H](N[C@@H]1CC[C@H]1O)c1c(O)cccc1F	886629576	IRTIBOZLBGKLHA-SZEHBUNVSA-N	225.263	1.705	10	20	BDCD	
C[C@@H]1COCCN(Cc2ccc(N)cc2)C1	399068809	GBUQUNMTAYEWQA-NSHDSACASA-N	220.316	1.737	10	20	BDCD	
COc1ccc2c(c1)CCCN2C[C@H](C)O	799112284	OBXFXFPSYJGXEV-JTQLQIEISA-N	221.300	1.829	10	20	BDCD	
CC1(CC(=O)NCc2ccc(O)cc2O)CC1	1333359142	QPNAVOBNOPUXHS-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CC(C)c1ccc(O)c(CN[C@H]2[C@@H]3C[C@@H]2CN3)c1	1575858198	BLLIJANOTQQHGA-VNHYZAJKSA-N	246.354	1.966	10	20	BDCD	
Cn1ccc(/C=C2/SC(=S)NC2=O)c1	160129417	YOJDEXGOMUOAPW-QPJJXVBHSA-N	224.310	1.514	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CCCNC2)c1O	841033565	VOIHJPHFCGQSIA-GFCCVEGCSA-N	234.343	1.790	10	20	BDCD	
C[C@@H]1NCCN(C(=O)Cc2ccc(N)cc2)[C@H]1C	262804363	PVBNRNAVUQPWHH-QWRGUYRKSA-N	247.342	1.020	10	20	BDCD	
N[C@@H](CO)c1cccc(Br)c1O	72198719	YQNUKWBOXOLUSU-ZETCQYMHSA-N	232.077	1.147	10	20	BDCD	
Cc1ccc(O)c(CN(C)CC[C@H](C)O)c1	93481762	QTEUIZAKAGSRBO-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
CC[C@H](CNC(=O)c1cc(O)cs1)OC	812368971	GOQGUMNEGHEKAJ-MRVPVSSYSA-N	229.301	1.609	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1C[C@]12CCNC2	828015575	JCKLQKFNEFOWKB-FZMZJTMJSA-N	246.310	1.008	10	20	BDCD	
CCn1nncc1CN(C)Cc1ccccc1O	838895513	NUQDSQRIVFTRDC-UHFFFAOYSA-N	246.314	1.636	10	20	BDCD	
CC(C)(N)CC(=O)NCCc1ccc(N)cc1	832659265	XEJBSVYMJIJKND-UHFFFAOYSA-N	235.331	1.055	10	20	BDCD	
CNCCCNCc1cccc(Cl)c1O	841042007	KRVIDBYAPWYABB-UHFFFAOYSA-N	228.723	1.745	10	20	BDCD	
CCN(CCN)Cc1cccc(F)c1O	863644528	ZIRIHGNBZYPXTG-UHFFFAOYSA-N	212.268	1.312	10	20	BDCD	
CC[C@]1(C(=O)N(C)c2ccc(N)cc2)CCCN1	877077367	FTQPZZZACYYVAP-CQSZACIVSA-N	247.342	1.764	10	20	BDCD	
Cc1ccc(CN2CCC[C@H](CO)C2)c(O)c1	876509730	HBHPYACLTUKSBM-LBPRGKRZSA-N	235.327	1.905	10	20	BDCD	
CC(C)(CO)NCc1cccc(Cl)c1O	163728613	ZARVKIFGQFDXDG-UHFFFAOYSA-N	229.707	1.906	10	20	BDCD	
COC1(C(F)(F)F)CN(C(=O)CN=[N+]=[N-])C1	409425541	APYMOBRKTXPRFZ-UHFFFAOYSA-N	238.169	1.086	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H]2CNC[C@@H]2C1	770396044	YEDGDTPMKQPWST-PHIMTYICSA-N	248.326	1.052	10	20	BDCD	
CCNC(=O)CN[C@H](C)c1ccccc1O	36780474	KKCJHKFFJXGGRK-SECBINFHSA-N	222.288	1.179	10	20	BDCD	
C[C@@H](NC[C@@H]1COCCO1)c1ccccc1O	38060523	RGYADTQDGYJZCU-GHMZBOCLSA-N	237.299	1.458	10	20	BDCD	
Cc1cccc(CNC(C)(C)CO)c1O	83345893	SNBYWSKGNCTACJ-UHFFFAOYSA-N	209.289	1.561	10	20	BDCD	
COC[C@H](C)OC(=O)c1cc(O)cs1	783607012	CYXPVGHAEPUUKY-LURJTMIESA-N	216.258	1.645	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](O)C[C@@H]2C)c1	788266903	CXUXWLXMQHACHS-CMPLNLGQSA-N	221.300	1.656	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)C[C@H]1O	897684464	PPMTWQJDBJEWHT-BXKDBHETSA-N	207.273	1.205	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)C[C@@H]1O	897684467	PPMTWQJDBJEWHT-SKDRFNHKSA-N	207.273	1.205	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C12CC(CN1)C2	822184657	FMWZVJHPYBARJM-UHFFFAOYSA-N	246.310	1.103	10	20	BDCD	
COc1ccc(N(CCO)CC2CC2)cc1	831587491	BMRMEGUMOAHHNX-UHFFFAOYSA-N	221.300	1.904	10	20	BDCD	
COCCN[C@H](C)c1cc(C(=O)O)ccc1O	1599244365	IGJYTKVDMBBHDC-MRVPVSSYSA-N	239.271	1.387	10	20	BDCD	
C[C@H](CNCc1ccc2c(c1)CCO2)CC(=O)O	258853658	JEIZFMPHOGUGAF-JTQLQIEISA-N	249.310	1.822	10	20	BDCD	
NCC[C@@H]1CCN(Cc2cc(F)ccc2O)C1	723670799	PBNLBSPZXOHZMW-SNVBAGLBSA-N	238.306	1.702	10	20	BDCD	
C[C@H](NC[C@@H](C)C(=O)O)c1ccccc1O	1603193484	WLPQCKSZVQSPEQ-BDAKNGLRSA-N	223.272	1.764	10	20	BDCD	
CCN(C)C(=O)CN[C@@H](C)c1ccccc1O	179902678	NCOHYJDHYMXRBV-JTQLQIEISA-N	236.315	1.521	10	20	BDCD	
CN(Cc1ccc(N)cc1)Cc1nccn1C	62246914	QQDRHAAZCHXYBN-UHFFFAOYSA-N	230.315	1.634	10	20	BDCD	
CO[C@H]1CCCN(c2ccc(N)cc2)C1	230219982	OXXGGOPASQGSDZ-LBPRGKRZSA-N	206.289	1.884	10	20	BDCD	
COCC[C@H](CO)N[C@H](C)c1ccccc1O	281541111	IQXSFCLNWLHEFE-GHMZBOCLSA-N	239.315	1.440	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2C[C@@H](O)C2)c1	824904667	VTXCFCHEASRJJH-JGZJWPJOSA-N	235.283	1.088	10	20	BDCD	
C[C@@H](NCC1(N)CC1)c1ccc(F)cc1O	902408158	XHNRYSFAHYHBKH-MRVPVSSYSA-N	224.279	1.673	10	20	BDCD	
C[C@H](CCCN)NCc1cc(F)ccc1O	841078941	FEQSJFJGRORZSA-SECBINFHSA-N	226.295	1.748	10	20	BDCD	
Nc1ccc(N[C@@H]2CCC[C@H](N)C2)cc1	848715185	PSWZBZUJYRCSDI-CMPLNLGQSA-N	205.305	1.951	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCNC2(C)C)c1	841085452	CQHUCOPUYZPXJP-ZDUSSCGKSA-N	234.343	1.931	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCCOC1)c1ccccc1O	827930632	NPJVDNMXIYCGBY-GHMZBOCLSA-N	249.310	1.996	10	20	BDCD	
O=C(NN1CCCCC1)c1cc(O)cs1	765239546	HIWZQGKAEJULHB-UHFFFAOYSA-N	226.301	1.584	10	20	BDCD	
COc1ccc(CN[C@H]2CCNC2)cc1C	259155735	VEPXOIYFAXVNAV-LBPRGKRZSA-N	220.316	1.455	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1C[C@@H](O)C1	877657596	KSIVEDUMGBWBTR-PHIMTYICSA-N	221.300	1.561	10	20	BDCD	
C[C@@H]1COC[C@@H]1NCc1cc(F)cc(F)c1O	708534683	DDCHXPKUZGARAF-HQJQHLMTSA-N	243.253	1.795	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)[C@@H]1CCC[C@H]1O	709154686	AAEMHDWCTVIODK-CHWSQXEVSA-N	248.326	1.183	10	20	BDCD	
C[C@@H]1OCCN(C(=O)Nc2ccc(N)cc2)[C@H]1C	380584699	ZHTRAVQSTHUXEM-UWVGGRQHSA-N	249.314	1.910	10	20	BDCD	
COc1cccc(CN[C@H]2COC[C@@H]2C)c1O	699792035	VBQQRQYFFYCYBY-ONGXEEELSA-N	237.299	1.525	10	20	BDCD	
CC(C)(C)ONC(=O)c1cccc(O)c1O	126611277	PHUXDAAYYDBFQY-UHFFFAOYSA-N	225.244	1.558	10	20	BDCD	
CCCN(C)CC(=O)Nc1ccc(N)cc1	37097847	XKPWNIYLSCBANK-UHFFFAOYSA-N	221.304	1.549	10	20	BDCD	
COC[C@@H](C)CNCc1ccccc1O	45655967	IFNALPYDBKWDBG-JTQLQIEISA-N	209.289	1.764	10	20	BDCD	
CC(F)(F)C(=O)NCc1ccccc1O	289160853	IGBPVGBDINRFKI-UHFFFAOYSA-N	215.199	1.664	10	20	BDCD	
C[C@H](NCC1(N)CCC1)c1ccccc1O	817965575	XWEYINIHASEUJJ-JTQLQIEISA-N	220.316	1.924	10	20	BDCD	
C[C@@H](NCCCON)c1ccccc1O	902419917	VPDVMKLIIUNXPQ-SECBINFHSA-N	210.277	1.323	10	20	BDCD	
COC(=O)[C@@H](C)OC(=O)c1cc(O)cs1	732354655	PNAVVPSWPNKGDM-RXMQYKEDSA-N	230.241	1.172	10	20	BDCD	
CC(F)(F)CNC(=O)c1cc(O)cs1	832876573	CVOHHPDMFIIKMJ-UHFFFAOYSA-N	221.228	1.839	10	20	BDCD	
CNC[C@@H](C)N[C@@H](C)c1cc(F)cc(F)c1O	854231721	KSAWDYFCXHIHRK-SFYZADRCSA-N	244.285	1.929	10	20	BDCD	
CCN(Cc1nncn1C)c1ccc(OC)cc1	750521143	CIKNVZZBOGYPDS-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
Cc1ccc(CN(CCO)C2CC2)c(O)c1	876579119	BIHZHVRIJHNOTM-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
O=C(O)[C@@H]1CCCN1Cc1ccccc1O	83403826	CJTGZOXTMMDJIV-JTQLQIEISA-N	221.256	1.441	10	20	BDCD	
CC[C@H](CO)Sc1ncc(C(=O)O)s1	1605048103	ZMTPPEYLUGNNKT-RXMQYKEDSA-N	233.314	1.704	10	20	BDCD	
Oc1ccccc1CNCCOCC1CC1	163943630	FTRBJZDIDKTVRB-UHFFFAOYSA-N	221.300	1.908	10	20	BDCD	
CN(C)c1ccc(CNCc2ncnn2C)cc1	80532156	IIFDDDCGWQPLLB-UHFFFAOYSA-N	245.330	1.171	10	20	BDCD	
C[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2)CCN1	692161746	QPMROOJYOUYADP-TZMCWYRMSA-N	247.386	1.983	10	20	BDCD	
C[C@@H](NCc1ccc2c(c1)CCCN2C)C(=O)O	50286862	QVKDQAPNPPGMPI-SNVBAGLBSA-N	248.326	1.632	10	20	BDCD	
CC[C@@H](CO)N[C@H](C)c1ccccc1O	20194908	PFCWRTFIVYPSDM-ZJUUUORDSA-N	209.289	1.814	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)N(C)C	115489768	RVJHJRBQJWVKQT-UHFFFAOYSA-N	235.331	1.832	10	20	BDCD	
COc1cccc(CNCC2(CO)CC2)c1O	118906870	UDHSDUAKUCZZKB-UHFFFAOYSA-N	237.299	1.263	10	20	BDCD	
Cc1cccc(CN[C@@H]2C[C@H](O)C2(C)C)c1O	128232981	XMQCEBJYXGJSSU-NEPJUHHUSA-N	235.327	1.950	10	20	BDCD	
Oc1cccc(Cl)c1CN1CCNCC1	82657484	ORTBISNMVLPQGL-UHFFFAOYSA-N	226.707	1.451	10	20	BDCD	
Cc1cccc(CN2CCN[C@@H](C)C2)c1O	132481978	QPMAAKRBXZQNEA-NSHDSACASA-N	220.316	1.494	10	20	BDCD	
C[C@H](N[C@@H]1CCOC1)c1ccc(F)cc1O	87783770	GSDUQCYMOQLTPU-WCBMZHEXSA-N	225.263	1.971	10	20	BDCD	
CCOc1ccc(N(C)C[C@H](C)O)cc1	49814626	AFYVXKOGDBPGJB-JTQLQIEISA-N	209.289	1.902	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccccc1C	808488621	LHFOQUWZTLYUJI-UHFFFAOYSA-N	220.224	1.310	10	20	BDCD	
Cc1cc(O)c(CNCc2nonc2C)cc1C	809743353	YESIURKDKUSWPP-UHFFFAOYSA-N	247.298	1.990	10	20	BDCD	
COc1ccc(CNC/C=C/CO)cc1C	717532258	MQQVYFNYTPDXIK-ONEGZZNKSA-N	221.300	1.642	10	20	BDCD	
C[C@H](NCCN)c1cc(F)cc(F)c1O	817934052	AZWOYPLNDVNFLV-LURJTMIESA-N	216.231	1.280	10	20	BDCD	
Oc1cccc2c1[C@H](NCCNC1CC1)CC2	817952558	FVXXUNYWHXQZHR-GFCCVEGCSA-N	232.327	1.721	10	20	BDCD	
CCC(=O)C1(C(=O)NCc2ccccc2O)CC1	825659298	XNQNTJMVTKISQQ-UHFFFAOYSA-N	247.294	1.768	10	20	BDCD	
Cc1cccc(O)c1CNC1CCOCC1	876948125	GKUVBTQNPOIPJY-UHFFFAOYSA-N	221.300	1.969	10	20	BDCD	
CC[C@H](NCc1ccc(OC)c(C)c1)C(=O)O	843038453	HRXSEXBHHOROHJ-NSHDSACASA-N	237.299	1.956	10	20	BDCD	
Cc1cccc(CN2CC[C@H](CN)C2)c1O	843048452	WPOPDEJEMZBGAX-LLVKDONJSA-N	220.316	1.481	10	20	BDCD	
CN[C@H]1CCN(Cc2ccc(N(C)C)cc2C)C1	843045143	MSENBJXTXUVQIT-AWEZNQCLSA-N	247.386	1.855	10	20	BDCD	
Oc1ccc(Cl)c(F)c1CN[C@H]1C[C@H](O)C1	850417509	ARHIJMHXEDOGNJ-LJGSYFOKSA-N	245.681	1.798	10	20	BDCD	
Cc1cc(O)c(CNC2(C)COC2)cc1C	877691355	NSAYYZQCBITMFX-UHFFFAOYSA-N	221.300	1.888	10	20	BDCD	
CCC[C@@H]1CN(CCN=[N+]=[N-])CC[C@@H]1O	409436169	YLGIUOBHGZQVTH-ZJUUUORDSA-N	212.297	1.780	10	20	BDCD	
C[C@H]1CN(C)[C@H](C)CN1Cc1ccccc1O	775987309	VKSQXHBMKHJWEF-NEPJUHHUSA-N	234.343	1.917	10	20	BDCD	
CN(C)c1ccc(CN[C@H](CF)C(=O)O)cc1	1598320837	VLBGZKODNYIWKK-LLVKDONJSA-N	240.278	1.265	10	20	BDCD	
CCN(C(=O)c1cccc(O)c1O)C1CC1	163269491	XWCKVDGTRMMQPB-UHFFFAOYSA-N	221.256	1.722	10	20	BDCD	
CC(=O)N1CCC[C@H]1C(=O)Nc1ccc(N)cc1	236816690	HQZJVUSMGLPOFJ-LBPRGKRZSA-N	247.298	1.218	10	20	BDCD	
CNC(=O)CCN(C)Cc1ccc(C)cc1O	876685796	VPHHIYGROSMNRF-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CNC(=O)CCCN[C@@H](C)c1ccccc1O	272834235	IPEZIIMXUHMJNN-JTQLQIEISA-N	236.315	1.569	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCOC2)cc1	70964843	SYBZZUMJRBHEKN-GFCCVEGCSA-N	220.316	1.631	10	20	BDCD	
C[C@H]1CN(Cc2cccc(Cl)c2O)CCN1	132482392	QGQXCGVMCOPHAX-VIFPVBQESA-N	240.734	1.839	10	20	BDCD	
Cn1ccc(CCNCc2cc(F)ccc2O)n1	230943502	SDNXQLQNHSPFTQ-UHFFFAOYSA-N	249.289	1.597	10	20	BDCD	
C/C=C(\C)C(=O)NCCc1ccc(N)cc1	818544807	PDWYYUDGWICHFZ-XCVCLJGOSA-N	218.300	1.894	10	20	BDCD	
C[C@H](O)CNCCCSc1nccs1	819063331	KQNABMIRZAQJSR-QMMMGPOBSA-N	232.374	1.596	10	20	BDCD	
Cc1cc(C)c([C@H](C)NC2CNC2)c(O)c1	817956204	SZFZXEHQWWYQTC-JTQLQIEISA-N	220.316	1.631	10	20	BDCD	
O=C1CC[C@@H]2[C@@H]1[C@@H]2C(=O)NCc1ccccc1O	907054948	AAQVHYUYBDZOEL-JIMOISOXSA-N	245.278	1.234	10	20	BDCD	
Cc1cccc(CN2CC[C@@](C)(CN)C2)c1O	843115709	JJGKIILUCOCJOU-AWEZNQCLSA-N	234.343	1.871	10	20	BDCD	
CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccccc1O	765794964	GOLGTKMDZJJSCX-NEPJUHHUSA-N	248.326	1.397	10	20	BDCD	
CC[C@@](C)(O)CNCc1cccc(OC)c1O	96478748	DJPNKXXXJXTXBD-CYBMUJFWSA-N	239.315	1.651	10	20	BDCD	
C[C@@H](O)[C@H]1CCCN1c1ccc(N)cc1	409426772	IRHNDIUKANLSKC-BXKDBHETSA-N	206.289	1.618	10	20	BDCD	
CN[C@@H](C)CCNCc1ccc2c(c1)CCO2	1325625394	JZNPWNBSMWUIEQ-NSHDSACASA-N	234.343	1.709	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@H]1CCC=CO1	1263894829	WZRASASDOFYNRG-LLVKDONJSA-N	249.266	1.407	10	20	BDCD	
COCC1(NC(=O)NCc2ccc(N)cc2)CC1	1357791353	KXOUZNOTIAUJLY-UHFFFAOYSA-N	249.314	1.247	10	20	BDCD	
CN(CC1(CC(=O)O)CC1)c1ccc(N)cc1	1598441982	KFQWPPULCDQYAU-UHFFFAOYSA-N	234.299	1.960	10	20	BDCD	
COC[C@H](O)CN(C)c1ccc(OC)cc1	8697949	LOBJORACDSXKTD-LLVKDONJSA-N	225.288	1.139	10	20	BDCD	
CCNC(=O)CN1CCCc2cc(CN)ccc21	62801567	OZFULLUQHWVRBF-UHFFFAOYSA-N	247.342	1.034	10	20	BDCD	
COc1ccc(O)c(CNCc2c[nH]cn2)c1	78749253	HRWJRGWRGMJLMJ-UHFFFAOYSA-N	233.271	1.414	10	20	BDCD	
O=C1OC[C@@H]2CN(Cc3ccccc3O)CCN12	361054147	UDLMJAZLARUOAW-NSHDSACASA-N	248.282	1.029	10	20	BDCD	
CCOC[C@@H](C)NCc1ccccc1O	44688533	PSUPPIUUFISMCG-SNVBAGLBSA-N	209.289	1.907	10	20	BDCD	
Cc1ccc(CNCCCN(C)C)c(O)c1	83352241	IDVOQWBYXQYODS-UHFFFAOYSA-N	222.332	1.742	10	20	BDCD	
CN(Cc1cc(F)ccc1O)CC(C)(C)CO	824630188	KMZMKOXYXBQKSB-UHFFFAOYSA-N	241.306	1.982	10	20	BDCD	
Oc1ccccc1CN1CC(OCC(F)F)C1	839138847	UVIRUQOUIBULKM-UHFFFAOYSA-N	243.253	1.858	10	20	BDCD	
C[C@H]1CCCCN1NC(=O)c1cc(O)cs1	912142886	WLNLUPQVSPSMHW-QMMMGPOBSA-N	240.328	1.973	10	20	BDCD	
C[C@H](N[C@@H](CO)CCF)c1ccc(F)cc1O	846209240	PSFJOTYKKADFFM-WCBMZHEXSA-N	245.269	1.902	10	20	BDCD	
CCN1CCC[C@@H]1CNCc1ccc(N)cc1	83360246	RORPTLMPVVHDQJ-CQSZACIVSA-N	233.359	1.843	10	20	BDCD	
C[C@H]1CCN[C@H](C(=O)NCc2ccc(N)cc2)C1	1524009763	VPHOAAYPBXYNAP-GWCFXTLKSA-N	247.342	1.273	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1C[C@@H]1F	1123769325	IQRYPLKOAVMFQE-BDAKNGLRSA-N	209.220	1.366	10	20	BDCD	
Cc1cccc(CNC[C@H]2CCCN2)c1O	841036102	NZGAVCHMKUVJAW-GFCCVEGCSA-N	220.316	1.542	10	20	BDCD	
COc1ccc(N(C)CCN(C)C(C)=O)cc1	844851794	GYIMCRRSFSEIRI-UHFFFAOYSA-N	236.315	1.610	10	20	BDCD	
C[C@H](NCc1cc(F)ccc1O)C(=O)O	235506794	KJKCQAHHXPTGKU-LURJTMIESA-N	213.208	1.094	10	20	BDCD	
CCN1C[C@H](NCc2ccc(C)cc2O)CC1=O	877566891	BNJRGGNUFSYVLL-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H]3NCC[C@H]3C2)c1	381309955	CSJMYALGJNEVFZ-JSGCOSHPSA-N	246.354	1.884	10	20	BDCD	
CN(C(=O)NCc1ccc(N)cc1)C1CCC1	1262603577	NHYYIGPCTFDQIC-UHFFFAOYSA-N	233.315	1.963	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1CC1	70262927	LWYAAMHMJVSXAT-UHFFFAOYSA-N	205.257	1.761	10	20	BDCD	
C[C@@H](CN)CN[C@H](C)c1ccc(F)cc1O	817962952	PSQFSFXASMLSHY-DTWKUNHWSA-N	226.295	1.777	10	20	BDCD	
CCOc1cccc(CNC/C=C/CO)c1O	717547439	LTMQYERIIJFROU-ONEGZZNKSA-N	237.299	1.429	10	20	BDCD	
CC[C@@H](NCc1cc(OC)ccc1O)C(=O)O	820419284	URGDZOUGHISHOW-SNVBAGLBSA-N	239.271	1.354	10	20	BDCD	
O=C(OC[C@@H]1CCCO1)c1cc(O)cs1	732352610	AGDISQSJGIPZPD-QMMMGPOBSA-N	228.269	1.790	10	20	BDCD	
Oc1ccc(F)cc1CN1CC(OC(F)F)C1	839143693	JNYPKRDDZXSXFA-UHFFFAOYSA-N	247.216	1.955	10	20	BDCD	
CC(C)(N)CCC(=O)Nc1ccc(N)cc1	843292350	HTLMEARPMVHLLW-UHFFFAOYSA-N	221.304	1.725	10	20	BDCD	
CCc1cccc(CNCc2nonc2C)c1O	848910257	HDVIMLFDAQAJLR-UHFFFAOYSA-N	247.298	1.936	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCN(C2CC2)C1	44684077	CIMNARQAPXWVFM-GFCCVEGCSA-N	232.327	1.719	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)c2noc(C)n2)c1	863499359	XCIRRBYDZVCSIC-UHFFFAOYSA-N	247.254	1.322	10	20	BDCD	
O=C1CC[C@@H](Sc2nccs2)C(=O)N1	765829803	RWVXXOFGXMCQRJ-RXMQYKEDSA-N	228.298	1.040	10	20	BDCD	
CC[C@@H](NCc1ccccc1O)C(=O)O	84847069	KPQUMOQJPIVUPC-SECBINFHSA-N	209.245	1.345	10	20	BDCD	
CCO[C@H]1CCN(Cc2ccc(N)cc2)C1	706523832	DWNQYLYVVHHFBA-ZDUSSCGKSA-N	220.316	1.880	10	20	BDCD	
CC1(C)CNCCN1Cc1ccc(N)cc1	1235825777	NTWMOGRQLVFSDA-UHFFFAOYSA-N	219.332	1.453	10	20	BDCD	
CC(C)OCCC(=O)NCc1ccccc1O	299604230	WGUGPNKAMRGAIL-UHFFFAOYSA-N	237.299	1.824	10	20	BDCD	
CCC1(CNCc2ccccc2O)COC1	310020255	MWYQPTOSUIPUQS-UHFFFAOYSA-N	221.300	1.908	10	20	BDCD	
CON1CCC(N(C)Cc2ccc(N)cc2)CC1	691954519	OLRYHOHXDCIEPU-UHFFFAOYSA-N	249.358	1.726	10	20	BDCD	
C[C@@H](NCCN)c1ccc(N(C)C)cc1	37712897	BLLWKDDEPSYKPD-SNVBAGLBSA-N	207.321	1.362	10	20	BDCD	
C[C@H](c1nnnn1C)N(C)Cc1ccccc1O	189663429	NDQDJBBAFXEJKK-SECBINFHSA-N	247.302	1.109	10	20	BDCD	
O=C(Nc1ncccc1O)c1cccc(O)c1O	186793766	PISAOROVCJTVTP-UHFFFAOYSA-N	246.222	1.451	10	20	BDCD	
OCCCCN[C@@H]1CCc2cccc(O)c21	296616443	YVRWHDKGTTXUQO-LLVKDONJSA-N	221.300	1.742	10	20	BDCD	
CCO[C@@H]1C[C@@H]1C(=O)N(C)Cc1ccccc1O	298765971	ANKANIQZSAZICQ-WCQYABFASA-N	249.310	1.776	10	20	BDCD	
O=C(O)C1(CNCc2ccccc2O)CC1	1350600281	PFFBLQSPKOUEIK-UHFFFAOYSA-N	221.256	1.347	10	20	BDCD	
CC(C)=CCNC(=O)c1c(F)ccc(O)c1O	295274108	CMIKLJOSPZLUEI-UHFFFAOYSA-N	239.246	1.933	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)Nc2ccc(N)cc2)CCN1	911661266	SQPAUACIMJJYQN-NXEZZACHSA-N	233.315	1.595	10	20	BDCD	
CNC(=O)CCNCc1ccc(N(C)C)cc1C	840932898	KYUSLTRXFLRTNU-UHFFFAOYSA-N	249.358	1.287	10	20	BDCD	
O=C(N[C@@H]1C=CCC1)c1cc(O)cs1	855432989	OSSXGEMZBXPQFS-SSDOTTSWSA-N	209.270	1.902	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)OCCF	859004760	YKOKWQDQHMKBLR-UHFFFAOYSA-N	227.235	1.930	10	20	BDCD	
CNC[C@H](C)NCc1cc(C)c(C)cc1O	853249349	PXKPUKBCCPLSFB-NSHDSACASA-N	222.332	1.707	10	20	BDCD	
CC(C)N(C)CCNC(=O)Cc1ccc(N)cc1	54110171	COFLFXPLERBRHH-UHFFFAOYSA-N	249.358	1.268	10	20	BDCD	
CN(C(=O)[C@@](C)(O)C1CCC1)c1ccc(N)cc1	1122174384	PCYQTXLSPYNRDY-AWEZNQCLSA-N	248.326	1.783	10	20	BDCD	
CNC1(C(=O)N(C)c2ccc(N)cc2)CCC1	1344368455	KKGBWOJZUKUZNT-UHFFFAOYSA-N	233.315	1.374	10	20	BDCD	
O=C(O)c1cnc(SCCF)s1	1608979231	QMAZSWHSSQMREH-UHFFFAOYSA-N	207.251	1.903	10	20	BDCD	
Cc1ccc(O)c(CN2CCn3cnnc3C2)c1	156046037	KBXNDFLPRHWQOG-UHFFFAOYSA-N	244.298	1.308	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H](O)C1CC1	877526503	SAZGLVUEWSUZTL-CYBMUJFWSA-N	221.300	1.561	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@@H](CN)C2)c1	50245445	RAMYRSLSFKUJMQ-JTQLQIEISA-N	236.315	1.181	10	20	BDCD	
COc1ccc(CNCCCC(=O)O)cc1C	37417953	NYHNVRXWWPIOAB-UHFFFAOYSA-N	237.299	1.958	10	20	BDCD	
CNC(=O)CCNCc1c(O)cccc1Cl	83599848	LPBPMPCDRGXPED-UHFFFAOYSA-N	242.706	1.271	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@](C)(C(=O)O)C2)c1	86779778	DALJZGSRBJFUQV-CQSZACIVSA-N	249.310	1.997	10	20	BDCD	
Cc1ncccc1/C=C1/SC(=S)NC1=O	255090130	AHWVWMIVQNHUHA-VMPITWQZSA-N	236.321	1.879	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C(C)(F)F)c1	808463759	WBACMSNTMWTPLN-UHFFFAOYSA-N	245.225	1.672	10	20	BDCD	
COC1CN(Cc2cccc(Cl)c2O)C1	839131125	NEOWPKODPXYSNU-UHFFFAOYSA-N	227.691	1.876	10	20	BDCD	
CC(C)(C)[C@H](CO)NC(=O)c1cc(O)cs1	834559872	SPYNFILQXKUEDA-VIFPVBQESA-N	243.328	1.591	10	20	BDCD	
CNC(=S)NCc1ccc(N2CC=CC2)cc1	740632498	TXCSGHFOMRQJNW-UHFFFAOYSA-N	247.367	1.657	10	20	BDCD	
N[C@@H](CNCc1ccccc1O)C1CC1	841050654	RQGWAYCEVQBBLD-NSHDSACASA-N	206.289	1.219	10	20	BDCD	
COc1ccc(N(C)Cc2nc(O)n[nH]2)cc1	844352692	CQEYCZBHGPMXSY-UHFFFAOYSA-N	234.259	1.155	10	20	BDCD	
O=C(c1cc(O)cs1)N1N[C@H]2CC[C@H]1C2	862912146	ISGXJCVBAPVWCF-BQBZGAKWSA-N	224.285	1.335	10	20	BDCD	
CCN(C)c1ccc(CN2CCNC(=O)C2)cc1	773735060	XMLHDFBAAWNVNL-UHFFFAOYSA-N	247.342	1.075	10	20	BDCD	
Cc1ccc(O)c(CNCCCCO)c1	193277037	JPAKMZCXUAJOIW-UHFFFAOYSA-N	209.289	1.563	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)[C@H]1C[C@@H]1F	1519816684	GNYPEYBYCDOQRW-IUCAKERBSA-N	239.246	1.115	10	20	BDCD	
COc1ccc(N(C)Cc2n[nH]c(C)n2)cc1	844355104	KLNYGNXCVXSRJI-UHFFFAOYSA-N	232.287	1.758	10	20	BDCD	
c1csc(SC[C@H]2COCCO2)n1	307322977	IPJVIHXCRZKQPX-SSDOTTSWSA-N	217.315	1.651	10	20	BDCD	
CCc1cccc(CNC2([C@@H](C)O)CC2)c1O	827585512	KOBHSTOCOLOSOM-SNVBAGLBSA-N	235.327	1.958	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NCc1ccc(C)cc1O	877639578	BVLWZJYPBVDMCW-OLZOCXBDSA-N	221.300	1.968	10	20	BDCD	
C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(C)CC1	186419963	SUTWRCRFYYXKAM-SECBINFHSA-N	249.310	1.945	10	20	BDCD	
COc1ccc(N(C)CCO)cc1Cl	49815917	XUPAWBXYQNYBIC-UHFFFAOYSA-N	215.680	1.777	10	20	BDCD	
CC(C)N(CC(=O)O)Cc1ccccc1O	83405497	WICQKUHYXZXSII-UHFFFAOYSA-N	223.272	1.687	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C(=O)NCC[C@H]2C)c1	193692235	UIIMQPUZGSFFKD-ZWNOBZJWSA-N	248.326	1.315	10	20	BDCD	
C[C@@H](NCc1cc(Cl)cc(F)c1O)C(N)=O	381262499	SJWPFIDGUUJDFF-RXMQYKEDSA-N	246.669	1.148	10	20	BDCD	
CC/C=C/CNC(=O)c1cccc(O)c1O	295933251	KEGVXRAFNWTFJF-ONEGZZNKSA-N	221.256	1.794	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cccs1	808487472	AIOYOQFTXJLRKN-UHFFFAOYSA-N	212.226	1.063	10	20	BDCD	
C[C@@H](CN)CN[C@H]1CCc2cccc(O)c21	817963908	YBKNCGLKGQRWFR-ONGXEEELSA-N	220.316	1.564	10	20	BDCD	
Nc1ccc(NC(=O)C23CCCN2CCC3)cc1	1327959426	BDDUSEKGKHRYBE-UHFFFAOYSA-N	245.326	1.836	10	20	BDCD	
Cc1cc(CN2CCNC[C@@H]2C)ccc1N(C)C	923279441	AUKPFWPAIUFECE-ZDUSSCGKSA-N	247.386	1.855	10	20	BDCD	
CN(C(=O)[C@@H]1C[C@@H]1F)c1ccc(N)cc1	1522217985	QOMTVEASCOFOHQ-ZJUUUORDSA-N	208.236	1.590	10	20	BDCD	
COC[C@@H](O)CN[C@@H](C)c1c(O)cccc1F	886607306	OZQMYZNOVADCFP-IUCAKERBSA-N	243.278	1.189	10	20	BDCD	
COC1(CNC(=O)c2cc(O)cs2)CCC1	780763447	DDHWJETXJKTUJQ-UHFFFAOYSA-N	241.312	1.753	10	20	BDCD	
CCc1cccc(CN[C@H](C)CO)c1O	709418468	SKNWSMKEPAOYLI-SECBINFHSA-N	209.289	1.425	10	20	BDCD	
C[C@H]1NCCC[C@@H]1NC(=O)Cc1ccc(N)cc1	193545423	GZDWSNYHEZAOME-MFKMUULPSA-N	247.342	1.068	10	20	BDCD	
CC1(NCc2cc([N+](=O)[O-])ccc2O)CC1	309768850	KBMTTZXDVRDXBP-UHFFFAOYSA-N	222.244	1.943	10	20	BDCD	
N[C@@H](C(=O)NCc1ccccc1O)C1CCC1	399022438	FVPXDCZJOUZNJU-GFCCVEGCSA-N	234.299	1.136	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C2CC2)cc1F	58731032	SRPNAARXLYWIDC-UHFFFAOYSA-N	236.290	1.918	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)NC	171734749	JOKBNRVPMMHSQV-UHFFFAOYSA-N	222.288	1.944	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C(C)(C)N)cc1	40925127	KSNFYRYQJYICKC-UHFFFAOYSA-N	235.331	1.106	10	20	BDCD	
CC(=O)C(=O)CSc1cccc(C(N)=O)c1	809989383	VYFLBBVPLDAWQA-UHFFFAOYSA-N	237.280	1.036	10	20	BDCD	
CC(C)(N)CN[C@@H]1CCc2cccc(O)c21	817960870	SBGNDKGQAYFGSV-SNVBAGLBSA-N	220.316	1.706	10	20	BDCD	
C[C@@H]1COCCN1C(=O)c1cc(O)cs1	731868540	IXSNLTTYBVIVTN-SSDOTTSWSA-N	227.285	1.315	10	20	BDCD	
N[C@@H](CNCc1cc(F)ccc1O)C1CC1	841049304	JPBXUQKSCZBVGV-NSHDSACASA-N	224.279	1.358	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@@H](C)CN)cc1C	843053039	YMBHBPNBJCBQCO-NSHDSACASA-N	222.332	1.788	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@@H](C)CCO)c1	846110146	HUPXQCVMBYXLTM-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
Nc1ccc(CCN[C@@H]2CCC[C@H](N)C2)cc1	848714491	CACFCXXDWSPVOR-UONOGXRCSA-N	233.359	1.671	10	20	BDCD	
Oc1cc2c(cc1CN1CC[C@@H]3C[C@H]3C1)OCO2	853581670	WXJYUGCPYSAQGL-ZJUUUORDSA-N	247.294	1.963	10	20	BDCD	
CCOc1ccc(CNCC[C@H](C)O)c(O)c1	758478976	AAHWJYFMZVOPGK-JTQLQIEISA-N	239.315	1.651	10	20	BDCD	
Nc1ccc(CNC(=O)N[C@H]2C=CCC2)cc1	1353438564	PTFYZRMFONOESV-LBPRGKRZSA-N	231.299	1.787	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@H]2C[C@@H]2C1	862558313	LPQORGGHVMINQT-RNFRBKRXSA-N	209.270	1.546	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1C=C[C@H](CO)C1	877157752	BCOPZNLWTOSMAR-NWDGAFQWSA-N	233.311	1.727	10	20	BDCD	
COC[C@@H]1CCN(c2ccc(N)cc2)C1	81040948	BJLWLLZLQIWKOI-SNVBAGLBSA-N	206.289	1.742	10	20	BDCD	
CCNC(=S)NCc1ccc(OC)cc1O	795032580	VBJWSQHZOKWUDT-UHFFFAOYSA-N	240.328	1.385	10	20	BDCD	
CN1CC(=O)N[C@@H]1c1ccc(N2CCCC2)cc1	1248746710	JJNDELSROZGWDC-AWEZNQCLSA-N	245.326	1.347	10	20	BDCD	
C[C@H]1CCCN1C(=O)NCc1ccc(N)cc1	1357792034	RSEMPOPVIWXROX-JTQLQIEISA-N	233.315	1.963	10	20	BDCD	
CC[C@@H](F)C(=O)NCCc1ccc(N)cc1	1353003906	HDDRURNODZRJNB-LLVKDONJSA-N	224.279	1.676	10	20	BDCD	
COC[C@H](CO)N[C@H](C)c1cc(F)ccc1O	234837982	WHBSTPBZUBAACS-SCZZXKLOSA-N	243.278	1.189	10	20	BDCD	
COC[C@H](O)CCNCc1ccc(C)cc1O	877125507	OBNASCVAGPFPHK-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
CCn1nncc1CNCc1ccc(C)cc1O	877647491	DELUGXMWBBSRKS-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
COc1cccc(CN[C@@H]2CCC[C@H]2O)c1O	323520364	HQOMYCIECLCSKM-GHMZBOCLSA-N	237.299	1.404	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CCCN2C)c1	113328537	AKXSCKCBUKFUPR-CYBMUJFWSA-N	234.343	1.884	10	20	BDCD	
COCC[C@@H](C)NCc1cccc(OC)c1O	112018151	QYDBBYNGCVVGNN-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
O=C(CC(F)(F)F)NCc1cccc(O)c1O	1347542657	PHZLRRILARJOPH-UHFFFAOYSA-N	249.188	1.666	10	20	BDCD	
C[C@H](O)CCN[C@@H](C)c1ccc(F)cc1O	82992693	VCDALLODMMEJHN-IUCAKERBSA-N	227.279	1.953	10	20	BDCD	
O=C(NCCC(F)F)c1cccc(O)c1O	381670423	WKMCSXHWSKUAAG-UHFFFAOYSA-N	231.198	1.483	10	20	BDCD	
Cc1ccc(O)c(CNC/C=C\CO)c1	717525084	JGZVKHGYIZTHMH-IHWYPQMZSA-N	207.273	1.339	10	20	BDCD	
C[C@H](CCCCO)NCCc1ccc(N)cc1	817958463	WFYAFYVJKJUHRM-GFCCVEGCSA-N	236.359	1.952	10	20	BDCD	
O=C(NCCC1(CO)CC1)c1cc(O)cs1	854845986	LBLZWEPBQURTQQ-UHFFFAOYSA-N	241.312	1.346	10	20	BDCD	
C[C@H](NCCN1CCC1)c1ccc(F)cc1O	697393451	DWSPUNVDDRSELO-JTQLQIEISA-N	238.306	1.888	10	20	BDCD	
Nc1ccc(CN2CC[C@H](N3CCCC3)C2)cc1	62977325	SFJLKYLFDXMMDX-HNNXBMFYSA-N	245.370	1.939	10	20	BDCD	
COCc1cc(NCc2ccccc2O)ncn1	782135990	QPDMKNLUZDAMAF-UHFFFAOYSA-N	245.282	1.941	10	20	BDCD	
C[C@@H]1NC(=O)[C@@H](C)N(Cc2ccccc2O)[C@H]1C	895117520	VQQCMSYZAWLOIH-GARJFASQSA-N	248.326	1.490	10	20	BDCD	
O=C1OCC[C@@H]1NCc1cc(F)cc(F)c1O	895808422	MHRJBRFPSFYRNI-VIFPVBQESA-N	243.209	1.076	10	20	BDCD	
C[C@@H](NC(=O)c1cccc(O)c1O)c1ccc[nH]1	790911933	WAKXKKPMHUNWFM-MRVPVSSYSA-N	246.266	1.917	10	20	BDCD	
CC1(C)OC[C@H]2C[C@@]21NCc1ccc(N)cc1	1334753955	KGWMABICENWHJI-BXUZGUMPSA-N	232.327	1.926	10	20	BDCD	
O=C(O)CSc1ncc([N+](=O)[O-])s1	226765889	CFMDFUYXGGBBBI-UHFFFAOYSA-N	220.231	1.228	10	20	BDCD	
C[C@@H](CC(N)=O)NCc1cccc(Cl)c1O	162705679	OOCJZEMIPIUDIB-ZETCQYMHSA-N	242.706	1.399	10	20	BDCD	
CSC[C@@H](C)NC(=O)c1cccc(O)c1O	163278348	HFKSICAAIZNJOJ-SSDOTTSWSA-N	241.312	1.579	10	20	BDCD	
C[C@@H](CN(C)C)NC(=O)Nc1ccc(N)cc1	168896376	ANFDUXCUAOICFE-VIFPVBQESA-N	236.319	1.340	10	20	BDCD	
OCC[C@H](NCc1ccccc1O)C(F)(F)F	886371506	NOQCKWODVPXFIW-JTQLQIEISA-N	249.232	1.795	10	20	BDCD	
COc1ccc(O)c(CN2CCCOCC2)c1	134188107	OAGRFEBBKUCVPZ-UHFFFAOYSA-N	237.299	1.623	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(C)N	40923144	CGMCZILWJFNJIF-UHFFFAOYSA-N	249.358	1.448	10	20	BDCD	
C[C@@]1(CNC(=O)Nc2ccc(N)cc2)CCCO1	94804636	KJLZUJJUUPRZTD-ZDUSSCGKSA-N	249.314	1.959	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cccc(Cl)c1	808487663	FWLHYXIEJOXVMD-UHFFFAOYSA-N	240.642	1.655	10	20	BDCD	
C/C=C/C(=O)NCc1cc(C)ccc1O	862761350	OMYNLXUCJQQZGP-ONEGZZNKSA-N	205.257	1.893	10	20	BDCD	
Cc1ccc(CN2CCC[C@@H](C(N)=O)C2)c(O)c1	876511311	DRDIPKPRSFGEAH-GFCCVEGCSA-N	248.326	1.398	10	20	BDCD	
CC(=O)C1=NN(c2ccc(C)cc2)C(=O)C1	871940609	LVHJPPFTFPZQEW-UHFFFAOYSA-N	216.240	1.677	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H](N)CC2CC2)cc1	884009484	XVQLTBCKLFTYQP-NSHDSACASA-N	219.288	1.335	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H]3C[C@]3(CO)C2)c1	783746567	YGLKLWHLSNMBQF-TZMCWYRMSA-N	233.311	1.515	10	20	BDCD	
Cc1cccc(CNCc2ncc[nH]2)c1O	165166288	PWGFKZOLEGSQAU-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NCc1cccc(C)c1O	694391816	DMHUEGIVPYZKFX-YPMHNXCESA-N	221.300	1.968	10	20	BDCD	
COC(=O)[C@@]1(C)CCN(Cc2ccc(N)cc2)C1	1334773995	CBHUFAPERVPIBA-AWEZNQCLSA-N	248.326	1.654	10	20	BDCD	
COc1ccc(N2CCN(C[C@H](C)N)CC2)cc1	19275602	YGDCCZHHAZMAMZ-LBPRGKRZSA-N	249.358	1.164	10	20	BDCD	
COC[C@H](CNCc1c(C)cccc1O)OC	877189186	KXQRFCFDSHFDRC-NSHDSACASA-N	239.315	1.452	10	20	BDCD	
Cn1cc(CNCc2ccc3c(c2)CCO3)cn1	41159489	LRWPJQOKHVNEJC-UHFFFAOYSA-N	243.310	1.645	10	20	BDCD	
COc1cccc(CN[C@@H](C)C(C)(C)O)c1O	393975590	PHTNOXFNTQVXAW-VIFPVBQESA-N	239.315	1.650	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C2CC2)cc1	8171724	ZVISQQDREZLKFW-UHFFFAOYSA-N	218.300	1.779	10	20	BDCD	
O=C(CC[C@@H]1CCCO1)NCc1ccccc1O	133757753	SICDVJRFDJHFCL-LBPRGKRZSA-N	249.310	1.968	10	20	BDCD	
O=C1CC[C@@H](CSc2nccs2)N1	307070325	VNDMGOFCKLGGJS-LURJTMIESA-N	214.315	1.514	10	20	BDCD	
C[C@@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)CCO1	235429821	WPUYCNRRKVZPHP-ZWNOBZJWSA-N	248.326	1.495	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCCCO)c1	35628920	SKGOBVOLVAGQKA-JTQLQIEISA-N	209.289	1.734	10	20	BDCD	
COCCN(CCOC)Cc1ccccc1O	84827967	GQSDAFWRKDRWJX-UHFFFAOYSA-N	239.315	1.487	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)CC[C@@H]1O	190045126	JKRKDOHPOANPPD-PWSUYJOCSA-N	221.300	1.595	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCC(=O)C1)c1ccccc1O	827952031	DRHMEFPKRVOQEY-ZJUUUORDSA-N	247.294	1.939	10	20	BDCD	
Nc1ccc(CCNC(=O)NCC2CCC2)cc1	841706105	CATQDOKASHBRMY-UHFFFAOYSA-N	247.342	1.911	10	20	BDCD	
NC[C@@H]1CCN(Cc2cccc(Cl)c2O)C1	843048429	TVQXNXRGIKNDEF-VIFPVBQESA-N	240.734	1.826	10	20	BDCD	
C[C@H](CNC(=O)c1cc(O)cs1)C[C@@H](C)O	748375762	NDEAFWMGCPLENE-JGVFFNPUSA-N	243.328	1.591	10	20	BDCD	
CNC[C@H](C)N[C@@H](C)c1cc(F)cc(F)c1O	854231722	KSAWDYFCXHIHRK-YUMQZZPRSA-N	244.285	1.929	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](C)[C@H]2CO)c(O)c1	877464000	IETOMNYOXFVPCQ-DGCLKSJQSA-N	235.327	1.903	10	20	BDCD	
N[C@H]1C[C@@H](CN[C@H]2CCc3cccc(O)c32)C1	873249909	NJAQSOLUJJUPBW-WCQGTBRESA-N	232.327	1.706	10	20	BDCD	
CN(CC(N)=O)Cc1cc(Cl)cc(F)c1O	775649302	NYPAICIVUNFWAE-UHFFFAOYSA-N	246.669	1.102	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](N)C2)c1	70955778	BYUBOSAJIOSZQM-NSHDSACASA-N	206.289	1.234	10	20	BDCD	
Cc1cc(O)c(CN(C)C2CNC2)cc1Cl	1235922860	COUMWJUZFBIGHZ-UHFFFAOYSA-N	240.734	1.758	10	20	BDCD	
Cc1cccc(CN[C@@H](C(=O)O)C(C)C)c1O	158741871	HSOOKTOJOUGTEE-LLVKDONJSA-N	237.299	1.899	10	20	BDCD	
CN1CCC(C(=O)Nc2ccc(N)cc2)CC1	237105843	RXESYSMYHDIBKZ-UHFFFAOYSA-N	233.315	1.549	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCc2cnnn2C)c1	287278491	JMKOKWGKZMXXNU-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
C/C=C/C[C@@H](CO)NCc1cc(F)ccc1O	186534905	ADFDMLPOGHAZDT-JDGPPOGSSA-N	239.290	1.948	10	20	BDCD	
COc1ccc(CN[C@@]2(C)CCOC2=O)cc1C	289890260	SOVQAOMUSUEROO-AWEZNQCLSA-N	249.310	1.799	10	20	BDCD	
CCOC1CN(Cc2cc(OC)ccc2O)C1	297553863	ZVDQXILNVOLANI-UHFFFAOYSA-N	237.299	1.622	10	20	BDCD	
C/C(=C/COC(=O)c1cc(O)cs1)C(=O)O	825775586	VTKSNFXZERRSTQ-KXFIGUGUSA-N	242.252	1.641	10	20	BDCD	
Cc1n[nH]cc1CNC(=O)c1cc(O)cs1	732277139	BFLFKYCURCUUHP-UHFFFAOYSA-N	237.284	1.415	10	20	BDCD	
CN(Cc1cccc(Cl)c1O)[C@H]1CCNC1	843049326	KLTQLDXBGFFFEQ-JTQLQIEISA-N	240.734	1.839	10	20	BDCD	
C[C@@H](NCCN1CCC1)c1cc(F)ccc1O	697393914	NKAGATMZQKUOIW-SNVBAGLBSA-N	238.306	1.888	10	20	BDCD	
C[C@@H](N)CN(C)Cc1cccc(Cl)c1O	863651323	GMVTWGXHUMMTLW-MRVPVSSYSA-N	228.723	1.825	10	20	BDCD	
O=C(O)CCNCc1ccc2c(c1)CCCO2	82606396	ZXYXSFZCGVIXKU-UHFFFAOYSA-N	235.283	1.576	10	20	BDCD	
CON(C)CCN[C@H](C)c1cc(C)ccc1O	850478984	JGRGCPVILFECPJ-LLVKDONJSA-N	238.331	1.844	10	20	BDCD	
CC(CO)(CO)CSc1nccs1	379355933	MODLQQSVZBXQRA-UHFFFAOYSA-N	219.331	1.226	10	20	BDCD	
C[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1	126192898	HFAOFJZAHGWFCP-SECBINFHSA-N	235.283	1.970	10	20	BDCD	
C[C@@H](NCCN(C)C)c1ccc(F)c(F)c1O	287188807	VQBCDIRQMMUXJV-MRVPVSSYSA-N	244.285	1.883	10	20	BDCD	
Cc1ccc([C@@H](C)NCCN)c(O)c1C	817935490	WVBUEESJLPXQCA-SNVBAGLBSA-N	208.305	1.618	10	20	BDCD	
Cc1cc(O)c(CNC/C=C/CO)cc1Cl	826942158	NKEBLJKOPXRBIU-NSCUHMNNSA-N	241.718	1.992	10	20	BDCD	
CC[S@@](=O)CCNCc1c(C)cccc1O	877041120	IDTAISBXGWEIRS-MRXNPFEDSA-N	241.356	1.559	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@H]1CCNC1	841045466	WDGVSQDHAIAOHO-JTQLQIEISA-N	226.707	1.497	10	20	BDCD	
Cc1cc(CN2CCNC[C@H]2C)ccc1N(C)C	923279440	AUKPFWPAIUFECE-CYBMUJFWSA-N	247.386	1.855	10	20	BDCD	
OCC1(NCc2ccccc2O)CCCC1	53044529	RGYGFTPHLKAKSZ-UHFFFAOYSA-N	221.300	1.787	10	20	BDCD	
CC[C@@H](OC(=O)c1cc(O)cs1)C(=O)OC	762821808	IYDLUOIFKBXSAS-SSDOTTSWSA-N	244.268	1.562	10	20	BDCD	
C[C@@H](CNCc1cccc(F)c1O)C(=O)O	1118331324	PFZNSNRPIXFOQZ-ZETCQYMHSA-N	227.235	1.342	10	20	BDCD	
Cc1cc(O)c(CNC[C@@H]2COCO2)cc1C	894871976	HOIIHCOPCXCVDQ-GFCCVEGCSA-N	237.299	1.472	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)COC(F)F	797190897	QHEGCJJIEFTQQY-UHFFFAOYSA-N	245.225	1.590	10	20	BDCD	
COc1ccc(O)c(CN2CCCC2)c1	163165837	XLVZWOQRHOYSOQ-UHFFFAOYSA-N	207.273	1.997	10	20	BDCD	
CCCNC(=O)CN(C)c1ccc(OC)cc1	844354863	JAXXWZCUKRWAOY-UHFFFAOYSA-N	236.315	1.658	10	20	BDCD	
Cc1cccc(O)c1CNCCc1cn[nH]c1	877539394	LNQXLOQJSNWYFK-UHFFFAOYSA-N	231.299	1.756	10	20	BDCD	
C[C@@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccccc1O	834907312	NOPLOJVVWPJVHD-OUAUKWLOSA-N	248.326	1.697	10	20	BDCD	
COCC(=O)NCc1c(O)ccc2c1CCCC2	75159498	OGSZMRKDCMDEPK-UHFFFAOYSA-N	249.310	1.534	10	20	BDCD	
CC(C)NCCC(=O)NCCc1ccc(N)cc1	131837565	YZYYAJRWEDUFNZ-UHFFFAOYSA-N	249.358	1.316	10	20	BDCD	
CCOc1cccc(CNC2CC(N)C2)c1O	906510145	NMTRHOPBYVWACR-UHFFFAOYSA-N	236.315	1.370	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@H]1N	843120278	CMRVYJMZFNDJRB-LDYMZIIASA-N	240.734	1.825	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(F)c2O)CC[C@@H]1N	843051424	HFVBPQZNKFFJFL-SKDRFNHKSA-N	238.306	1.700	10	20	BDCD	
c1csc(SCC2OCCO2)n1	133450554	KOQVLZVWNLYZAR-UHFFFAOYSA-N	203.288	1.608	10	20	BDCD	
O=C(O)CCCNCc1cccc(F)c1O	165152325	ANQMCQMGAYRKIB-UHFFFAOYSA-N	227.235	1.486	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCc2ncn(C)n2)c1	186214122	CYTSLGJPNJZSIG-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
CN(CCCCC(=O)O)c1ccc(N)cc1	1606117150	KSQODNVEPSKZNA-UHFFFAOYSA-N	222.288	1.960	10	20	BDCD	
CC(C)(CF)NC(=O)NCc1ccc(N)cc1	1337070794	WMFXIIWHDTZZFW-UHFFFAOYSA-N	239.294	1.816	10	20	BDCD	
N[C@H]1CCC[C@@H](NCc2ccccc2O)C1	162936420	YDQXZJVSTSZHGZ-NWDGAFQWSA-N	220.316	1.752	10	20	BDCD	
Cc1ccc(CN[C@@H]2CCCCNC2=O)c(O)c1	876926449	VIEFZVUQHHASES-GFCCVEGCSA-N	248.326	1.459	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](CC(N)=O)C2)c1	368135265	PDZODWCSPJRYLS-LLVKDONJSA-N	248.326	1.398	10	20	BDCD	
COc1ccc(O)c(CNC[C@H]2CCN2C)c1	712585343	FXJBYBMHLMNTFL-LLVKDONJSA-N	236.315	1.195	10	20	BDCD	
COc1cccc(CN2[C@H]3CC[C@H]2COC3)c1O	695059606	IDHQHTSXZSBXHB-RYUDHWBXSA-N	249.310	1.764	10	20	BDCD	
Cc1nc(CN[C@H](C)c2ccccc2O)n[nH]1	392465481	RWYOJCNCOPTDNG-MRVPVSSYSA-N	232.287	1.670	10	20	BDCD	
Nc1ccc(NC(=O)NCC2CC2)cc1	35407565	UTDGKWXKVHIGFC-UHFFFAOYSA-N	205.261	1.800	10	20	BDCD	
CO[C@H](C)CNC(=O)Nc1ccc(N)cc1	224315905	QQFRYJNOUDUTRP-MRVPVSSYSA-N	223.276	1.425	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@@H]1N	84946453	GTFRCGNUOGDCCG-DOMZBBRYSA-N	247.386	1.922	10	20	BDCD	
C[C@@H](CCO)NCc1cc(Cl)ccc1O	96811788	YJLFBGHWSUBCNF-QMMMGPOBSA-N	229.707	1.906	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C[C@H](F)[C@H](F)C1	295719275	KUEKCZCADGMGEK-OCAPTIKFSA-N	243.209	1.230	10	20	BDCD	
Cc1cccc(CN2CC[C@H]([C@H](C)O)C2)c1O	272568235	VHBPEGLBXDRAEN-RYUDHWBXSA-N	235.327	1.903	10	20	BDCD	
C[C@H]1CO[C@H](C)CN1C(=O)c1cc(O)cs1	731868504	HAZFGEBOASWYFR-JGVFFNPUSA-N	241.312	1.703	10	20	BDCD	
CCCN1CC(=O)N[C@@H]1c1ccc(N(C)C)cc1	840822702	PICRPNWTFIVBLG-AWEZNQCLSA-N	247.342	1.593	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H]1C[C@H](CO)C1	897355594	XMYQZWSLTQVZDX-MQMHXKEQSA-N	248.370	1.922	10	20	BDCD	
COc1cc(C)cc(CN2CC[C@H](O)C2)c1O	893947512	XCYUNOWQOYUPKE-NSHDSACASA-N	237.299	1.276	10	20	BDCD	
CCc1cccc(CNC[C@@H](C)N(C)C)c1O	691502321	BZAXLFWWEXVIOR-LLVKDONJSA-N	236.359	1.994	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)C(=O)O	1605345130	YHCGXPCRQFMPSN-MRVPVSSYSA-N	209.245	1.263	10	20	BDCD	
Nc1ccc(CN(CCO)C2CC2)cc1	35366032	FYSMURHKFZTANN-UHFFFAOYSA-N	206.289	1.226	10	20	BDCD	
C[C@H](NC[C@@H](C)C(=O)O)c1c(O)cccc1F	1589067339	JFHPWHRKFCAMCY-SFYZADRCSA-N	241.262	1.903	10	20	BDCD	
CO[C@@H](C)C(=O)N(C)c1ccc(N)cc1	163761655	UJOQHYNEHPGTCL-QMMMGPOBSA-N	208.261	1.267	10	20	BDCD	
CCn1cnnc1NCc1ccc(N(C)C)cc1	922661118	ZESPPLCCIQPALK-UHFFFAOYSA-N	245.330	1.976	10	20	BDCD	
CN(C)c1ccc(CNC(=O)NCC2CC2)cc1	31728978	WVWWJVHYDICWCA-UHFFFAOYSA-N	247.342	1.962	10	20	BDCD	
CC[C@H](OC)C(=O)NCc1ccccc1O	299585171	RUBGNKLOHGSPIN-NSHDSACASA-N	223.272	1.433	10	20	BDCD	
CN(CCC1CC1)C(=O)c1cccc(O)c1O	193143854	SPDLKLRSEQOJCR-UHFFFAOYSA-N	235.283	1.970	10	20	BDCD	
C[C@@H]1COC[C@@H]1NCc1ccc2c(c1)CCO2	710894174	UBGSNECJFNWOOJ-MFKMUULPSA-N	233.311	1.746	10	20	BDCD	
CO[C@@H]1COC[C@@H]1NCc1cc(F)ccc1O	839192034	GMONDXUOBZMMFA-CMPLNLGQSA-N	241.262	1.035	10	20	BDCD	
CO[C@H](C)[C@@H](C)NCc1ccccc1O	133139774	UDNXNDAMHZTKIO-NXEZZACHSA-N	209.289	1.905	10	20	BDCD	
CN(C(=O)[C@H]1CCCCO1)c1ccc(N)cc1	50958620	NAQAIONSBSXMQV-GFCCVEGCSA-N	234.299	1.801	10	20	BDCD	
O=C(C[C@H]1CCCCO1)NCc1ccccc1O	122674377	LCMLJSBJWLAASX-GFCCVEGCSA-N	249.310	1.968	10	20	BDCD	
CN(C)C(=O)CNCc1cc(Cl)ccc1O	37225378	SQELQUVBBVQMMQ-UHFFFAOYSA-N	242.706	1.223	10	20	BDCD	
O=C(C=C1CCC1)NCc1ccc(O)c(O)c1	182530896	CYPQLGHFPVRKTA-UHFFFAOYSA-N	233.267	1.824	10	20	BDCD	
Cc1cc(O)c(CN(C)C[C@@H](C)O)cc1C	130759022	XJLJNKCEEOKFAX-LLVKDONJSA-N	223.316	1.822	10	20	BDCD	
O=C(O)CCNCc1c(O)ccc(Cl)c1F	381191810	YYKMQJIKQKXVPU-UHFFFAOYSA-N	247.653	1.749	10	20	BDCD	
CCC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O	86733674	TVKVWIOFVSEZQC-GFCCVEGCSA-N	249.310	1.964	10	20	BDCD	
Cn1cncc1C(=O)NCc1ccccc1O	236077990	XVHTZCXWEOKODY-UHFFFAOYSA-N	231.255	1.056	10	20	BDCD	
Cc1cccc(CN2CCC(CO)CC2)c1O	271835010	RTCVBTZZLLIAPQ-UHFFFAOYSA-N	235.327	1.905	10	20	BDCD	
CNCCCN[C@@H](C)c1ccc(F)cc1O	817941355	UABWZIBTKAQUIS-VIFPVBQESA-N	226.295	1.791	10	20	BDCD	
C[C@@H]1CN(C(=O)c2cc(O)cs2)CCO1	731865031	IIQYYPNUGKBKJS-SSDOTTSWSA-N	227.285	1.315	10	20	BDCD	
C[C@@H](CN(C)C(=O)c1cc(O)cs1)C(=O)O	736576339	XXODBIWVEVDZHU-LURJTMIESA-N	243.284	1.246	10	20	BDCD	
O=C(O)[C@@H]1CC[C@H](NCc2ccccc2O)C1	843037954	CNSNRDZZSMMXHG-KOLCDFICSA-N	235.283	1.735	10	20	BDCD	
CN(Cc1cccc(F)c1O)C1(CN)CCC1	843125300	ROXJSAPJPQHFRC-UHFFFAOYSA-N	238.306	1.845	10	20	BDCD	
CC1CC(NC(=O)c2cc(O)cs2)C1	752815663	BIDQVDYQYKSDSU-UHFFFAOYSA-N	211.286	1.982	10	20	BDCD	
O=C(NCC1(CO)CCC1)c1cc(O)cs1	753519770	AVFCVFYYUKNVSL-UHFFFAOYSA-N	241.312	1.346	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](O)[C@H]2C)c(O)c1	877571828	KHXMEHDKOBKBDM-ZYHUDNBSSA-N	221.300	1.656	10	20	BDCD	
C[C@H]1C[C@H](NC(=O)c2cc(O)cs2)CCO1	770412781	WIDSQZNTGGLKHJ-JGVFFNPUSA-N	241.312	1.751	10	20	BDCD	
COC(=O)c1cc2n(CCN=[N+]=[N-])ccn2n1	409438770	OLTFFMHEBVZMHD-UHFFFAOYSA-N	234.219	1.233	10	20	BDCD	
Nc1ccc(NC(=O)NCC2(CO)CCC2)cc1	841296108	OWBVRULRLGULSN-UHFFFAOYSA-N	249.314	1.553	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H]3NCC[C@@H]3C2)c1	381309960	CSJMYALGJNEVFZ-OCCSQVGLSA-N	246.354	1.884	10	20	BDCD	
CCOC[C@H](C)NCc1ccccc1O	44688536	PSUPPIUUFISMCG-JTQLQIEISA-N	209.289	1.907	10	20	BDCD	
COc1ccc(O)c(CNC2CC(OC)C2)c1	230690162	XZUTZPOAOYIWRU-UHFFFAOYSA-N	237.299	1.668	10	20	BDCD	
Cc1cccc(CN[C@H]2CCN(C)C2)c1O	162861243	WYNCNXVRGLCSOM-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
Cc1cc(O)c(CN2CC(=O)N[C@H](C)C2)cc1C	295127927	YDFVELAZHNWKQZ-LLVKDONJSA-N	248.326	1.329	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@@H]2CCNC2)c1	817944713	KCWUSYLFTCGDRP-VHSXEESVSA-N	236.315	1.413	10	20	BDCD	
C[C@H](N[C@H]1CCNC1)c1ccc(F)cc1O	817945073	SPMLADFWIXWHQA-WPRPVWTQSA-N	224.279	1.544	10	20	BDCD	
C[C@H]1CN(C(=O)c2cc(O)cs2)CCCO1	732284611	URXHUNCUEZVGQV-QMMMGPOBSA-N	241.312	1.705	10	20	BDCD	
COc1cc(CN2CC[C@@H]2CO)c(O)cc1C	902630672	BYNHZAIBDUNAJL-LLVKDONJSA-N	237.299	1.276	10	20	BDCD	
CCOCCC(=O)NCc1ccc(O)cc1O	910956465	WJSPVXHWRXJJNB-UHFFFAOYSA-N	239.271	1.141	10	20	BDCD	
C[C@H](NC(=O)c1cc(O)cs1)[C@@H]1CCOC1	743670883	VXHILZCFHYMAMO-JGVFFNPUSA-N	241.312	1.609	10	20	BDCD	
CC[C@H](N)CNCc1c(O)cccc1OC	841069646	CBXCTDQPXGGQRP-VIFPVBQESA-N	224.304	1.228	10	20	BDCD	
COc1cccc(CN[C@H](C)CCCN)c1O	841081725	XNQRCOKPFGPEIV-SNVBAGLBSA-N	238.331	1.618	10	20	BDCD	
Cc1cc(O)c(CN(C)C[C@H](C)N)cc1C	863652443	SYBRAKCPAHUUCB-NSHDSACASA-N	222.332	1.788	10	20	BDCD	
Cc1ccc(CN[C@@H](CO)CCF)c(O)c1	877614962	PVJUTIOPHMPMFY-LLVKDONJSA-N	227.279	1.511	10	20	BDCD	
COC[C@@H]1CN(c2ccc(N)cc2)C[C@H]1C	409433592	YOKRXZNNSLJWBG-MNOVXSKESA-N	220.316	1.988	10	20	BDCD	
C[C@@H](O)CCNCc1c(O)cccc1Cl	83608000	BLEZNUCEFHSQSP-MRVPVSSYSA-N	229.707	1.906	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCC[C@@H]2CN)cc1	89147861	QUVALSMNYAEKQX-HIFRSBDPSA-N	247.386	1.970	10	20	BDCD	
C[C@@H](CC(N)=O)NCc1c(O)cccc1Cl	158895837	MUYRELKHUHQZDZ-ZETCQYMHSA-N	242.706	1.399	10	20	BDCD	
CS[C@H](CO)[C@@H](C)NCc1ccccc1O	164279012	NPWYYJMMHGATNN-BXKDBHETSA-N	241.356	1.594	10	20	BDCD	
CCOCC(=O)NCc1cccc(OC)c1O	155623815	UPILFUMKYYSTKU-UHFFFAOYSA-N	239.271	1.054	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)c2cn[nH]c2)c1	224935460	AVERPQRYTUTPMX-SECBINFHSA-N	247.298	1.975	10	20	BDCD	
CCOc1cccc(CN(C)C[C@@H](C)N)c1O	310327579	ZGYUFLQMXBNJLQ-SNVBAGLBSA-N	238.331	1.570	10	20	BDCD	
COC[C@@H](C)NCc1cc2c(cc1O)OCO2	42879132	GTHBMDQUJHHUNB-MRVPVSSYSA-N	239.271	1.245	10	20	BDCD	
COc1cccc(CN(C)CC[C@H](C)O)c1O	93481657	XHGITXSJZWSIMW-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
COCCCN(C)Cc1ccccc1O	96477927	AZKYQBDAGWENAW-UHFFFAOYSA-N	209.289	1.861	10	20	BDCD	
CC(C)[C@@H](OC(=O)c1cc(O)cs1)C(N)=O	732353827	ASLGYWFMNKMKDP-MRVPVSSYSA-N	243.284	1.120	10	20	BDCD	
CC[C@H](NCc1ccc2c(c1)CCCO2)C(=O)O	900035324	HJQFDBNMJKRLRX-LBPRGKRZSA-N	249.310	1.964	10	20	BDCD	
CC(=O)C(=O)Cn1c(Br)cnc1C	918302214	WILIWPLIQLJZJY-UHFFFAOYSA-N	245.076	1.112	10	20	BDCD	
C[C@@H]1C[C@@H]1CNC(=O)NCCc1ccc(N)cc1	841710705	HTUMGHPMUDYQAV-ZYHUDNBSSA-N	247.342	1.767	10	20	BDCD	
COc1cccc(CNC[C@@H](N)C2CC2)c1O	841049684	MTXCWEIXTDTYOB-LLVKDONJSA-N	236.315	1.228	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H]2CCC[C@H]2N)cc1	852795933	MJIVRCAQVFRFFM-QWHCGFSZSA-N	247.342	1.055	10	20	BDCD	
Cc1cccc(O)c1CNC[C@]1(C)CCC(=O)N1	877578058	SFVXDHVIUVICQL-AWEZNQCLSA-N	248.326	1.459	10	20	BDCD	
Cc1cccc(O)c1CN1CC(C)(O)C1	877580886	JAHYHRMZDQDSGL-UHFFFAOYSA-N	207.273	1.267	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H]1O	785765155	SLHXKDRMSNCWFD-FZMZJTMJSA-N	234.343	1.565	10	20	BDCD	
Cc1cc(O)c(CN2CC(C)(C(=O)O)C2)cc1C	1607700048	RLCPQIZNWCZXKX-UHFFFAOYSA-N	249.310	1.916	10	20	BDCD	
C[C@@H](NC(=O)CCCN)c1ccccc1O	870988685	XAQRCQKSQXCKRE-SECBINFHSA-N	222.288	1.308	10	20	BDCD	
C[C@H](CN1CCCC1=O)NCc1ccccc1O	37782334	ZXBFRHASXCVETB-LLVKDONJSA-N	248.326	1.493	10	20	BDCD	
C[C@@H](O)[C@@H]1CCN(Cc2ccccc2O)C1	134735137	AKKCRFDCTQIEJJ-GHMZBOCLSA-N	221.300	1.595	10	20	BDCD	
Cc1cc(O)c(CNCC(=O)NC2CC2)cc1C	266232976	VDLTUVMPJFABNT-UHFFFAOYSA-N	248.326	1.377	10	20	BDCD	
CC(=O)C(=O)COc1cccc(C)c1[N+](=O)[O-]	289630695	MIWWBNIYHXMECC-UHFFFAOYSA-N	237.211	1.440	10	20	BDCD	
C[C@@H]1C[C@@H](NCCN)c2c(O)ccc(F)c21	817935456	WERXVXVPVNSXCG-VXNVDRBHSA-N	224.279	1.628	10	20	BDCD	
C[C@@H](NC[C@H](N)C1CC1)c1ccc(F)cc1O	817965928	XCTLLZKVBKZMII-PELKAZGASA-N	238.306	1.919	10	20	BDCD	
CO[C@H](CNC(=O)c1cc(O)cs1)C1CC1	832895020	WBYOQCSSURTLSI-SECBINFHSA-N	241.312	1.609	10	20	BDCD	
C[C@@](CO)(NC(=O)c1cc(O)cs1)C1CC1	830385237	IBJWDMKMFIHZIQ-NSHDSACASA-N	241.312	1.345	10	20	BDCD	
Cc1ncc(/C=C\C(=O)N(C)c2cn[nH]c2)s1	749244263	QVGKFNFFNSKVDE-ARJAWSKDSA-N	248.311	1.851	10	20	BDCD	
C[C@H]1NCCC[C@H]1NCCc1ccc(N)cc1	925689552	BXKNOEXKDGFNJK-BXUZGUMPSA-N	233.359	1.541	10	20	BDCD	
Cc1cccc(O)c1CN(C)C[C@H](O)C1CC1	877527724	OFYHAAKNGPOFOY-AWEZNQCLSA-N	235.327	1.903	10	20	BDCD	
COCC1CN(Cc2cc(F)ccc2O)C1	895971860	VDONETSDROZHEQ-UHFFFAOYSA-N	225.263	1.610	10	20	BDCD	
Cc1cccc(CNC2CCNCC2)c1O	841026832	RRFAFBFNBYEIRQ-UHFFFAOYSA-N	220.316	1.542	10	20	BDCD	
Cc1ccc(CN[C@@H](CO)C2CC2)c(O)c1	877045540	XWRNEMMBAPFGGD-LBPRGKRZSA-N	221.300	1.561	10	20	BDCD	
COC[C@@H](CNCc1ccc(C)cc1O)OC	877188631	DBRNTNRTBHYXBO-GFCCVEGCSA-N	239.315	1.452	10	20	BDCD	
CCNC(=O)NCc1ccc2c(c1)CCCN2C	58483285	LZSYSBVNRWNHNE-UHFFFAOYSA-N	247.342	1.888	10	20	BDCD	
c1csc(SCc2nnnn2C2CC2)n1	64669661	RPFSNTBWAGMBBR-UHFFFAOYSA-N	239.329	1.757	10	20	BDCD	
CO[C@@H]1CCN(Cc2cc(C)ccc2O)C1	300046287	SPGDHDXYOKFEFO-GFCCVEGCSA-N	221.300	1.921	10	20	BDCD	
C[C@]1(C(=O)Nc2ccc(N)cc2)CCCCN1	180895592	LJVSZEVUZQHMNY-CYBMUJFWSA-N	233.315	1.740	10	20	BDCD	
O=C(CC[C@H]1CCNC1)NCc1ccccc1O	228423936	JJSWCVSTFAUQFV-NSHDSACASA-N	248.326	1.398	10	20	BDCD	
c1csc(SCCCN2CCOCC2)n1	195337755	JQEMOSRPVVKNHU-UHFFFAOYSA-N	244.385	1.958	10	20	BDCD	
Nc1ccc(CN(CCO)C2CCC2)cc1	228329403	PZKCLBJGTBBKTB-UHFFFAOYSA-N	220.316	1.616	10	20	BDCD	
C[C@H](CCO)NCc1ccc2c(c1)CCO2	96811639	KTIRRCPSZPBDNN-SNVBAGLBSA-N	221.300	1.482	10	20	BDCD	
C[C@H](CN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O	817966164	HSBGQOJGUUCJRH-HTQZYQBOSA-N	239.275	1.298	10	20	BDCD	
CNCCN[C@H](C)c1cc(Cl)ccc1O	817952804	SUTBVAQUTIFAGP-MRVPVSSYSA-N	228.723	1.916	10	20	BDCD	
CC[C@]1(NC(=O)c2cc(O)cs2)CCOC1	834356215	VHYWKBXNSBREOK-NSHDSACASA-N	241.312	1.753	10	20	BDCD	
Cc1cccc(CN2[C@@H](C)CNC[C@H]2C)c1O	843065708	OZWBUVPMECZALX-TXEJJXNPSA-N	234.343	1.883	10	20	BDCD	
CCNCCNCc1cccc(Cl)c1O	841037711	TVWQEHQAWAQBPN-UHFFFAOYSA-N	228.723	1.745	10	20	BDCD	
CCCONC(=O)c1c(F)ccc(O)c1O	844150729	VXFDOSQAUWXEHF-UHFFFAOYSA-N	229.207	1.308	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)CCN)c1	841049789	HQSUQQUDCXWMIS-VIFPVBQESA-N	224.304	1.228	10	20	BDCD	
C[C@@H](C[C@@H](C)N)NCc1ccccc1O	843129429	OOXYJMCUIMRRDC-ZJUUUORDSA-N	208.305	1.608	10	20	BDCD	
O=C(NCCc1ccncc1)c1cc(O)cs1	764319434	WGUFQZIZJYNUKH-UHFFFAOYSA-N	248.307	1.821	10	20	BDCD	
C[C@H]1[C@@H](C)OCCN1C(=O)c1cc(O)cs1	768258302	OAUGQKPDNDRFKY-JGVFFNPUSA-N	241.312	1.703	10	20	BDCD	
Cc1ocnc1CNC(=O)c1cc(O)cs1	765340036	IPIYBFPFADWKSO-UHFFFAOYSA-N	238.268	1.680	10	20	BDCD	
CC(=O)C1=NN(c2ccc(C)cc2C)C(=O)C1	871941140	WGEOIPZIIPSTQA-UHFFFAOYSA-N	230.267	1.985	10	20	BDCD	
CN(Cc1cc(Cl)ccc1O)[C@@H]1CCNC1	70892262	AGUXRCLMENXSKH-LLVKDONJSA-N	240.734	1.839	10	20	BDCD	
C[C@@H]1CC[C@H](CNCc2ccc(N)cc2)O1	398106446	KNRPMKOZYSJMND-ZWNOBZJWSA-N	220.316	1.926	10	20	BDCD	
COC[C@H](C)C(=O)Nc1ccc(N)cc1	237234627	FIHGSZRKSGRFED-QMMMGPOBSA-N	208.261	1.490	10	20	BDCD	
C[C@@H](NC[C@H]1CNC(=O)C1)c1ccccc1O	398363915	YXXMYUUUDVFAQI-ZJUUUORDSA-N	234.299	1.179	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@@H](O)C2(C)C)c1O	128233622	XMQCEBJYXGJSSU-NWDGAFQWSA-N	235.327	1.950	10	20	BDCD	
COc1cc(Cl)cc(CNCCCO)c1O	76274271	GODLLUQOLUSNBY-UHFFFAOYSA-N	245.706	1.526	10	20	BDCD	
C[C@H](NCC(F)(F)CO)c1ccc(F)cc1O	184698456	XDESEPYKEZSQGV-ZETCQYMHSA-N	249.232	1.810	10	20	BDCD	
CCOc1ccc(N(C)C[C@@H](C)O)cc1	49814625	AFYVXKOGDBPGJB-SNVBAGLBSA-N	209.289	1.902	10	20	BDCD	
C[C@H](N)CN(C)Cc1cc(F)ccc1O	380114033	SRBCADYTAUYQGC-QMMMGPOBSA-N	212.268	1.310	10	20	BDCD	
C[C@@H]1CSC[C@H]1NC(=O)c1cc(O)cs1	807692515	ZSIGOEPJJIKWNZ-HTRCEHHLSA-N	243.353	1.935	10	20	BDCD	
Cc1ccc(O)c(CNC/C=C/CO)c1	717525088	JGZVKHGYIZTHMH-NSCUHMNNSA-N	207.273	1.339	10	20	BDCD	
COC(=O)c1cnc(SCC[C@H](C)O)s1	829678105	YUXKRTODHPVSFC-LURJTMIESA-N	247.341	1.793	10	20	BDCD	
COC(=O)[C@H]1C[C@@H](NCc2cccc(C)c2O)C1	827501635	ZERWDJJXOSCJLH-TXEJJXNPSA-N	249.310	1.742	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCCNCC2)c1	841056783	FEIBOYUQTVLVBV-CYBMUJFWSA-N	234.343	1.932	10	20	BDCD	
CCONC(=O)N[C@H](C)c1ccccc1O	867975696	OWQCBVDOIIEYEL-MRVPVSSYSA-N	224.260	1.704	10	20	BDCD	
CCOc1ccc(N(C)Cc2cnnn2C)cc1	1119253629	NGHZFDIBSZAWTA-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCN[C@@H]1C)c1ccccc1O	870988329	MTASIQKVRWDBFL-FOGDFJRCSA-N	248.326	1.567	10	20	BDCD	
CNC[C@@H](C)CNCc1ccc(N)cc1	1120371034	NGIMHKQWVIGYKQ-SNVBAGLBSA-N	207.321	1.214	10	20	BDCD	
NC(=O)C1(NCc2cccc(Cl)c2O)CC1	191484433	OCNTVJHJBYLANV-UHFFFAOYSA-N	240.690	1.153	10	20	BDCD	
CCCN(CC(=O)O)Cc1ccc(N)cc1	1595856156	IAPFRSHFJSJJNB-UHFFFAOYSA-N	222.288	1.565	10	20	BDCD	
Cc1cc(O)c(CN[C@@H]2CC[C@H]2O)cc1Cl	1343077574	PQCDNTOPKKNZEX-GHMZBOCLSA-N	241.718	1.967	10	20	BDCD	
CNC[C@@H](C)CNCc1cc(C)c(C)cc1O	1345100668	URPQJDUAEYIYCE-SNVBAGLBSA-N	236.359	1.954	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@H](CO)C2)c1O	897357642	MVLNDKLCDFILMR-UMSPYCQHSA-N	221.300	1.561	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@H](CN)C2)c1	50245444	RAMYRSLSFKUJMQ-SNVBAGLBSA-N	236.315	1.181	10	20	BDCD	
CC(C)CNC(=O)/C=C/c1ccc(O)c(O)c1	26283649	RNZWOGIRBNBORU-GQCTYLIASA-N	235.283	1.883	10	20	BDCD	
c1cc(N2CCOCC2)ccc1CNC1CC1	20082965	DLHRGKSLKXIPRQ-UHFFFAOYSA-N	232.327	1.775	10	20	BDCD	
CN(C)c1ccc(CNC2(C(=O)O)CCC2)cc1	283769027	BRJXAGFQDDZBCX-UHFFFAOYSA-N	248.326	1.850	10	20	BDCD	
CC[C@@H](CCO)NCc1cccc(OC)c1O	77453144	DNDUQCFURPDWOQ-NSHDSACASA-N	239.315	1.651	10	20	BDCD	
CN(Cc1ccccc1O)CC(C)(C)CN	86637516	BZZLHBIRGDOAGQ-UHFFFAOYSA-N	222.332	1.809	10	20	BDCD	
Oc1cccc(Cl)c1CNC[C@H](O)C1CC1	83599854	IFZQPOGBJMMXQG-LBPRGKRZSA-N	241.718	1.906	10	20	BDCD	
COC[C@H]1CCN(Cc2ccccc2O)C1	132743675	AKCDPQCDSSTUHE-NSHDSACASA-N	221.300	1.861	10	20	BDCD	
OCC[C@]1(NCc2ccccc2O)CCOC1	278502764	ODLAHFIZERTMJR-ZDUSSCGKSA-N	237.299	1.023	10	20	BDCD	
CCN(CCO)Cc1c(O)cccc1OC	768141290	VPYZFTMFCSNBDN-UHFFFAOYSA-N	225.288	1.215	10	20	BDCD	
CCOc1ccc(N(C)Cc2nnn(C)n2)cc1	788021320	UMZYOMDIEJZFPK-UHFFFAOYSA-N	247.302	1.245	10	20	BDCD	
CC[C@H](F)C(=O)NCc1ccc(O)cc1O	1120745538	ABDWWGLHBOLDBF-VIFPVBQESA-N	227.235	1.462	10	20	BDCD	
C[C@@H](O)[C@H]1CCN(Cc2ccc(N)cc2)C1	161633472	JNWIGMWTZLGXSS-PWSUYJOCSA-N	220.316	1.472	10	20	BDCD	
NC[C@H]1CC[C@H](NC(=O)Cc2ccc(N)cc2)C1	834860620	CKRAUQBJEQKKQX-AAEUAGOBSA-N	247.342	1.055	10	20	BDCD	
C[C@@H](C(=O)O)N(C)Cc1cc(F)ccc1O	235493587	ITDJWMHZCPQLOA-ZETCQYMHSA-N	227.235	1.436	10	20	BDCD	
CN(C)c1ccc(CNCc2cn(C)cn2)cc1	311125454	POGSYXYNACOYDB-UHFFFAOYSA-N	244.342	1.776	10	20	BDCD	
CN1CCC(C(=O)N(C)c2ccc(N)cc2)CC1	702110729	NJQKTUSRVSPPIY-UHFFFAOYSA-N	247.342	1.573	10	20	BDCD	
CN1CCCN=C1NCc1ccc(N(C)C)cc1	848982346	JSOUXNSCNVRDLR-UHFFFAOYSA-N	246.358	1.534	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1C[C@H](N)C1)c1ccccc1O	877256477	XAKQJTIXDZJIMU-OPRDCNLKSA-N	234.299	1.307	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2CCCOC2)cc1	62192910	NNNYXWYFJCJTLK-LLVKDONJSA-N	234.299	1.312	10	20	BDCD	
CC[C@H](C)C[C@@H](N)C(=O)NCc1ccc(N)cc1	1356237803	AXPQFUIMNSBWCN-GXFFZTMASA-N	249.358	1.649	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](C)CO)c1	78638541	QRLDDCYCCLVGLD-SNVBAGLBSA-N	209.289	1.419	10	20	BDCD	
C[C@H]1C[C@@H]1C(=O)NCCc1ccc(N)cc1	40675581	MVYOQRARGBVRBZ-CABZTGNLSA-N	218.300	1.584	10	20	BDCD	
CCN(CCCO)c1ccc(OC)cc1	264209427	LXWMPUDKVOBWMP-UHFFFAOYSA-N	209.289	1.904	10	20	BDCD	
Cc1cc(CN2C[C@@H](O)[C@H](C)C2)ccc1N(C)C	815081055	QOCRTPYXGBSYBA-IUODEOHRSA-N	248.370	1.874	10	20	BDCD	
CCc1cccc(CNC/C=C/CO)c1O	717438270	PAONYJUYNCXZHB-ONEGZZNKSA-N	221.300	1.593	10	20	BDCD	
CC(C)CONC(=O)Nc1ccc(N)cc1	841297607	HIVOQZCTSKICOR-UHFFFAOYSA-N	223.276	1.978	10	20	BDCD	
Cc1cccc(CN(C)[C@H]2CCNC2)c1O	843049927	YVNSBGLASAPAQX-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1ccc(C)cc1O	877556243	NGAJAOCJGOMDPC-LBPRGKRZSA-N	223.316	1.903	10	20	BDCD	
CC1(O)CN(Cc2ccc(N3CCCC3)cc2)C1	1119246261	ZMFNUKBOOVCNQW-UHFFFAOYSA-N	246.354	1.853	10	20	BDCD	
C[C@H]1C[C@@H](N)CCN1Cc1ccc(N)cc1	1120268395	DHIPQJVDIYXVOU-GWCFXTLKSA-N	219.332	1.580	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H]2CCC[C@]2(CO)C1	409426032	BUNABGWWLQANAR-VHSXEESVSA-N	210.281	1.391	10	20	BDCD	
OCC1(CSc2nccs2)COC1	84853286	BZLUKZLSGKNQGM-UHFFFAOYSA-N	217.315	1.244	10	20	BDCD	
Nc1ccc(CN2C[C@@H]3CCC[C@]3(N)C2)cc1	1334754804	RSCDCFAMMBWOFY-JSGCOSHPSA-N	231.343	1.582	10	20	BDCD	
C[C@@H](NCCS(C)(=O)=O)c1ccccc1O	37740564	XDTUPCLSHKKSKQ-SECBINFHSA-N	243.328	1.087	10	20	BDCD	
CC[C@@H](CNCc1cc(OC)ccc1O)OC	290818271	GQUKAZNLKDEDSK-NSHDSACASA-N	239.315	1.915	10	20	BDCD	
CC(=O)NCCN(C)Cc1cccc(C)c1O	308319666	XTXHBBASJSOJST-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CC1(C)NCC[C@H]1NCc1ccccc1O	841085549	GSUWNTIFNQKNRP-GFCCVEGCSA-N	220.316	1.622	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H](C(=O)O)C2)cc1	86789460	CBIQDJPATCDLRM-LBPRGKRZSA-N	248.326	1.659	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CCSC2)cc1	226357227	MAOQIORUMYZIOQ-LLVKDONJSA-N	236.340	1.433	10	20	BDCD	
Cc1ccc(C(=O)N2CCC(=O)CC2)c(O)c1O	272689305	VJMYTJZANKYEBX-UHFFFAOYSA-N	249.266	1.211	10	20	BDCD	
NC[C@H]1CCC[C@H]1NCCc1ccc(N)cc1	817958113	SEEMBMQCGVCCCZ-TZMCWYRMSA-N	233.359	1.528	10	20	BDCD	
CC(C)(C)[C@H](CN)NCc1ccccc1O	841087651	PGUYILTZGPVZMU-LBPRGKRZSA-N	222.332	1.855	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC[C@H]2C[C@H]2C1	856060744	BJCJCBKPTNPUJY-YUMQZZPRSA-N	223.297	1.936	10	20	BDCD	
Cc1cccc(CNC[C@H]2COCO2)c1O	894875711	IPFSYRIROSFMLD-NSHDSACASA-N	223.272	1.163	10	20	BDCD	
COCCC(=O)NCc1ccc(OC)cc1O	794376736	JKGWGJYNJSUUHJ-UHFFFAOYSA-N	239.271	1.054	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCC[C@H]2O)cc1	716266359	JWTOYCXLHGMVCF-VXGBXAGGSA-N	206.289	1.272	10	20	BDCD	
C[C@H](O)CCCOC(=O)c1cc(O)cs1	795503606	AXXOGDWTSWHXTR-ZETCQYMHSA-N	230.285	1.772	10	20	BDCD	
C[C@@H](CC(=O)O)NCc1cc(F)cc(F)c1O	1776401805	NABOTDZFQPSEMX-LURJTMIESA-N	245.225	1.623	10	20	BDCD	
O=C(C=C1CCC1)NCCc1ccc(O)c(O)c1	158040187	UIGFGBPAVGCPCP-UHFFFAOYSA-N	247.294	1.867	10	20	BDCD	
C[C@@H](CNC(=O)Cc1ccc(N)cc1)C1CC1	156887355	FTLKJRZOABSVDK-JTQLQIEISA-N	232.327	1.974	10	20	BDCD	
Cc1ccc(CNCCc2cn[nH]c2)c(O)c1	877538602	FLOBFSUNGPBNDA-UHFFFAOYSA-N	231.299	1.756	10	20	BDCD	
O[C@@H](CCNCc1ccc2c(c1)CCO2)C1CC1	898206080	LJUCQNQXKSAGMS-AWEZNQCLSA-N	247.338	1.872	10	20	BDCD	
COc1cccc(CNC[C@H](O)C(C)C)c1O	134698256	PAVCVHUECZDXHY-NSHDSACASA-N	239.315	1.507	10	20	BDCD	
Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCN	37712542	UNBOJUXYLHSOOU-VHSXEESVSA-N	220.316	1.797	10	20	BDCD	
Cc1ccc(O)c(CNCC(=O)NC2CC2)c1	71407084	LXBQVPQUTCPLNY-UHFFFAOYSA-N	234.299	1.069	10	20	BDCD	
CC[C@H](CO)N[C@H](C)c1cc(F)ccc1O	87111342	COJWEHCPVQVWFR-PSASIEDQSA-N	227.279	1.953	10	20	BDCD	
CC(=O)C(=O)COc1cccc(F)c1F	808021147	BIDVCHBDVRNNGG-UHFFFAOYSA-N	214.167	1.502	10	20	BDCD	
CC(C)NC(=S)NCc1ccccc1O	748155986	CIYBQDHZKLCPFR-UHFFFAOYSA-N	224.329	1.765	10	20	BDCD	
NC[C@H]1CC[C@H](NCc2cccc(F)c2O)C1	841084534	KHGCNHVDCVFCOF-ONGXEEELSA-N	238.306	1.748	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1C(=O)CNC1=O	777655521	KEQGBNAASKZXNH-UHFFFAOYSA-N	247.298	1.113	10	20	BDCD	
C[C@H](NCC(C)(C)O)c1c(O)cccc1F	886525955	BOPYAEAEXFKLTD-QMMMGPOBSA-N	227.279	1.953	10	20	BDCD	
CCON(CC)C(=O)c1c(F)ccc(O)c1O	881450389	FDULYBGXGKLMPC-UHFFFAOYSA-N	243.234	1.651	10	20	BDCD	
Nc1ccc(CC(=O)N2C[C@H](F)[C@H](F)C2)cc1	714597754	JOHXRJAAOPMXOF-PHIMTYICSA-N	240.253	1.330	10	20	BDCD	
CC(C)CC(=O)NCc1cccc(O)c1O	1347531096	PIYLJCFKKGKPLS-UHFFFAOYSA-N	223.272	1.760	10	20	BDCD	
Nc1ccc(CNS(=O)(=O)CCCF)cc1	1580446796	HAALRTHMYVIANV-UHFFFAOYSA-N	246.307	1.048	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2ccc[nH]2)c1	155965081	OLYOTOOSRIUSDO-UHFFFAOYSA-N	246.266	1.659	10	20	BDCD	
CC(C)C[C@@H](CN)NCc1ccccc1O	841037603	BBKKJXNLUBQRAL-LBPRGKRZSA-N	222.332	1.855	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC[C@@H](C)CO)c1	83216063	XZLJDFQLWLQPHY-MNOVXSKESA-N	223.316	1.980	10	20	BDCD	
C[C@@H](CCO)NCc1ccc2c(c1)CCCO2	921762903	RJIRSEWUACXDPZ-NSHDSACASA-N	235.327	1.872	10	20	BDCD	
CC[C@@H](O)CN[C@H]1CCc2cccc(O)c21	309511667	PQBATQJHLFZQES-MNOVXSKESA-N	221.300	1.740	10	20	BDCD	
OCC(F)(F)CNCc1ccc2c(c1)CCO2	183892410	DIPNJTWNXKDGFG-UHFFFAOYSA-N	243.253	1.339	10	20	BDCD	
CNC[C@@H]1CCN(Cc2cc(C)ccc2O)C1	71409545	VVPNPEXDLMUKJW-LBPRGKRZSA-N	234.343	1.742	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCc2cn[nH]c2)c1	38005753	FNZRITCLDWSHPB-VIFPVBQESA-N	247.298	1.975	10	20	BDCD	
CCCOCC(=O)NCCc1ccc(N)cc1	226249117	BORLJILGXBWZAO-UHFFFAOYSA-N	236.315	1.354	10	20	BDCD	
C[C@@H](NCCN1CCC1)c1ccccc1O	381483359	UGKVAOJCNBJPQP-LLVKDONJSA-N	220.316	1.749	10	20	BDCD	
CC(=O)C(=O)Cn1cccc(C(F)(F)F)c1=O	289540441	FMBIDSRCYWUOMN-UHFFFAOYSA-N	247.172	1.025	10	20	BDCD	
Cc1cccc(CN2C[C@H](O)C(C)(C)C2)c1O	280452570	LJJSUQYJCXZHGC-LBPRGKRZSA-N	235.327	1.903	10	20	BDCD	
Nc1ccc(CNC2(CO)CCC2)cc1	1336285227	JQEACQNYEOGLLD-UHFFFAOYSA-N	206.289	1.273	10	20	BDCD	
C[C@@H](NC[C@@H](N)C1CC1)c1ccccc1O	817964726	GJAJFKWPQPJNHI-BXKDBHETSA-N	220.316	1.780	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCC[C@H](C)N)c1	817954319	YMQKPYXCJNPNRY-UWVGGRQHSA-N	238.331	1.789	10	20	BDCD	
COC(=O)c1cnc(SCC[C@@H](C)O)s1	829678106	YUXKRTODHPVSFC-ZCFIWIBFSA-N	247.341	1.793	10	20	BDCD	
C[C@](CCF)(NCc1ccccc1O)C(=O)O	901914809	FBDREWLWYNCIHE-GFCCVEGCSA-N	241.262	1.685	10	20	BDCD	
C[C@@H](CCN(C)C)NC(=O)Cc1ccc(N)cc1	49551416	TTZAWGDEGZMWKG-NSHDSACASA-N	249.358	1.268	10	20	BDCD	
COc1cccc(O)c1CN(C)CC[C@@H](C)O	769450858	IDSNAQBHRRIXIT-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
O=C(NC[C@H]1CCC=CO1)c1cc(O)cs1	782040723	WEJQCSRUQAKVRB-SECBINFHSA-N	239.296	1.876	10	20	BDCD	
O=C1OCC[C@@H]1NCc1ccc2c(c1)CCO2	895799388	REMOLGMYOMUIJK-NSHDSACASA-N	233.267	1.027	10	20	BDCD	
C[C@@H]1[C@H](O)CCN1Cc1cc(F)cc(F)c1O	894916309	DTCBEIUXVCOTDT-RDDDGLTNSA-N	243.253	1.626	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NCc1cc(C)ccc1O	703675420	IEVHOCVOSFSRET-OLZOCXBDSA-N	221.300	1.968	10	20	BDCD	
CC(C)(C)[C@H](CO)NCc1ccccc1O	207538121	WHJPLZJRKJLOTE-LBPRGKRZSA-N	223.316	1.889	10	20	BDCD	
COc1cc(C)c(CN2CCCCN2)c(O)c1	1579145258	XWXQSDIJDCXGPL-UHFFFAOYSA-N	236.315	1.810	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@@H]2C(N)=O)c1	160358951	JUXSJYXOVZOZJU-LLVKDONJSA-N	234.299	1.150	10	20	BDCD	
N[C@@H]1CCC[C@H](NCc2ccc3c(c2)CCO3)C1	841055522	PCMNUMAKAJSOSP-KGLIPLIRSA-N	246.354	1.981	10	20	BDCD	
Cc1cccc(CN[C@H]2CC[C@@H](CN)C2)c1O	841084092	FZVVQSXDDKLBTG-YPMHNXCESA-N	234.343	1.918	10	20	BDCD	
Cc1ccc(CN2CCO[C@H](CF)C2)c(O)c1	877586494	HLPXCYNIOKIFOK-GFCCVEGCSA-N	239.290	1.871	10	20	BDCD	
CO[C@H]1COC[C@@H]1NCc1cc(F)ccc1O	290816592	GMONDXUOBZMMFA-JQWIXIFHSA-N	241.262	1.035	10	20	BDCD	
Nc1ccc(CCNC(=O)NCC2CC2)cc1	701031880	XKXGEMOSAXKDFO-UHFFFAOYSA-N	233.315	1.521	10	20	BDCD	
CC(=O)N1CCN(Cc2ccc(N)cc2)[C@H](C)C1	1352788894	REBPURHFZVRIQF-LLVKDONJSA-N	247.342	1.321	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](C)CO)c1	78638544	QRLDDCYCCLVGLD-JTQLQIEISA-N	209.289	1.419	10	20	BDCD	
COCCS(=O)(=O)Nc1ccc(O)c(C)c1	148631203	JMSYEFANHDYOFD-UHFFFAOYSA-N	245.300	1.089	10	20	BDCD	
COCCOCCN(C)c1ccc(N)cc1	70027633	GDTJBXCQONKIRP-UHFFFAOYSA-N	224.304	1.368	10	20	BDCD	
Oc1ccccc1CNCC1=CCCOC1	124682722	FBJHURLPWUOHCX-UHFFFAOYSA-N	219.284	1.829	10	20	BDCD	
CC[C@@H](NCc1cc(C)ccc1O)C(=O)O	84853878	HXZJEEUEBQTPGW-SNVBAGLBSA-N	223.272	1.653	10	20	BDCD	
O=C(NC/C=C/C1CC1)c1cccc(O)c1O	383249517	QWWIKRYASWRNLX-NSCUHMNNSA-N	233.267	1.794	10	20	BDCD	
O=S(=O)(Nc1ccc(O)c(F)c1F)C1CC1	830184326	ADESXRRVZWRHIK-UHFFFAOYSA-N	249.238	1.575	10	20	BDCD	
Cc1ccc(CNC[C@H]2C[C@@H](O)C2)c(O)c1	877656755	APYJSDMRSMILNK-KLPPZKSPSA-N	221.300	1.561	10	20	BDCD	
CN(C(=O)C1(N)CCCCC1)c1ccc(N)cc1	877079059	OPVSDCVBNYOKBO-UHFFFAOYSA-N	247.342	1.893	10	20	BDCD	
OCC[C@H]1CCCN1Cc1ccccc1O	779201248	CELWONZJMZWFHU-GFCCVEGCSA-N	221.300	1.739	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(N)cc2)C[C@@H]1O	399920646	PNCBVAKSVJQEBQ-YPMHNXCESA-N	220.316	1.472	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@H]2C[C@H]2F)cc1	1337079630	CVTGVIOVXORMAT-NWDGAFQWSA-N	236.290	1.727	10	20	BDCD	
CC[C@H](OC)C(=O)Nc1ccc(N)cc1	269118707	IWBXICHHCBHXQA-JTQLQIEISA-N	208.261	1.632	10	20	BDCD	
C[C@@H]1C[C@H](NCc2ccccc2O)CO1	401968298	IBLUXNBKZIKOMC-KOLCDFICSA-N	207.273	1.659	10	20	BDCD	
C[C@@]1(CO)CCCN(Cc2ccc(N)cc2)C1	688702226	XCBVIXLPCKDHOV-CQSZACIVSA-N	234.343	1.863	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C(F)(F)F)c1	862758733	IXKSUFVDTLCXQR-UHFFFAOYSA-N	233.189	1.879	10	20	BDCD	
CN[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1	150073520	RYBIBJHPPRHKAY-LLVKDONJSA-N	240.734	1.839	10	20	BDCD	
OCCN(Cc1cc(F)ccc1O)CC(F)F	193022070	AOGVHIURZXUMHA-UHFFFAOYSA-N	249.232	1.591	10	20	BDCD	
CN(C)c1ccc(CN2C[C@@H]3CNC[C@H]3C2)cc1	90320321	PSEWQDCDKADKLK-KBPBESRZSA-N	245.370	1.404	10	20	BDCD	
CC[C@@H](N[C@@H]1COC[C@H]1O)c1ccccc1O	295842222	DJZFXHSQTYEGAY-NQBHXWOUSA-N	237.299	1.193	10	20	BDCD	
Cn1cccc1CNC(=S)NC1CCC1	814199685	WKGZHVAJQOTGCP-UHFFFAOYSA-N	223.345	1.542	10	20	BDCD	
C[C@H](CN)NCc1cccc(Cl)c1O	841059580	GDVWGDWBEOWAGN-SSDOTTSWSA-N	214.696	1.482	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](CO)CCF)c1	846097064	MRMPUDYGFGJBLT-LLVKDONJSA-N	227.279	1.511	10	20	BDCD	
CC(=O)C1(C(=O)NCc2cc(C)ccc2O)CC1	862754982	MNNWTNCMOUCHNZ-UHFFFAOYSA-N	247.294	1.686	10	20	BDCD	
Oc1ccccc1CN1CCc2ncncc2C1	895722028	BSUXQMWAUQEHGZ-UHFFFAOYSA-N	241.294	1.741	10	20	BDCD	
CN(C(=O)[C@@H]1[C@H]2CCC(=O)[C@@H]21)c1ccc(N)cc1	1263168845	XZLFUYRACNEVON-CYZMBNFOSA-N	244.294	1.457	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)C[C@@H]1CO	700439451	SRCMMJHNKODLHX-WCQYABFASA-N	234.343	1.719	10	20	BDCD	
Cc1ccc(O)c(CNCC[C@H](O)C2CC2)c1	898203489	VVEQWTVZBSUZNT-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
CCN(CC)c1ccc(CNC(N)=O)cc1	77631288	BKDDRZLOKPYTRG-UHFFFAOYSA-N	221.304	1.701	10	20	BDCD	
C[C@H]1CN[C@H](C)CN1Cc1ccccc1O	83117996	QNEFQDUMHVTGAF-MNOVXSKESA-N	220.316	1.574	10	20	BDCD	
O=C(CC(F)(F)F)NCc1ccc(O)c(O)c1	269344279	GKOGZTVFAPMTER-UHFFFAOYSA-N	249.188	1.666	10	20	BDCD	
CN(Cc1ncc[nH]1)Cc1cc(F)ccc1O	813328450	RCHJUCRIAXFWCV-UHFFFAOYSA-N	235.262	1.886	10	20	BDCD	
CC[C@@H](N)CNCc1cc(F)ccc1O	841072589	QOVDBSMWMFGKLU-SNVBAGLBSA-N	212.268	1.358	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1C[C@@H]1F	1519816680	GNYPEYBYCDOQRW-BDAKNGLRSA-N	239.246	1.115	10	20	BDCD	
CCCN(CCCO)Cc1ccccc1O	264103645	IXAOXGGDGNCROY-UHFFFAOYSA-N	223.316	1.987	10	20	BDCD	
N[C@@H]1CCC[C@@H](NCc2ccccc2O)C1	162936658	YDQXZJVSTSZHGZ-VXGBXAGGSA-N	220.316	1.752	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1C[C@H](O)C1(C)C	877430384	HHFMRSIEBWHOAI-OLZOCXBDSA-N	235.327	1.950	10	20	BDCD	
CCc1cccc(CN(C)[C@@H]2CCNC2=O)c1O	848890002	ONULVZXVBWYJPD-GFCCVEGCSA-N	248.326	1.275	10	20	BDCD	
CC(=O)C(=O)Cn1cnc(Cl)c1Cl	306331550	QWTAWJASFPVTLK-UHFFFAOYSA-N	221.043	1.348	10	20	BDCD	
CC(=O)N[C@H]1CCN(Cc2ccccc2O)C1	228356279	QPOISAZZDOHLSD-LBPRGKRZSA-N	234.299	1.103	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H]2CCCNC2)cc1	132023958	UEIYFHYEABVRON-CQSZACIVSA-N	247.386	1.842	10	20	BDCD	
C[C@H](NCCN(C)C)c1ccc(F)c(F)c1O	287188813	VQBCDIRQMMUXJV-QMMMGPOBSA-N	244.285	1.883	10	20	BDCD	
COCC(=O)N[C@H](C)c1cc(OC)ccc1O	728979715	KZHYMQXMBJFDSR-MRVPVSSYSA-N	239.271	1.224	10	20	BDCD	
CC1(O)CCN(C(=O)c2cc(O)cs2)CC1	760141333	RIRMTIHZWGUETC-UHFFFAOYSA-N	241.312	1.441	10	20	BDCD	
CNC[C@H](C)CNCc1cccc(F)c1O	1117953980	VWUHJIDXGLIRLE-VIFPVBQESA-N	226.295	1.476	10	20	BDCD	
CC(=O)OC[C@H](C)NCc1ccc2c(c1)CCO2	892793018	KIOAHMCMPNJZNB-JTQLQIEISA-N	249.310	1.663	10	20	BDCD	
CC(=O)OCSc1ncc(C(=O)O)s1	1589229535	CUDSSQMKMKJBNJ-UHFFFAOYSA-N	233.270	1.454	10	20	BDCD	
Cc1ccc([C@@H](C)NCCCO)c(O)c1	20188563	SLDLGLJMPFMBTC-SNVBAGLBSA-N	209.289	1.734	10	20	BDCD	
COc1ccc(O)c(CNc2ncc(F)cn2)c1	301749707	AIYVVKWAMCZIFW-UHFFFAOYSA-N	249.245	1.942	10	20	BDCD	
COc1cccc(CN2CCCNCC2)c1O	38086963	KQBHGZHAWVTRHV-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1CCOC1	226584606	YMIMDYNEPBIDNY-SECBINFHSA-N	225.263	1.657	10	20	BDCD	
CC(C)OCC(=O)NCc1ccccc1O	136333874	SGLHLYSGORVKSH-UHFFFAOYSA-N	223.272	1.433	10	20	BDCD	
Oc1c(Cl)cccc1CN1CC[C@H](O)C1	132493341	NRNVTRCCILYACX-VIFPVBQESA-N	227.691	1.612	10	20	BDCD	
CC(C)[C@H](N)C(=O)NCc1ccc(N(C)C)cc1	40825816	WZZBIVWNRLYLBZ-ZDUSSCGKSA-N	249.358	1.352	10	20	BDCD	
COc1cccc(CN[C@H](C)CCO)c1O	96811447	BXCMUMWKWMLRFI-SECBINFHSA-N	225.288	1.261	10	20	BDCD	
CC[C@@H]1NCC[C@@H]1C(=O)Nc1ccc(N)cc1	294779691	NORSRMMZWXAUBG-RYUDHWBXSA-N	233.315	1.595	10	20	BDCD	
CN(CCO)Cc1ccc2ccccc2c1O	816480629	SFTUUIXYXITBES-UHFFFAOYSA-N	231.295	1.970	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@H](C)CCO)c1	846111440	OZYXHNRNKZCPFQ-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
CCO/C=C\C(=O)NCc1ccc(N(C)C)cc1	841017157	ATRPXHNUPCPZRQ-KTKRTIGZSA-N	248.326	1.919	10	20	BDCD	
Cc1ccc(CN2CC[C@@H]([C@H](C)O)C2)c(O)c1	877183261	BECMAKMANVUXGM-NWDGAFQWSA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(CN[C@H]2C(=O)NCC[C@@H]2C)c(O)c1	877499635	RNAYJPSLONIVJV-GXFFZTMASA-N	248.326	1.315	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC(F)(F)C1	782851136	IRAZGOOLYLTQAF-UHFFFAOYSA-N	219.212	1.545	10	20	BDCD	
C[C@H](NC[C@H]1C[C@H](O)C1)c1ccc(F)cc1O	720951344	LHYPEMZTFMPBCY-QXEWZRGKSA-N	239.290	1.953	10	20	BDCD	
Nc1ccc(CN[C@H]2CC(=O)N(C3CC3)C2)cc1	1337838790	UKGHGXWNTFCMTD-LBPRGKRZSA-N	245.326	1.122	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@@H]2CCC[C@H]2N)cc1	1343567342	PNDFMDPYWZKUMW-WCQYABFASA-N	247.342	1.403	10	20	BDCD	
O=C(O)[C@@H](CF)NCc1cc(F)cc(F)c1O	1601650294	OVYOEGFIFVJGLK-MRVPVSSYSA-N	249.188	1.183	10	20	BDCD	
CNC[C@H](C)NCc1ccc(Cl)cc1O	1578638747	TWKMMJODPVMYKD-QMMMGPOBSA-N	228.723	1.743	10	20	BDCD	
CN(CC(=O)O)Cc1cc(Cl)c(F)cc1O	1593721385	NQPUWLBLLNFTCT-UHFFFAOYSA-N	247.653	1.701	10	20	BDCD	
NC(=O)c1ccc(NCc2ccccc2O)nc1	163774508	NNNVBOGULIXEBW-UHFFFAOYSA-N	243.266	1.498	10	20	BDCD	in-vitro
O[C@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)C1	922165709	KPUXPYWQPQTOMB-BETUJISGSA-N	233.311	1.625	10	20	BDCD	
C[C@@H](NCCn1cncn1)c1ccccc1O	271673421	NUOLGEMXXZEFJD-SNVBAGLBSA-N	232.287	1.335	10	20	BDCD	
OC[C@H](NCc1ccc2c(c1)CCO2)C1CC1	734161534	UFVURZPJAOODSH-ZDUSSCGKSA-N	233.311	1.482	10	20	BDCD	
CCOC(=O)[C@H](C)N(C)Cc1ccccc1O	109770186	ZHJHTPVUDZPAOE-JTQLQIEISA-N	237.299	1.776	10	20	BDCD	
CNC(=O)[C@@H](C)CN(C)Cc1ccccc1O	179585192	QQYHCLCNLLIRGF-JTQLQIEISA-N	236.315	1.206	10	20	BDCD	
C[C@H](N[C@H]1CCN(C)C1)c1ccc(F)cc1O	62748158	DAUYLUTXJRVQSQ-ONGXEEELSA-N	238.306	1.886	10	20	BDCD	
CCOC(=O)[C@H]1CCCN1Cc1ccccc1O	180768130	RBSZJYZKOFQFBP-GFCCVEGCSA-N	249.310	1.920	10	20	BDCD	
CCCN(Cc1ccccc1O)[C@H](C)C(N)=O	174372661	SDGUSFQNGNJLMU-SNVBAGLBSA-N	236.315	1.478	10	20	BDCD	
Cc1ccc(O)c(CN2CC(=O)NCC2(C)C)c1	282881203	YOCNIVMVXLBWRT-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
NC[C@@H]1CCCC[C@H]1NCCc1ccc(N)cc1	817958163	SQJQIEPUJHZVRD-DZGCQCFKSA-N	247.386	1.918	10	20	BDCD	
Oc1cc(F)c(Cl)cc1CN[C@H]1C[C@@H](O)C1	825256963	OTDPEJSTMNIOSP-OCAPTIKFSA-N	245.681	1.798	10	20	BDCD	
CSCCNC(=O)c1c(F)ccc(O)c1O	825683796	UOMJRNBKFTVFGJ-UHFFFAOYSA-N	245.275	1.330	10	20	BDCD	
COc1cccc(CNCCC(C)(C)N)c1O	903938786	KJJKDRNKUJGVLB-UHFFFAOYSA-N	238.331	1.618	10	20	BDCD	
CC[C@H](C(=O)NCCc1ccc(N)cc1)N(C)C	863585376	XCNSPBIBKQLJNK-CYBMUJFWSA-N	249.358	1.268	10	20	BDCD	
CCO/C=C\C(=O)NCc1cc(C)ccc1O	862755451	HJBQEKRRMMJTFH-SREVYHEPSA-N	235.283	1.867	10	20	BDCD	
C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H]1O	897684644	UKYCONJMBNVKLS-UFBFGSQYSA-N	241.718	1.858	10	20	BDCD	
CO[C@@H](C)CNCc1cc(F)ccc1O	191204950	JZFJEBNIGVOGFO-QMMMGPOBSA-N	213.252	1.656	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H]2C[C@@H]2C(=O)O)cc1	715235515	CRHBZZSMXQWBED-AAEUAGOBSA-N	248.326	1.563	10	20	BDCD	
Nc1ccc(CN2C[C@H]3[C@@H](N)CCC[C@H]3C2)cc1	1337833996	JOIHHEALCWOPMG-CFVMTHIKSA-N	245.370	1.828	10	20	BDCD	
COC(=O)C[C@H]1CCCN1Cc1ccc(N)cc1	1337838224	KUVDGSGKNIKBCB-CYBMUJFWSA-N	248.326	1.796	10	20	BDCD	
COC(=O)[C@@H]1CCN(Cc2ccc(N)cc2)[C@H]1C	1335290428	WJWKAZAPSZOMAY-GXFFZTMASA-N	248.326	1.652	10	20	BDCD	
CCN(C(=O)NCc1ccc(N)cc1)C1CC1	1337018965	NJQVYDMEIOJWLX-UHFFFAOYSA-N	233.315	1.963	10	20	BDCD	
C[C@@H]1CCNC[C@@H]1NCc1ccc2c(c1)CCO2	841058004	DPJGAQOAFIYNQC-RISCZKNCSA-N	246.354	1.709	10	20	BDCD	
CC[C@](C)(CO)NCc1ccc(C)cc1O	877143377	MVNFGJVZFGUEOU-CYBMUJFWSA-N	223.316	1.951	10	20	BDCD	
Cc1ccc(CNCCN2CCCC2=O)c(O)c1	877613562	LWCKZQQXWQNAEB-UHFFFAOYSA-N	248.326	1.413	10	20	BDCD	
CC(=O)NCCN(C)Cc1cc(C)ccc1O	308310644	RBICXYIJYKLSAD-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CC[C@H](C)NC(=O)CN(C)c1ccc(N)cc1	20374454	IPGHJGBLWADPGU-JTQLQIEISA-N	235.331	1.620	10	20	BDCD	
CCOCCNCc1ccc(N(C)C)cc1	35151404	WWRIACCEZVVLBD-UHFFFAOYSA-N	222.332	1.879	10	20	BDCD	
CNCCCNCc1cc(F)ccc1O	83347005	KINNRNPXYQTTBU-UHFFFAOYSA-N	212.268	1.230	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2CCCN2)cc1	234265214	GHFAYZIWMKDTNV-CYBMUJFWSA-N	233.359	1.594	10	20	BDCD	
CCN(C)C(=O)CN[C@@H]1CCc2cccc(O)c21	296418646	LIHCTINGXZOHQK-LLVKDONJSA-N	248.326	1.447	10	20	BDCD	
CC(=O)C(=O)Cn1ccc(C(F)(F)F)cc1=O	289697941	QTOMBVMRHAYCTD-UHFFFAOYSA-N	247.172	1.025	10	20	BDCD	
Nc1ccc(CN2CCOCC23CC3)cc1	1337837751	DVEUTGKFIGNDCS-UHFFFAOYSA-N	218.300	1.634	10	20	BDCD	
CN(Cc1ccccc1O)[C@H]1CC(C)(C)OC1=O	814178828	DZFHZEWMFRWAEJ-NSHDSACASA-N	249.310	1.918	10	20	BDCD	
O=C(O)CCCNC(=O)c1cc(O)cs1	738576562	CPXVNZLQSHQQPA-UHFFFAOYSA-N	229.257	1.048	10	20	BDCD	
CC[C@H](N)CNCc1ccc(OC)c(C)c1	841070120	LPCHJGXOVQAGKX-LBPRGKRZSA-N	222.332	1.831	10	20	BDCD	
CC(C)(C)[C@@H](CN)NCc1cc(F)ccc1O	841087884	SYIANBPSWHCXFF-GFCCVEGCSA-N	240.322	1.994	10	20	BDCD	
C[C@H](O)C[C@@H](C)NC(=O)c1cc(O)cs1	753469073	YQBULPKECJMYHW-RQJHMYQMSA-N	229.301	1.343	10	20	BDCD	
CO[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1	769446262	LNESRFGQUBROBK-CQSZACIVSA-N	234.343	1.973	10	20	BDCD	
Cc1cccc(O)c1CN(CCO)CC(F)F	877491446	SSERWRUONFZTGA-UHFFFAOYSA-N	245.269	1.760	10	20	BDCD	
Cc1ccc(O)c(CN2Cc3cnn(C)c3C2)c1	877632928	RUBUXVDADNFNBK-UHFFFAOYSA-N	243.310	1.950	10	20	BDCD	
CO[C@@H]1CN(Cc2ccccc2O)CCO1	895968591	DPEFHLMSTUJIBK-LBPRGKRZSA-N	223.272	1.197	10	20	BDCD	
COc1cccc(CN2C[C@@H](O)C[C@@H]2C)c1O	788269453	NRVMJFHJCGSIIE-ONGXEEELSA-N	237.299	1.356	10	20	BDCD	
OC[C@H]1C[C@@H](NCc2c(O)cccc2Cl)C1	707595775	QGHMBCUTNLUQPE-DTORHVGOSA-N	241.718	1.906	10	20	BDCD	
C[C@H]1C[C@H]1C(=O)NCCc1ccc(O)c(O)c1	98074510	ZHOFPZGAJRBXRE-WCBMZHEXSA-N	235.283	1.413	10	20	BDCD	
C[C@]1(C(=O)NCc2ccc(N)cc2)CCCNC1	1341923230	JQPRBQQVSMJYDX-AWEZNQCLSA-N	247.342	1.275	10	20	BDCD	
CC(C)N(C)CCNCc1cc(F)ccc1O	226589148	SQEFQTNTSZBMKN-UHFFFAOYSA-N	240.322	1.961	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)Cc1ccn[nH]1	121314791	CNQLKCKCUMKQCW-UHFFFAOYSA-N	245.282	1.316	10	20	BDCD	
C[C@@H]1CCOCCN1C(=O)Nc1ccc(N)cc1	904500625	NEJHACAZYRIVLP-SNVBAGLBSA-N	249.314	1.912	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCc2cnnn2C)c1	287278495	JMKOKWGKZMXXNU-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
C[C@@H](N[C@@H]1CCc2cccc(O)c21)C(=O)N(C)C	310868097	PHRCNGIOLKTTJG-MWLCHTKSSA-N	248.326	1.446	10	20	BDCD	
NC1CCC(NCc2ccccc2O)CC1	51692974	ZYRBJZUOANLEPU-UHFFFAOYSA-N	220.316	1.752	10	20	BDCD	
COCCCNCc1cccc(OC)c1O	20142381	NMADKNFDXSKFFL-UHFFFAOYSA-N	225.288	1.527	10	20	BDCD	
O=C1OCC[C@H]1Sc1nccs1	64660836	GYCDOFCAJNPIKX-RXMQYKEDSA-N	201.272	1.551	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCC(C)(C)O)c1	87010659	YEPNRIIUGFSTMT-VIFPVBQESA-N	239.315	1.822	10	20	BDCD	
C[C@@H]1C[C@@H](N)CCN1Cc1cc(F)ccc1O	220334355	FZIMEWAYARIGJQ-SKDRFNHKSA-N	238.306	1.843	10	20	BDCD	
C[C@H](Sc1nccs1)C(=O)NC1CC1	48874440	UAQQDMCGWRKFOK-LURJTMIESA-N	228.342	1.902	10	20	BDCD	
O=C(NCCn1ccnc1)c1cc(O)cs1	732271271	UBQBCTASYXKFGB-UHFFFAOYSA-N	237.284	1.080	10	20	BDCD	
CN(C)c1ccc(CN[C@@H](CO)CCF)cc1	846096468	IAPMJJILSPJBKR-GFCCVEGCSA-N	240.322	1.563	10	20	BDCD	
CC[C@H](CCO)NC(=O)c1cc(O)cs1	760178295	RWRRTYJTDQOZMR-SSDOTTSWSA-N	229.301	1.345	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2[C@H]3CCC(=O)[C@H]32)cc1	1122540975	YBKFUETWJVSJHP-WCFLWFBJSA-N	244.294	1.110	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H](CO)[C@H](C(F)(F)F)C1	409426703	CUNXOWDRISEPJD-NKWVEPMBSA-N	238.213	1.399	10	20	BDCD	
COc1cccc(CN[C@@H]2C[C@H]3CC[C@@H]2O3)c1O	152942126	AIEUIAKITOEFJA-UTUOFQBUSA-N	249.310	1.810	10	20	BDCD	
CC(C)CS(=O)(=O)NCc1ccccc1O	159166251	IXWFNOLNKVJZMQ-UHFFFAOYSA-N	243.328	1.468	10	20	BDCD	
C[C@@H](CN)CNCc1ccc2c(c1)CCCO2	258774056	OIDADNNUZDDCTB-NSHDSACASA-N	234.343	1.696	10	20	BDCD	
C[C@@H]1C[C@H](NCc2ccc3c(c2)CCO3)CO1	402024790	GLZAACGWZVRGPM-MFKMUULPSA-N	233.311	1.889	10	20	BDCD	
COc1ccc(O)c(CN(C)C2CC2)c1	179690819	IGKHGOWHEJAJRH-UHFFFAOYSA-N	207.273	1.995	10	20	BDCD	
Nc1ccc(NC(=O)NC[C@@H]2CCCCO2)cc1	42825685	DZKCNIYYFKBHTN-LBPRGKRZSA-N	249.314	1.959	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)[C@@H](C)CO	293547809	YQPQHQQIZYXCLG-LBPRGKRZSA-N	236.359	1.955	10	20	BDCD	
COc1cccc(CN2CC3(CC3)C2)c1O	824533856	QRFYOKUEALEIMS-UHFFFAOYSA-N	219.284	1.997	10	20	BDCD	
Nc1nnc(-c2ccc(O)c(O)c2)s1	45805259	YLRSEAOZQCCMNH-UHFFFAOYSA-N	209.230	1.199	10	20	BDCD	
C[C@H](NC[C@@H](C)O)c1c(O)cccc1F	886487784	VDUUPKHKFHSWFY-SFYZADRCSA-N	213.252	1.563	10	20	BDCD	
CS[C@@H](C)C(=O)NCc1cccc(O)c1O	1123890516	YYWHCEWOHQBEMB-ZETCQYMHSA-N	241.312	1.466	10	20	BDCD	
Cc1cccc(CN2C[C@H](C)[C@H](O)C2)c1O	897681623	XSTYFWGMVUACMM-CMPLNLGQSA-N	221.300	1.513	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@@H]1CCCO1	77258410	GQNPMLCAGROUJV-LBPRGKRZSA-N	249.310	1.920	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2C=CCC2)cc1	698310481	WVERIBJBRUAODI-GFCCVEGCSA-N	216.284	1.646	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)CON	1339894653	NVEQTOMKQMODRA-UHFFFAOYSA-N	238.287	1.021	10	20	BDCD	
C=CC(=O)NCc1ccc(N(C)C)c(F)c1	1335283971	MHLJAROQFUCAKZ-UHFFFAOYSA-N	222.263	1.694	10	20	BDCD	
Cc1ccc(O)c(CNC2(CO)CCC2)c1	157502654	ABHXECGAMRXXFK-UHFFFAOYSA-N	221.300	1.705	10	20	BDCD	
CCN(CC(=O)O)Cc1cc(F)ccc1O	233424638	YOVWQVKUMIUKKE-UHFFFAOYSA-N	227.235	1.438	10	20	BDCD	
CN1CCC(NCc2ccc(N(C)C)cc2)CC1	20146009	SEMGWGGFSPVXDS-UHFFFAOYSA-N	247.386	1.936	10	20	BDCD	
CC(C)NC(=O)CN[C@@H](C)c1ccccc1O	36781640	JPFMCVPMJOABMV-JTQLQIEISA-N	236.315	1.567	10	20	BDCD	
O=C(O)c1ccnc(Sc2nccs2)n1	231958220	NGSJECGPFCHQTK-UHFFFAOYSA-N	239.281	1.783	10	20	BDCD	
C[C@@H]1CCN(Cc2ccccc2O)[C@H]1CO	249148794	ZVPANAHJGCLZTH-PWSUYJOCSA-N	221.300	1.595	10	20	BDCD	
CC1(C)CN[C@@H]1C(=O)Nc1ccc(N)cc1	818556489	VGCAZAAFDWBBAC-SNVBAGLBSA-N	219.288	1.205	10	20	BDCD	
CCN(CC(=O)NC)Cc1ccc(N(C)C)cc1	726983799	BNROFMYIDNBSQQ-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
C[C@H]1CCN(C(=O)c2cc(O)cs2)[C@H]1CO	832761436	ZIDIODOZCHJSTO-CBAPKCEASA-N	241.312	1.297	10	20	BDCD	
CCc1cc2c(=O)n(CC(=O)C(C)=O)ccc2o1	842604379	LRCWFEZYACEEBG-UHFFFAOYSA-N	247.250	1.315	10	20	BDCD	
C[C@@H](CCN(C)C)NCc1ccccc1O	49551970	FZVJFKUZOJVXRQ-NSHDSACASA-N	222.332	1.822	10	20	BDCD	
C[C@H](CCN(C)C)NCc1ccccc1O	49551971	FZVJFKUZOJVXRQ-LLVKDONJSA-N	222.332	1.822	10	20	BDCD	
COC(=O)[C@H]1CCN(Cc2ccc(N)cc2)[C@@H]1C	1335290429	WJWKAZAPSZOMAY-MFKMUULPSA-N	248.326	1.652	10	20	BDCD	
CCC(CC)(CO)NCc1ccc(N)cc1	1345159811	MXVOUGTYILMKCI-UHFFFAOYSA-N	222.332	1.910	10	20	BDCD	
O=C(NCC1(C(=O)O)CC1)c1cc(O)cs1	1608426744	MDUIMOFPNAGEHO-UHFFFAOYSA-N	241.268	1.048	10	20	BDCD	
Cc1ccc(CN[C@H](C)C2(CO)CC2)c(O)c1	877624192	AGASRLYNDGJSJM-LLVKDONJSA-N	235.327	1.951	10	20	BDCD	
CCOCCNC(=O)c1ccc(C)c(O)c1O	177673148	RQJVVWAZYUJHMF-UHFFFAOYSA-N	239.271	1.173	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCC[C@@H]2CO)c1	230681996	CIDYJAXKFAANQV-DGCLKSJQSA-N	235.327	1.951	10	20	BDCD	
CCOC(=O)c1cnc(S[C@H](C)CO)s1	379794778	KDCOVDRRMPTBMX-ZCFIWIBFSA-N	247.341	1.793	10	20	BDCD	
C[C@H](NC(=O)C(=O)O)c1ccc(N(C)C)cc1	810542221	KTLMBXXYRGYZFO-QMMMGPOBSA-N	236.271	1.014	10	20	BDCD	
CC[C@@H](N[C@H]1CCNC1)c1ccccc1O	817944912	OYTKDFREGPLTGM-CMPLNLGQSA-N	220.316	1.795	10	20	BDCD	
CC[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccccc1O	817977180	DHIHXVWLBQTNSS-KZVDOYCCSA-N	232.327	1.651	10	20	BDCD	
C[C@@H](NCCN)c1cc2c(cc1O)CCCC2	817934063	BEQBZTLEMOIZER-SNVBAGLBSA-N	234.343	1.880	10	20	BDCD	
CC[C@@H](NC1CNC1)c1ccc(N(C)C)cc1	817955008	OFRQFHMXEYEABT-CQSZACIVSA-N	233.359	1.765	10	20	BDCD	
C[C@H](CN)CN[C@H]1CCc2cccc(O)c21	817963906	YBKNCGLKGQRWFR-KOLCDFICSA-N	220.316	1.564	10	20	BDCD	
O=C(O)[C@H](F)CNCc1cc(F)cc(F)c1O	1262163515	WKPZFNVFARWOTN-MRVPVSSYSA-N	249.188	1.183	10	20	BDCD	
COC(=O)C[C@H](N)c1ccc(N(C)C)cc1	19784022	ZDZPKDIOYSXSFS-NSHDSACASA-N	222.288	1.316	10	20	BDCD	
Cc1cccc(CNCc2cnnn2C)c1O	289244901	ANMMQYVQRWVYPV-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
CCCCS(=O)(=O)NCc1ccccc1O	125402955	KRUFJOGETDWREX-UHFFFAOYSA-N	243.328	1.612	10	20	BDCD	
CCN(CC(=O)O)c1ccc(OC)c(OC)c1	76621174	GLMZKXLSFYUWQM-UHFFFAOYSA-N	239.271	1.615	10	20	BDCD	
CC[C@@H](N)C(=O)N(C)Cc1ccccc1O	37823777	MVFBZCMJGDJGAD-SNVBAGLBSA-N	222.288	1.088	10	20	BDCD	
CCN1CC(=O)N[C@@H]1c1ccc2c(c1)CCN2C	189865162	GYCAGFXEMSUDIQ-AWEZNQCLSA-N	245.326	1.129	10	20	BDCD	
Oc1ccc(F)cc1CNCCN1CCCC1	226619007	KASQBCITNCAPSE-UHFFFAOYSA-N	238.306	1.717	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@@H](O)C2)cc1	294888183	QRVUPIRCLXEOJF-BJHJDKERSA-N	220.316	1.366	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cc(C)ccc1O	808485294	NEHNPFFCAANXQH-UHFFFAOYSA-N	236.223	1.016	10	20	BDCD	
C[C@H](OCC1CC1)C(=O)NCc1ccc(N)cc1	837303346	IEXSJHMIXWVJGX-JTQLQIEISA-N	248.326	1.700	10	20	BDCD	
CC[C@H](N)CNCc1ccc(N(C)C)c(F)c1	841071350	DQAJPUUGUIWSIY-NSHDSACASA-N	239.338	1.719	10	20	BDCD	
CNCCNCc1ccc(N(C)C)c(F)c1	841037279	WFSIBOYBWVBFFA-UHFFFAOYSA-N	225.311	1.201	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2(O)CCC2)c1	862757450	UTVMNSUOOREYDV-UHFFFAOYSA-N	235.283	1.232	10	20	BDCD	
CC[C@H](CO)C(=O)NCc1ccccc1O	779815392	OOYMUKUGQNVEET-SECBINFHSA-N	223.272	1.027	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@H]1F	1123669321	OVENCJRKZPNVLD-HTQZYQBOSA-N	225.219	1.072	10	20	BDCD	
CCOc1ccc(O)c(CNCCF)c1	389933901	MDUNMFKBFMRDJF-UHFFFAOYSA-N	213.252	1.850	10	20	BDCD	
COC1CC(C(=O)N(C)c2ccc(N)cc2)C1	703424432	JTGXADIBGKSRBK-UHFFFAOYSA-N	234.299	1.657	10	20	BDCD	
O=S(=O)(Nc1ccc(O)cc1F)C1CC1	82879443	DFEODZNHXMIGFB-UHFFFAOYSA-N	231.248	1.435	10	20	BDCD	
C[C@@H](CC(=O)O)NCc1ccc2c(c1)CCO2	738892961	XRYVEQUCTXCGEV-VIFPVBQESA-N	235.283	1.574	10	20	BDCD	
CN(C)c1ccc(CNCCOCCF)cc1	705796085	ZGQDZOPPZOGHDR-UHFFFAOYSA-N	240.322	1.828	10	20	BDCD	
Oc1cc2c(cc1CN1CC[C@H](F)C1)OCO2	689857751	GAUOXBXHELNZRN-VIFPVBQESA-N	239.246	1.665	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cocn1	104853238	OMBQZTLWWPSWOK-UHFFFAOYSA-N	232.239	1.652	10	20	BDCD	
CC1=NO[C@@H](C(=O)NCc2ccc(N)cc2)C1	1524018478	LUTTUJUGHXIOLE-LLVKDONJSA-N	233.271	1.050	10	20	BDCD	
CC[C@H](OC(=O)c1cc(O)cs1)C(=O)O	1589579509	TXNJNDZMDXTPPB-LURJTMIESA-N	230.241	1.474	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@@H](C)CN	843052293	SHOOHMOFDFWMAL-VIFPVBQESA-N	224.304	1.180	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CCCO2)c1	70954899	QOWGNBSCLSWABO-GFCCVEGCSA-N	221.300	1.969	10	20	BDCD	
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC1CC1	274942549	PUXLNCCIDUTKBK-VIFPVBQESA-N	249.310	1.945	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCC[C@H](N)C2)cc1	294779907	NSHMIMSSHGMWOI-ONGXEEELSA-N	233.315	1.725	10	20	BDCD	
CN(CC(F)F)C(=O)c1c(F)ccc(O)c1O	825731830	KYDFTULSYNAKDW-UHFFFAOYSA-N	249.188	1.574	10	20	BDCD	
CN(C[C@H]1CCCN1)c1ccc(N)cc1	903474008	DXHMARNQABJNOG-LLVKDONJSA-N	205.305	1.457	10	20	BDCD	
CCO/C=C\C(=O)NCc1ccc(O)c(O)c1	847591822	ZWDHBXNEBUFFMS-WAYWQWQTSA-N	237.255	1.264	10	20	BDCD	
CCc1cccc(CN2CC(OC)C2)c1O	848915549	XJZWFXMNFQEAIA-UHFFFAOYSA-N	221.300	1.785	10	20	BDCD	
Cn1cccc1CNC(=S)NCC1CC1	849258913	PUMNMASNILJIIL-UHFFFAOYSA-N	223.345	1.399	10	20	BDCD	
COc1cccc(CN2C[C@H](O)C[C@@H]2C)c1O	788269447	NRVMJFHJCGSIIE-GXSJLCMTSA-N	237.299	1.356	10	20	BDCD	
COC[C@@H](C)N(C)Cc1ccccc1O	72629626	IBVFMJLFYQFRMG-SNVBAGLBSA-N	209.289	1.859	10	20	BDCD	
O=C(O)C1CN(Cc2cc(F)cc(F)c2O)C1	708075168	JZFRUZLLWSSYPN-UHFFFAOYSA-N	243.209	1.187	10	20	BDCD	
C[C@H](NCc1cc(F)cc(F)c1O)C(=O)O	708393324	CVNBZXFILLYSAQ-YFKPBYRVSA-N	231.198	1.233	10	20	BDCD	
O=C1C[C@@H](CSc2nccs2)CN1	1327165646	UHZWMUYOJPKNQS-ZCFIWIBFSA-N	214.315	1.371	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCC[C@@H](N)C2)cc1	1263303816	JQCWRVFKYZSPDT-WCQYABFASA-N	247.342	1.403	10	20	BDCD	
C[C@@H](C(=O)NCc1ccc(N)cc1)C1CC1	163261708	MQHRSCAFERFVIK-SECBINFHSA-N	218.300	1.931	10	20	BDCD	
C[C@H](N)[C@H](C)C(=O)NCc1ccc(N(C)C)cc1	156759590	XSTOFIDUSPSWHN-QWRGUYRKSA-N	249.358	1.352	10	20	BDCD	
CC(=O)CSCC(=O)c1ccc(O)c(O)c1	176769121	ZTSKJKJZLUXRSI-UHFFFAOYSA-N	240.280	1.603	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CNCC1CC1	37823794	IFMWPBWCXGZICU-UHFFFAOYSA-N	248.326	1.350	10	20	BDCD	
Cc1n[nH]cc1CNCc1ccc2c(c1)CCO2	38011590	UOPDBYRVKKASCP-UHFFFAOYSA-N	243.310	1.943	10	20	BDCD	
COC(=O)[C@H]1C[C@H](NCc2ccccc2O)C1	827812643	STIFPVKVQDDTKL-XYPYZODXSA-N	235.283	1.433	10	20	BDCD	
CNC(=N)NCCCSc1nccs1	849008907	XGWQYUVWZYCZIY-UHFFFAOYSA-N	230.362	1.369	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CCCCN2)c1	841033041	NDPFSQFFWMIRSC-CYBMUJFWSA-N	234.343	1.932	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)N[C@H](C)c2ccccc2O)CO1	827946513	KONAMBMXTCCMEZ-MXWKQRLJSA-N	249.310	1.994	10	20	BDCD	
Cc1ccc(CN2C[C@@H](O)C[C@H]2C)c(O)c1	877468071	YCMCPUSIMCDOAG-PWSUYJOCSA-N	221.300	1.656	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@H]2CCN(C)[C@H]2C1	877568197	ZTUZVOAUILEVCQ-OCCSQVGLSA-N	246.354	1.837	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H]1C[C@@H](CO)C1	877668176	XMYQZWSLTQVZDX-XBXGTLAGSA-N	248.370	1.922	10	20	BDCD	
COc1cccc(O)c1CN[C@@H]1CCN(C)C1	729682099	MSUAVARAYIZSTL-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
O=C(Nc1c[nH]ccc1=O)c1cccc(O)c1O	790540740	XEISJPDTAQTEKT-UHFFFAOYSA-N	246.222	1.038	10	20	BDCD	
Cc1ccc([C@H](C)N[C@@H]2COC[C@@H]2O)c(O)c1	323592505	XNSYNCIFKLTXEW-NDMJEZRESA-N	237.299	1.111	10	20	BDCD	
CCC[C@@H](O)CNCc1cc(F)cc(F)c1O	708483695	FURQSTVMRKVDTE-SNVBAGLBSA-N	245.269	1.921	10	20	BDCD	
Oc1ccc(F)cc1CN1C[C@@H]2CC[C@H](C1)N2	873217472	MLVTYYRBRYPJLP-TXEJJXNPSA-N	236.290	1.468	10	20	BDCD	
COc1cccc(CNc2cnn(C)c2)c1O	20352854	BTAJENGWVWUOLY-UHFFFAOYSA-N	233.271	1.746	10	20	BDCD	
COC(=O)[C@H]1CCCCN1Cc1ccccc1O	179558525	BRBMZGSBAFYQNF-GFCCVEGCSA-N	249.310	1.920	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](O)C2)c1O	132488192	DHQPWWPBARCWJI-LLVKDONJSA-N	207.273	1.267	10	20	BDCD	
COc1cccc(CN2CCN[C@@H](C)C2)c1O	88058707	JLXBUIILBKZTGQ-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCC(=O)C1	843820014	INWSGDNRHUKFHR-SNVBAGLBSA-N	247.294	1.720	10	20	BDCD	
NC[C@H]1CCCC[C@H]1NCc1ccc(N)cc1	1352788136	DBEWNIAXPIFPQA-TZMCWYRMSA-N	233.359	1.876	10	20	BDCD	
CNC[C@@H](C)C(=O)N[C@H](C)c1ccccc1O	870988581	UBEJNCBHEGKNCP-NXEZZACHSA-N	236.315	1.425	10	20	BDCD	
CNC(=O)[C@H](C)CN(C)Cc1ccccc1O	179585201	QQYHCLCNLLIRGF-SNVBAGLBSA-N	236.315	1.206	10	20	BDCD	
COC(=O)C(C)(C)NCc1ccc2c(c1)CCO2	37363409	MAYBYBKSSDUQRJ-UHFFFAOYSA-N	249.310	1.663	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCCNC2)cc1	43324903	BXCPTGRAJZHBGQ-CYBMUJFWSA-N	233.359	1.594	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)[C@H]1CCCN1	817958521	WPLYWENEEABAMI-BXUZGUMPSA-N	233.359	1.541	10	20	BDCD	
C[C@@H](NC(=O)c1cnnn1C)c1ccccc1O	827947029	YOWKDBFAZOGEHQ-MRVPVSSYSA-N	246.270	1.012	10	20	BDCD	
NC1CC(NCc2cc(F)ccc2O)C1	906510759	VPNCVFZGNCHZHI-UHFFFAOYSA-N	210.252	1.111	10	20	BDCD	
COc1ccc(CN[C@H]2C[C@H](N)C2)cc1C	906508594	RDTKJSGDRZSYRC-HAQNSBGRSA-N	220.316	1.583	10	20	BDCD	
Cc1ccc(C(=O)O[C@H](C)C(=O)O)c(O)c1O	738259000	XGZJWUVLJQJMAE-ZCFIWIBFSA-N	240.211	1.036	10	20	BDCD	
CC(C)(F)C(=O)NCc1ccc(O)cc1O	910949619	MEVSZKFPLJSFJX-UHFFFAOYSA-N	227.235	1.462	10	20	BDCD	
CC(C)[C@@H](O)Cc1cn(-c2ccc(N)cc2)nn1	849134965	YTFYCVTTWDYMQK-ZDUSSCGKSA-N	246.314	1.409	10	20	BDCD	
CN(CCN)Cc1ccc(N(C)C)c(F)c1	841099923	ATLAEDXUXWFLGQ-UHFFFAOYSA-N	225.311	1.282	10	20	BDCD	
O=C(OCC(=O)C1CCC1)c1cc(O)cs1	754097123	ZDJFXXFFLHUAQI-UHFFFAOYSA-N	240.280	1.980	10	20	BDCD	
COC(=O)[C@@H]1CCC[C@H]1NCc1ccccc1O	1116771992	XUMFJJQFVQDQKZ-VXGBXAGGSA-N	249.310	1.824	10	20	BDCD	
COC[C@@H](O)CN[C@H](C)c1ccc(F)cc1O	71269114	YHVRXFCUVHGRRE-SCZZXKLOSA-N	243.278	1.189	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)C[C@H]1O	897681307	QTPLAMHWUUHTPT-QPUJVOFHSA-N	225.263	1.344	10	20	BDCD	
CCN(C[C@H](C)O)c1ccc(OC)cc1	799129835	XECITRNCWLUTDC-JTQLQIEISA-N	209.289	1.902	10	20	BDCD	
CSCCCNC(=O)c1cccc(O)c1O	163275018	CKYNNVLXQNTWNR-UHFFFAOYSA-N	241.312	1.581	10	20	BDCD	
Cc1cccc(CN[C@@H](C)c2ncn(C)n2)c1O	276264029	QGRCRIVOVXAMJQ-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
Cc1ccc(C(=O)NC(C)C)c(O)c1O	177658082	CCBQQTHZJYSUJF-UHFFFAOYSA-N	209.245	1.544	10	20	BDCD	
CN[C@@H](CC(C)C)C(=O)NCc1ccc(N)cc1	1342698246	BXLRLUPJBLFBJI-ZDUSSCGKSA-N	249.358	1.519	10	20	BDCD	
Cc1ccc(O)c(CNCCC[S@](C)=O)c1	116919771	ZVEDHOMMCGHSBV-MRXNPFEDSA-N	241.356	1.559	10	20	BDCD	
COc1ccc(N2CC[C@@H](CNC(C)=O)C2)cc1	62574801	CJJWAEGYKMMAAU-LBPRGKRZSA-N	248.326	1.658	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C[C@H]2C[C@@H]2C1	380361220	ARFHIPHEXOEVEX-HTQZYQBOSA-N	219.240	1.190	10	20	BDCD	
C/C=C(/C)C(=O)NCCc1ccc(N)cc1	236709170	PDWYYUDGWICHFZ-KMKOMSMNSA-N	218.300	1.894	10	20	BDCD	
C[C@@H]1C[C@@H](C)[C@@H](C(=O)NCc2ccccc2O)O1	282244502	BTLSNFBXIRCNCJ-BREBYQMCSA-N	249.310	1.822	10	20	BDCD	
O=C1CCC(=O)N1CCSc1nccs1	299074176	YJUMRCYDQHNCIX-UHFFFAOYSA-N	242.325	1.384	10	20	BDCD	
COc1cccc(CNC/C=C/CO)c1O	717550747	ZGAVKKRUNQMFAV-NSCUHMNNSA-N	223.272	1.039	10	20	BDCD	
C[C@H](NC[C@@H](C)N)c1cc([N+](=O)[O-])ccc1O	817972905	PJHRPWAXMIJZCF-SFYZADRCSA-N	239.275	1.298	10	20	BDCD	
Cc1cc(O)c(CNCCO)cc1Cl	825417365	LNILYMUUUXQCGR-UHFFFAOYSA-N	215.680	1.436	10	20	BDCD	
C[C@H](CCN(C)C)NC(=O)c1cc(O)cs1	748362323	FCEQSGCLMOHSHS-MRVPVSSYSA-N	242.344	1.524	10	20	BDCD	
Oc1c(F)cc(F)cc1CN1CC[C@H](O)C1	893945881	JADQWHKSHULKCA-VIFPVBQESA-N	229.226	1.237	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CC1(N)CCC1	94294733	XWSUECVCFSLWCD-UHFFFAOYSA-N	248.326	1.622	10	20	BDCD	
Cc1nc(CN(C)c2ccc(N)cc2)no1	702071607	OYJXCLCSOQWRAA-UHFFFAOYSA-N	218.260	1.597	10	20	BDCD	
CO[C@H]1CN(Cc2ccc(N)cc2)C[C@H]1OC	234876405	PMYRYORMMQBOPH-BETUJISGSA-N	236.315	1.114	10	20	BDCD	
CC1(C)CNCCN1C(=O)Cc1ccc(N)cc1	841848805	DXFKDUOCXYIDDQ-UHFFFAOYSA-N	247.342	1.022	10	20	BDCD	
Nc1ccc(CNC(=O)CC[C@H]2CCOC2)cc1	401378055	NPFCENXMZZTGHW-LBPRGKRZSA-N	248.326	1.702	10	20	BDCD	
CC(C)N(CC(=O)O)Cc1ccc(N)cc1	1603875096	XGPABGOTQIHTFT-UHFFFAOYSA-N	222.288	1.564	10	20	BDCD	
C[C@@H](CCCO)NCc1cc(F)ccc1O	226616736	VZOKSGXQJOPGNQ-VIFPVBQESA-N	227.279	1.782	10	20	BDCD	
CN[C@@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1	133054207	MQQPAXQVOOYFFT-CYBMUJFWSA-N	247.342	1.022	10	20	BDCD	
C[C@@H](C[C@@H](C)O)NCc1cc(F)ccc1O	228836373	YJNRWBIHWFAMPE-DTWKUNHWSA-N	227.279	1.780	10	20	BDCD	
CS/C=C/C(=O)NCCc1ccc(N)cc1	818545215	PIZXWKTVXONMEO-VQHVLOKHSA-N	236.340	1.804	10	20	BDCD	
C[C@@](CCF)(NCc1ccccc1O)C(=O)O	901914810	FBDREWLWYNCIHE-LBPRGKRZSA-N	241.262	1.685	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@H](O)C1	732258432	ABNAMFJDXBYMNF-ZETCQYMHSA-N	227.285	1.051	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCO[C@H](CF)C1	839803979	LLIFCYNBVJIIHP-MRVPVSSYSA-N	245.275	1.264	10	20	BDCD	
C[C@]1(CNCc2ccccc2O)CCCNC1	841057450	NHLMTAHCHLUCEA-AWEZNQCLSA-N	234.343	1.872	10	20	BDCD	
CC1(NCc2cccc(Cl)c2O)COC1	877691127	JLHHVQXARZRXOV-UHFFFAOYSA-N	227.691	1.924	10	20	BDCD	
CC[C@@](C)(O)CNCc1c(O)cccc1OC	732229330	RGGGFYMBIOHCPL-CYBMUJFWSA-N	239.315	1.651	10	20	BDCD	
C[C@](O)(C(=O)NCc1ccc(N)cc1)C1CCC1	1343579308	ZQMUOTIQUKOXIM-CQSZACIVSA-N	248.326	1.436	10	20	BDCD	
CON(C)CCN[C@H](C)c1ccc(C)cc1O	850479391	RPSRCEUTAPKAGV-LLVKDONJSA-N	238.331	1.844	10	20	BDCD	
Cc1ccc(CN[C@@]2(C)CCOC2)c(O)c1	877121186	PXYIFXMJMUZTGI-ZDUSSCGKSA-N	221.300	1.969	10	20	BDCD	
CC(C)(CCO)NCc1cc(F)cc(F)c1O	708484338	GSOYJJBIFFRQEA-UHFFFAOYSA-N	245.269	1.921	10	20	BDCD	
CC[C@@H](O)CCNCc1cccc(OC)c1O	127403823	HLNNAVCGFGNSNB-LLVKDONJSA-N	239.315	1.651	10	20	BDCD	
CC[C@H](O)CNCc1ccc(N(C)C)cc1	229966365	GZZXFXRHFIXTBU-ZDUSSCGKSA-N	222.332	1.613	10	20	BDCD	
Oc1ccccc1CNCC1(O)CCCC1	82687294	FWEFARZWUHVWMA-UHFFFAOYSA-N	221.300	1.787	10	20	BDCD	
C[C@H](CCO)NCc1c(O)cccc1Cl	96811525	XVGYUIATYKSJEB-MRVPVSSYSA-N	229.707	1.906	10	20	BDCD	
COc1cccc(CN2CC[C@H](CO)C2)c1O	92764288	XYEWNBROQCPQAN-JTQLQIEISA-N	237.299	1.215	10	20	BDCD	
CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1	264648513	PXINONGLQOEKTG-QPJJXVBHSA-N	246.310	1.282	10	20	BDCD	
COC(=O)c1ccc(O)c([C@H](C)NC2CC2)c1	273365835	DZNZFLMTTDQPBA-QMMMGPOBSA-N	235.283	1.992	10	20	BDCD	
C[C@@H](NCCN)c1cc(Cl)ccc1O	817935008	SMBMBPMGMSXRFO-SSDOTTSWSA-N	214.696	1.655	10	20	BDCD	
CN1CCC(NC(=O)c2cc(O)cs2)CC1	731864902	DJAROXZUMRLSRK-UHFFFAOYSA-N	240.328	1.278	10	20	BDCD	
CC[C@@H](CO)NCc1ccc(N(C)C)cc1C	840928581	ZMVSDWVWILLNMX-ZDUSSCGKSA-N	236.359	1.922	10	20	BDCD	
Cc1cccc(CN2C[C@H](CN)C[C@@H]2C)c1O	843057262	HQPKZQKXOPMRLL-RYUDHWBXSA-N	234.343	1.870	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCSC1	1120700012	KBSZJDPIWLPKQF-UHFFFAOYSA-N	229.326	1.990	10	20	BDCD	
CO[C@H]1CN(Cc2ccc(C)cc2O)CCO1	895961830	FNGBSBHYXDYFGZ-CYBMUJFWSA-N	237.299	1.505	10	20	BDCD	
CO[C@@H](C)CC(=O)N(C)Cc1ccccc1O	195495726	JVPNDNMTNOIDCM-JTQLQIEISA-N	237.299	1.776	10	20	BDCD	
CNCc1ccc(OC)c(CN(C)C)c1	16942024	BQNLKUFSWLZTOJ-UHFFFAOYSA-N	208.305	1.476	10	20	BDCD	
Nc1ccc(CCNC(=O)CC2CC2)cc1	49728845	QNFGIDLLQXJLCR-UHFFFAOYSA-N	218.300	1.728	10	20	BDCD	
CC(C)[C@@H](O)CNCc1cc(F)ccc1O	226608792	DYADZUVHGNEEOU-LBPRGKRZSA-N	227.279	1.638	10	20	BDCD	
COc1ccc(O)c(CNCCCCCO)c1	83367183	YUQHIAAAHHQSOB-UHFFFAOYSA-N	239.315	1.653	10	20	BDCD	
C[C@@]1(NC(=O)Nc2ccc(N)cc2)CCCOC1	235418838	OFCBOGXPSWZKSM-CYBMUJFWSA-N	249.314	1.959	10	20	BDCD	
CC(C)(O)C1CN(Cc2ccccc2O)C1	297464653	RVCSSMGAXSISDY-UHFFFAOYSA-N	221.300	1.595	10	20	BDCD	
CN(CCCF)C(=O)Cc1ccc(N)cc1	716754884	YLJREFWOESBIOF-UHFFFAOYSA-N	224.279	1.629	10	20	BDCD	
CC[C@@H](O)CNCc1ccc(N(C)C)cc1C	819077706	NLRAVTNNFRVQPY-CQSZACIVSA-N	236.359	1.922	10	20	BDCD	
Nc1ccc(NC(=O)CC2(N)CCC2)cc1	832244756	UNONMBKINJNWMS-UHFFFAOYSA-N	219.288	1.479	10	20	BDCD	
Cc1ccc(C(=O)N[C@@H]2C=CCC2)c(O)c1O	855429853	QETKSEMDHYSPPD-SECBINFHSA-N	233.267	1.855	10	20	BDCD	
N[C@H](C(=O)O)c1cc(Br)ccc1O	72196616	OPOLGUBWDNLGTE-ZETCQYMHSA-N	246.060	1.239	10	20	BDCD	
COc1ccc(CNCCF)c(O)c1OC	894218055	FWYSKFQFRCZMRK-UHFFFAOYSA-N	229.251	1.469	10	20	BDCD	
Cc1cccc(CNCCOCCF)c1O	702655333	WHRXGYDOBJXJNY-UHFFFAOYSA-N	227.279	1.776	10	20	BDCD	
CCNC(=O)CN1CCCc2cc(OC)ccc21	797720975	SLMZUHLBEZVSKB-UHFFFAOYSA-N	248.326	1.584	10	20	BDCD	
Cc1ccc(O)c(CN2CC(C)(O)C2)c1	1140617104	FEBYWQPWEONQSM-UHFFFAOYSA-N	207.273	1.267	10	20	BDCD	
O=C(O)c1cnc(SCCC2(O)CC2)s1	1602536723	GBVJCHGTNXITSY-UHFFFAOYSA-N	245.325	1.848	10	20	BDCD	
O=C(O)CC1(NCc2cccc(F)c2O)CC1	1601936341	UQCCYYKSKLGRPM-UHFFFAOYSA-N	239.246	1.628	10	20	BDCD	
Cc1cccc(O)c1CN1CCO[C@H](C)C1	876556869	WTLOSSJULYWVPF-LLVKDONJSA-N	221.300	1.921	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@H]2CNC[C@@H]2C1	876818590	WKZRCUCCIKCTFL-VXGBXAGGSA-N	232.327	1.352	10	20	BDCD	
COc1cccc(CNC2(C)COC2)c1O	877690564	ARBDLGGMIGVAEL-UHFFFAOYSA-N	223.272	1.279	10	20	BDCD	
NC[C@H](NCc1ccccc1O)C1CC1	841028766	REWWOTUJCLFAAY-NSHDSACASA-N	206.289	1.219	10	20	BDCD	
CCN(CC)c1ccc(CNC(=O)NC)cc1	55328987	QTWYYFJUTJLHNT-UHFFFAOYSA-N	235.331	1.962	10	20	BDCD	
CN(C)CCCN(C)C(=O)Cc1ccc(N)cc1	111129784	SHKUOUMFEACQPV-UHFFFAOYSA-N	249.358	1.221	10	20	BDCD	
C[C@H]1CN(C(=O)Nc2ccc(N)cc2)C[C@@H](C)O1	35407533	COQJATZOCVKFHM-AOOOYVTPSA-N	249.314	1.910	10	20	BDCD	
C[C@@H](O)[C@H]1CCN(Cc2cc(F)ccc2O)C1	180861568	DWKXXHQEYMKAFM-ZJUUUORDSA-N	239.290	1.734	10	20	BDCD	
CC(C)NCc1ccc(N2CCN(C)CC2)cc1	34823187	WRCLASGAARZNES-UHFFFAOYSA-N	247.386	1.936	10	20	BDCD	
COC[C@@H](CNCc1ccccc1O)OC	227706654	OXOIFNUHIRDKTR-LLVKDONJSA-N	225.288	1.143	10	20	BDCD	
Cc1cccc(CNCC2(CO)CC2)c1O	162869736	IIJNXZVBQAICRX-UHFFFAOYSA-N	221.300	1.563	10	20	BDCD	
CNC(=O)CCCN[C@H]1CCc2cccc(O)c21	297589331	HOEPDKUFLZIJQC-NSHDSACASA-N	248.326	1.495	10	20	BDCD	
COCCCNC(=O)NCc1ccccc1O	299488855	IXYBBYRCDKSTBF-UHFFFAOYSA-N	238.287	1.228	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H](C)CN)c1	817966265	JXHWLARLVXZPLP-RKDXNWHRSA-N	224.304	1.399	10	20	BDCD	
CCOc1ccc(O)c(CN[C@H](C)CNC)c1	853250006	XUZNSQOFSPEUAP-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
CCn1ncnc1COc1ccc(N(C)C)cc1	853692255	AOQPFZAUTAJUDH-UHFFFAOYSA-N	246.314	1.943	10	20	BDCD	
CN1CCCC[C@H]1C(=O)NCc1ccc(N)cc1	1343567327	PESBKEKLWYXZQC-ZDUSSCGKSA-N	247.342	1.369	10	20	BDCD	
Cn1ccc(C(=O)NCc2ccccc2O)c1	764322638	RJYCNPUXQFPVCK-UHFFFAOYSA-N	230.267	1.661	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@H](O)C1)c1ccc(F)cc1O	720951342	LHYPEMZTFMPBCY-FXPVBKGRSA-N	239.290	1.953	10	20	BDCD	
Cc1ccc(C(=O)Nc2cc[nH]n2)c(O)c1O	1323595272	KAKUDBMJZBUPTN-UHFFFAOYSA-N	233.227	1.382	10	20	BDCD	
C[C@@H](O)CSc1ncc(C(=O)O)s1	1593472509	PDIMMSHYXWDENM-SCSAIBSYSA-N	219.287	1.314	10	20	BDCD	
COc1ccc(O)c(CNCc2ocnc2C)c1	894259798	JNQJRERBRKCQNO-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
Cc1cccc(CN[C@H]2CO[C@@H](C)C2)c1O	402145566	NKGUQNRZVJWDFQ-CMPLNLGQSA-N	221.300	1.968	10	20	BDCD	
C[C@H]1COCCN(C(=O)Nc2ccc(N)cc2)C1	399134162	VMTSEIFQEPBOHQ-SNVBAGLBSA-N	249.314	1.769	10	20	BDCD	
CCOCCC(=O)NCc1ccc(N)cc1	53732680	QXCZAVCKQVTWDX-UHFFFAOYSA-N	222.288	1.312	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)CC[C@@H]1O	190045145	JKRKDOHPOANPPD-JQWIXIFHSA-N	221.300	1.595	10	20	BDCD	
O=C(NCc1ccccc1O)C1(O)CCCCC1	269141511	MMVMYBQIOACHMN-UHFFFAOYSA-N	249.310	1.704	10	20	BDCD	
CC(=O)C(=O)COc1ccc(C(C)=O)cc1C	289700892	QXTSASDMNBWJIC-UHFFFAOYSA-N	234.251	1.735	10	20	BDCD	
O=C(NCc1ccccc1O)C1(O)CCCC1	299472436	GYBYODZUYCZBRI-UHFFFAOYSA-N	235.283	1.314	10	20	BDCD	
C[C@H]1C[C@@H]1CNC(=O)NCc1ccccc1O	299495910	KRHDJKHXJSSWTK-GXSJLCMTSA-N	234.299	1.847	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1cccc(Cl)c1O	819895304	FQERWMKCINOGMI-SSDOTTSWSA-N	243.690	1.951	10	20	BDCD	
COCCOC[C@@H](C)NCc1ccccc1O	742377605	WFPZJBKAZDSPMJ-LLVKDONJSA-N	239.315	1.533	10	20	BDCD	
COc1cccc([C@@H](C)NCCCO)c1O	846138541	WCVVVJPQWXMNOK-SECBINFHSA-N	225.288	1.434	10	20	BDCD	
COc1ccc(CNC(=N)N2CCC2)c(O)c1	849025255	WCMXPILMZOPJKF-UHFFFAOYSA-N	235.287	1.131	10	20	BDCD	
C[C@@H](NCc1ccc(F)c(F)c1O)C(=O)O	703330744	YUANYPTXIPFNQF-RXMQYKEDSA-N	231.198	1.233	10	20	BDCD	
CC(C)[C@H](NCc1cccc(F)c1O)C(=O)O	158742302	AXWHSROFONMDGT-JTQLQIEISA-N	241.262	1.730	10	20	BDCD	
N[C@H]1CC[C@@H](C(=O)NCc2ccccc2O)CC1	870876606	VGTXFGYIJJJKDM-KLPPZKSPSA-N	248.326	1.526	10	20	BDCD	
CNC(=O)C[C@H](C)N[C@@H]1CCc2cccc(O)c21	322803379	RBGVDAMXOJVPJO-GXSJLCMTSA-N	248.326	1.494	10	20	BDCD	
O=C(O)C1(NCc2ccc3c(c2)CCO3)CC1	720760586	VQECZCFDRRMIKH-UHFFFAOYSA-N	233.267	1.328	10	20	BDCD	
CNCCCN(C)Cc1cccc(OC)c1O	124776841	KMTVFBWKKBGQBQ-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
Nc1ccc(CN2CCCOCC2)cc1	61913773	IYFXQNPKCDXZBI-UHFFFAOYSA-N	206.289	1.491	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@@H](CO)C2)c1	305205684	ODXCSSBRXNCKBN-GFCCVEGCSA-N	235.327	1.905	10	20	BDCD	
N=C(N)NCc1ccc(N2CCCC2)cc1	73640707	FSPZFRKLUJSZQF-UHFFFAOYSA-N	218.304	1.270	10	20	BDCD	
CNC(=O)NCc1c(O)ccc2c1CCCC2	80612756	ZLYJXFRYFMQFJF-UHFFFAOYSA-N	234.299	1.700	10	20	BDCD	
CC1(CNC(=O)c2cccc(O)c2O)CC1	229413091	NZWLIBNBBKJGPA-UHFFFAOYSA-N	221.256	1.628	10	20	BDCD	
C[C@H]1COCCN1Cc1ccccc1O	132606273	FZSHPGJTTXUXRF-JTQLQIEISA-N	207.273	1.613	10	20	BDCD	
CC(=O)C(=O)COC(=O)[C@@H]1CC=CCC1	808492779	FKYBJZRJMJOVSK-SECBINFHSA-N	210.229	1.044	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC[C@H](C)N)c1	817973263	RXESBEBXFNSXGY-DTWKUNHWSA-N	224.304	1.399	10	20	BDCD	
C[C@H](NCCN)c1cc(Cl)ccc1O	817935010	SMBMBPMGMSXRFO-ZETCQYMHSA-N	214.696	1.655	10	20	BDCD	
NCC1CCN(Cc2cccc(F)c2O)CC1	843047072	FLNJJBHDSBWLKR-UHFFFAOYSA-N	238.306	1.702	10	20	BDCD	
COC[C@@H](C)CNC(=O)Cc1ccc(N)cc1	45660577	MBNDUQCFPYQZBC-JTQLQIEISA-N	236.315	1.210	10	20	BDCD	
CCCNCCNCc1cccc(F)c1O	841046722	LSAYTHXHWFDISR-UHFFFAOYSA-N	226.295	1.621	10	20	BDCD	
COc1cccc(O)c1CN(C)C[C@H](C)O	776521273	OLDSYTPAMGMXSQ-VIFPVBQESA-N	225.288	1.213	10	20	BDCD	
COC(=O)C(C)(C)NCc1ccc(C)cc1O	83364819	VDJQJZGQLMKGRL-UHFFFAOYSA-N	237.299	1.742	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@@H]1CCN1C	896595346	JJBFSURYXJNODM-HNNXBMFYSA-N	247.386	1.855	10	20	BDCD	
O=C(CCc1cnc[nH]1)NCc1ccccc1O	793683770	YGFPAPJRVNGQHB-UHFFFAOYSA-N	245.282	1.364	10	20	BDCD	
CCN1CC[C@@H](N[C@H](C)c2ccccc2O)C1=O	708663946	BBPZLOTTYKWTCE-ZYHUDNBSSA-N	248.326	1.664	10	20	BDCD	
CC[C@H](NC)C(=O)N(C)Cc1ccccc1O	709305197	NASPVMHXRACYAU-NSHDSACASA-N	236.315	1.349	10	20	BDCD	
CC(F)(F)C(=O)[C@@H]1CCCC(=O)C1=O	300862939	JJRYZKPQXYYBFD-RXMQYKEDSA-N	204.172	1.149	10	20	BDCD	
C[C@H](CC(=O)O)N[C@@H]1CCc2cccc(O)c21	1609888472	MKXGPOVVPDNROH-PSASIEDQSA-N	235.283	1.832	10	20	BDCD	
C[C@@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)CCN1	834673850	WUSVVXMYTCYGQE-MFKMUULPSA-N	247.342	1.068	10	20	BDCD	
CCN1CC[C@@H](N(C)Cc2ccccc2O)C1=O	851841493	UBISZYARWFDVJO-GFCCVEGCSA-N	248.326	1.445	10	20	BDCD	
COC[C@@H](CNCc1c(C)cccc1O)OC	877189185	KXQRFCFDSHFDRC-LLVKDONJSA-N	239.315	1.452	10	20	BDCD	
Nc1ccc(CC(=O)N2CCC[C@@H](O)CC2)cc1	386271649	XKBAWEJPEQMRRN-CYBMUJFWSA-N	248.326	1.185	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CC[C@@H](O)C2)c1	188839917	SEALPYKZKNKIRV-WCQYABFASA-N	235.327	1.951	10	20	BDCD	
C[C@H](N)[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1	126809436	IZIWIZHNIOPASS-JSGCOSHPSA-N	247.386	1.922	10	20	BDCD	
C[C@@H](NC(=O)Cc1ccc(N)cc1)C1CC1	35732594	IXOCIIBEUFRDFG-SECBINFHSA-N	218.300	1.726	10	20	BDCD	
Cn1cnc([N+](=O)[O-])c1Sc1nccs1	48894082	WTSXIESRNPTROM-UHFFFAOYSA-N	242.285	1.936	10	20	BDCD	
C[C@H]1[C@@H](C)NCCN1Cc1ccc(N(C)C)cc1	379472684	SYFZBMOIWSHATP-OLZOCXBDSA-N	247.386	1.935	10	20	BDCD	
CN(CCc1cn[nH]c1)Cc1ccccc1O	290054275	OYNUVMSCBYWRNG-UHFFFAOYSA-N	231.299	1.790	10	20	BDCD	
CCN(C)c1ccc([C@H](C)NCCN)cc1	817934445	IQFRMASAHGLZHQ-NSHDSACASA-N	221.348	1.752	10	20	BDCD	
CC(C)(N)CNCc1cc(F)ccc1O	841031440	UCZZOSWFLOTPHS-UHFFFAOYSA-N	212.268	1.358	10	20	BDCD	
O=C(OC[C@@H]1CCOC1)c1cccc(O)c1O	758559035	CAIXFSYSFDSMPJ-MRVPVSSYSA-N	238.239	1.291	10	20	BDCD	
CCN(C)c1ccc(CN(C)CC(=O)NC)cc1	773731713	OGGJUZNLMWRBID-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
CCCN(CC(N)=O)Cc1ccccc1O	60378116	VEPXPZNZQOKMMO-UHFFFAOYSA-N	222.288	1.090	10	20	BDCD	
Cc1ccc(O)c(CN(C)CC(C)(C)N)c1	691986367	SGHJXQPTGTXFJU-UHFFFAOYSA-N	222.332	1.870	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@H](O)C1)c1ccccc1O	720976139	DDHSKTPLTPNWFL-GMTAPVOTSA-N	221.300	1.814	10	20	BDCD	
CCc1oc(C(=O)O)cc1COc1cncnc1	1605881522	PAPURSLHAXOLOI-UHFFFAOYSA-N	248.238	1.909	10	20	BDCD	
Cc1cccc(CN2CC[C@@](C)(C(=O)O)C2)c1O	1594404427	UTBFLYNGBTUYLI-CQSZACIVSA-N	249.310	1.997	10	20	BDCD	
CC(C)(F)C(=O)NCCc1ccc(O)c(O)c1	160734743	HBBWAQBEYRCRNY-UHFFFAOYSA-N	241.262	1.505	10	20	BDCD	
NCC1(NC(=O)Cc2ccc(N)cc2)CCCC1	262597526	KUMNYOMDPUMYNX-UHFFFAOYSA-N	247.342	1.199	10	20	BDCD	
CC(C)[C@H](O)CN[C@H]1CCc2cccc(O)c21	297613962	IREDGLKZDKQTQM-WCQYABFASA-N	235.327	1.986	10	20	BDCD	
Cc1ccc(C(=O)NCC(C)C)c(O)c1O	177661133	TXSHTYFPBFVFNF-UHFFFAOYSA-N	223.272	1.792	10	20	BDCD	
CN(C)c1ccc(CN(C)[C@H]2CCOC2)cc1	120180202	XHDQNYYLOZCKFB-AWEZNQCLSA-N	234.343	1.973	10	20	BDCD	
COC[C@@H](O)CCNCc1cc(C)ccc1O	231607478	FTAHMQVLLOQYMZ-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
O=S1CCN(Cc2cc(F)ccc2O)CC1	180080740	JSDNDLIILXCVHW-UHFFFAOYSA-N	243.303	1.096	10	20	BDCD	
CCOc1cccc(CNCc2ncc[nH]2)c1O	80583564	YUHQPWUXRZEOFU-UHFFFAOYSA-N	247.298	1.804	10	20	BDCD	
CN(C)CCSc1ncc([N+](=O)[O-])s1	192483416	KQPZUSKZQQAALN-UHFFFAOYSA-N	233.318	1.705	10	20	BDCD	
COC[C@H](CO)NCc1c(O)cccc1Cl	234785180	RMPGGICXDGBJRI-QMMMGPOBSA-N	245.706	1.143	10	20	BDCD	
Cc1cccc(CNC[C@@H](C)CCO)c1O	162868285	CWUIJCRDWVLVMG-JTQLQIEISA-N	223.316	1.809	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H](O)C1CC1	236513959	SQMNFJDJQVRQGV-LBPRGKRZSA-N	225.263	1.392	10	20	BDCD	
Cc1cccc(CN2CC[C@@](F)(CO)C2)c1O	802661478	QMOUUZNNMQBOKO-ZDUSSCGKSA-N	239.290	1.607	10	20	BDCD	
CC[C@@H](O)[C@@H](C)C(=O)NCc1ccccc1O	822576126	JHUGAJSXYYVZLL-MWLCHTKSSA-N	237.299	1.415	10	20	BDCD	
C[C@@H](CO)CCCNC(=O)c1cc(O)cs1	760834149	MGWBFYLBKKLYMP-MRVPVSSYSA-N	243.328	1.592	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCCC[C@H]2N)cc1	1122540966	YBDASGQLHPEJGN-QWHCGFSZSA-N	247.342	1.403	10	20	BDCD	
CO[C@@H]1CN(Cc2c(C)cccc2O)CCO1	895963541	PDOSRWMQXFEURB-ZDUSSCGKSA-N	237.299	1.505	10	20	BDCD	
CC1(C(=O)COC(=O)c2cc(O)cs2)CC1	795507003	RNJRASYAIVNUIQ-UHFFFAOYSA-N	240.280	1.980	10	20	BDCD	
COc1cc(CN2CCO[C@@H]3C[C@H]32)c(O)cc1C	793621688	ZQQRRUAUIAYKTO-BXUZGUMPSA-N	249.310	1.682	10	20	BDCD	
CCN(C)S(=O)(=O)Nc1ccc(O)cc1C	746055569	UMKAHGFRFFGZCD-UHFFFAOYSA-N	244.316	1.309	10	20	BDCD	
CCC[C@@](C)(CO)NCc1ccc(N)cc1	1334754664	QOISXPYCBWSBOW-ZDUSSCGKSA-N	222.332	1.910	10	20	BDCD	
CN[C@H]1CCN(Cc2ccc(N)cc2)C1	1336116110	BSCMIZBMKLUZJR-LBPRGKRZSA-N	205.305	1.063	10	20	BDCD	
Cc1ccc(CN[C@@H](CCO)C2CC2)c(O)c1	877058789	GHOJODXPCKLMLR-ZDUSSCGKSA-N	235.327	1.951	10	20	BDCD	
Cc1ccc(CNC[C@@H]2CCN2C)c(O)c1	896594794	DAOGVPZQDGZFEE-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCCCN1	37823730	ABWXKPISCDTETJ-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
CC[C@H](CNC(=O)c1cccc(O)c1O)OC	291881870	HGHGAMLCISFWKU-MRVPVSSYSA-N	239.271	1.253	10	20	BDCD	
CC[C@@](C)(O)CNCc1cc(F)cc(F)c1O	708481363	CTEVOCVPPJSHAQ-GFCCVEGCSA-N	245.269	1.921	10	20	BDCD	
CC[C@@H]1C[C@H]1CNC(=O)Cc1ccc(N)cc1	388117196	ZLWCZGRDGWXEME-NEPJUHHUSA-N	232.327	1.974	10	20	BDCD	
CNC(=O)CCN[C@H](C)c1ccccc1O	44988445	JVXRFAIYGQOQON-SECBINFHSA-N	222.288	1.179	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1(C)COC1	272791409	AVWPEGIVQPRPNI-UHFFFAOYSA-N	235.283	1.387	10	20	BDCD	
COc1ccccc1SCC(=O)C(C)=O	288035247	ASLXDCASZVPBCK-UHFFFAOYSA-N	224.281	1.945	10	20	BDCD	
CC[C@H](NCC1CNC1)c1ccc(C)cc1O	817964947	KLJDHENJVYEQOO-ZDUSSCGKSA-N	234.343	1.961	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@H](N)C1)c1ccc(F)cc1O	873259037	XVIWMGVYNDIWFG-FXPVBKGRSA-N	238.306	1.919	10	20	BDCD	
CCOC1CN(Cc2c(C)cccc2O)C1	877579901	IFTLRXPHMSGZSG-UHFFFAOYSA-N	221.300	1.921	10	20	BDCD	
[N-]=[N+]=NCCN1CCN(C[C@@H]2CCCO2)CC1	409427154	JSGKQVRGUQSXGQ-NSHDSACASA-N	239.323	1.093	10	20	BDCD	
Oc1ccc(Cl)cc1CNC[C@@H]1COCO1	894871358	BRQHZMJSKJXAQZ-SNVBAGLBSA-N	243.690	1.508	10	20	BDCD	
Nc1ccc(CNC[C@H](O)C(F)(F)F)cc1	716303933	YAGOXMRULWWFMS-VIFPVBQESA-N	234.221	1.282	10	20	BDCD	
C[C@@H](Cc1cnn(C)c1)NCc1ccccc1O	768400931	BODBABPFVDYDNJ-NSHDSACASA-N	245.326	1.847	10	20	BDCD	
Cc1ccc(CN(CC(=O)O)C2CC2)c(O)c1	1600410555	RXZYYVLKDGHZBT-UHFFFAOYSA-N	235.283	1.750	10	20	BDCD	
C[C@H](C(=O)NCc1ccc(N(C)C)cc1)[C@@H](C)N	156759316	XSTOFIDUSPSWHN-WDEREUQCSA-N	249.358	1.352	10	20	BDCD	
O=C(O)CN(Cc1ccccc1O)C1CCC1	848640573	SAYMWTACBJPQMU-UHFFFAOYSA-N	235.283	1.831	10	20	BDCD	
Cc1ccc(CN[C@H]2CC(=O)N(C)C2)c(O)c1	876994117	DFNVDOWTGBIHBE-NSHDSACASA-N	234.299	1.021	10	20	BDCD	
Cc1ccc(CNC2(CO)CCC2)c(O)c1	877140230	BXAGWQLOXTYFHD-UHFFFAOYSA-N	221.300	1.705	10	20	BDCD	
Oc1ccc(Cl)c(F)c1CN1CCNCC1	217639325	QKFZIJMQVRMLIU-UHFFFAOYSA-N	244.697	1.590	10	20	BDCD	
COC[C@@H](CNCc1cccc(C)c1O)OC	227717477	YRIDWAUUYZRFNY-GFCCVEGCSA-N	239.315	1.452	10	20	BDCD	
CCN(CC(=O)OC)c1ccc(OC)cc1	265996216	LVTSFAXMILFZTO-UHFFFAOYSA-N	223.272	1.695	10	20	BDCD	
CC(=O)C(=O)COc1cc(C)ccc1F	289630983	MLXAXYACCROKKN-UHFFFAOYSA-N	210.204	1.671	10	20	BDCD	
CC1=NO[C@@H](C(=O)Nc2ccc(N)cc2)C1	911661323	VAWCTWQLZBOKFD-SNVBAGLBSA-N	219.244	1.372	10	20	BDCD	
CN[C@@H]1CCN(Cc2ccc(N(C)C)cc2C)C1	843045144	MSENBJXTXUVQIT-CQSZACIVSA-N	247.386	1.855	10	20	BDCD	
C[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@@H]2O	768465788	LHKXTFYXLQIWMY-ZANVPECISA-N	249.310	1.802	10	20	BDCD	
COc1ccc(CN[C@H](C)[C@@H](C)OC)c(O)c1	877493865	PRSUEIAYVYYFIK-NXEZZACHSA-N	239.315	1.914	10	20	BDCD	
COc1ccc(CNC(=O)[C@H](C)OC)c(O)c1	794381332	KXBYSQRIAAJMLF-QMMMGPOBSA-N	239.271	1.052	10	20	BDCD	
N[C@H]1C[C@H](CNCc2cc(F)c(F)cc2O)C1	1580427848	VWWZAIXQQVIFMC-XWEPSHTISA-N	242.269	1.497	10	20	BDCD	
C[C@H](NC[C@@H](C)O)c1cc(C(=O)O)ccc1O	1593462541	MEEDHNAQPMNZNY-SFYZADRCSA-N	239.271	1.122	10	20	BDCD	
CN1CC[C@H]1CN[C@@H]1CCc2cccc(O)c21	712581805	PSYZIFWNDNLLNS-NWDGAFQWSA-N	232.327	1.673	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@H]2CCNC2=O)c1	770377674	BDCUJJLZVNJWAF-NSHDSACASA-N	234.299	1.021	10	20	BDCD	
CC[C@H](COC)NC(=O)c1cccc(O)c1O	126436963	QENOEEKGMGRMRK-MRVPVSSYSA-N	239.271	1.253	10	20	BDCD	
Cc1cccc(CNCCC(=O)N(C)C)c1O	124753544	WTLHDPMTRUVSOF-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
Cc1ccc(O)c(CNCC(C)(C)CO)c1	133528867	QYUONPPBQNKVSB-UHFFFAOYSA-N	223.316	1.809	10	20	BDCD	
C[C@H](O)C(=O)NCc1c(O)ccc2c1CCCC2	276364024	MUPGOOOCPTWTIS-VIFPVBQESA-N	249.310	1.268	10	20	BDCD	
CO[C@@H](C)CN(C)C(=O)c1cc(O)cs1	807755508	ORKMUGDMADNPDC-ZETCQYMHSA-N	229.301	1.561	10	20	BDCD	
C[C@@]1(NCc2cc(F)ccc2O)CCOC1=O	290824631	HBPLAAMGTFQKAT-GFCCVEGCSA-N	239.246	1.327	10	20	BDCD	
CNCCN[C@@H](C)c1cc(Cl)ccc1O	817952805	SUTBVAQUTIFAGP-QMMMGPOBSA-N	228.723	1.916	10	20	BDCD	
C[C@@H](NCC(C)(C)N)c1ccc(F)cc1O	817959651	FRDBJXXKQRFDQT-MRVPVSSYSA-N	226.295	1.919	10	20	BDCD	
CN(C(=O)/C=C\c1cccnc1)c1cn[nH]c1	746446577	VIVBRKIJCVTWLS-PLNGDYQASA-N	228.255	1.481	10	20	BDCD	
CN[C@@H]1CCN(Cc2cc(C)c(C)cc2O)C1	843045796	WKJUASXXOAVTPX-CYBMUJFWSA-N	234.343	1.803	10	20	BDCD	
CCn1[nH]cnc1=NCc1ccccc1O	1336489699	LFAPUOZSJIWULB-UHFFFAOYSA-N	218.260	1.038	10	20	BDCD	
O=C(N[C@H]1C=CCC1)c1c(F)ccc(O)c1O	857309261	XWXSTHVOGVSHPX-ZETCQYMHSA-N	237.230	1.685	10	20	BDCD	
C[C@@H](N)[C@H]1CCCN(Cc2ccccc2O)C1	70171414	GAFVFCMGSBPYQS-NEPJUHHUSA-N	234.343	1.951	10	20	BDCD	
CN(C)c1ccnc(NCc2ccccc2O)n1	774522857	APUIBBZMEKUNTF-UHFFFAOYSA-N	244.298	1.860	10	20	BDCD	
C/C=C(\C)C(=O)NCc1ccc(OC)cc1O	794381720	SGWBOFNGNOUERN-RUDMXATFSA-N	235.283	1.983	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)NOC1CCC1	1324684455	BLXUDRDYTQRXIQ-ALCCZGGFSA-N	249.266	1.711	10	20	BDCD	
COCCN(C)C(=O)NCc1ccc(N)cc1	1335738276	YKKSOUDLPPYFOB-UHFFFAOYSA-N	237.303	1.057	10	20	BDCD	
CCc1cccc(CN[C@H](C(=O)O)C2CC2)c1O	1597586275	DFLOXHVVBKMWKD-LBPRGKRZSA-N	249.310	1.907	10	20	BDCD	
CCNC(=S)NCc1ccc(N(C)C)cc1	7371520	FOUPSRUFRGYKMB-UHFFFAOYSA-N	237.372	1.737	10	20	BDCD	
NC[C@H](NCc1ccc2c(c1)CCCO2)C1CC1	904350059	GQTPYJRVSCLQBF-AWEZNQCLSA-N	246.354	1.839	10	20	BDCD	
COCC[C@@H](CO)NCc1c(C)cccc1O	894654339	FODACRLPYJGKNV-NSHDSACASA-N	239.315	1.188	10	20	BDCD	
COc1cccc(CN[C@@H]2CO[C@@H](C)C2)c1O	402031067	ILITWIHOKCJPOM-ONGXEEELSA-N	237.299	1.668	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCCO2)C(=O)O	1333892669	MDJNFXNTQCTCFR-VIFPVBQESA-N	235.283	1.574	10	20	BDCD	
COc1cccc(CN(C)[C@@H](C)CN)c1O	383002064	VHTSFIKQYYLDDL-VIFPVBQESA-N	224.304	1.180	10	20	BDCD	
C[C@@H](N)CN[C@@H]1CCc2cccc(O)c21	817971821	HJPICKYIAZJNQD-PSASIEDQSA-N	206.289	1.316	10	20	BDCD	
CN1CC[C@H]1CNCc1c(O)cccc1Cl	712572081	MUWXUXJKBPUJHL-VIFPVBQESA-N	240.734	1.839	10	20	BDCD	
C[C@]1(CNC(=O)c2cc(O)cs2)CCOC1	733365009	YVKSPLPSIAMXTB-LLVKDONJSA-N	241.312	1.610	10	20	BDCD	
C[C@@H](N)C[C@@H](C)NCc1cc(F)ccc1O	843127426	DGHDTVQYNBBWRQ-RKDXNWHRSA-N	226.295	1.747	10	20	BDCD	
NCC[C@@H](NCc1ccccc1O)C(F)F	841073261	GKVDUJYSDMTNNK-SECBINFHSA-N	230.258	1.464	10	20	BDCD	
COc1cccc([C@@H](C)NC/C=C/CO)c1O	850510218	VZCLDENULHUBDD-HMDXOVGESA-N	237.299	1.600	10	20	BDCD	
CNC[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O	854231376	GSKJPQUSAUWNCD-ZJUUUORDSA-N	238.331	1.659	10	20	BDCD	
Cc1cc(O)c(CN2CC(C)(O)C2)cc1C	877581199	QDKFSDARMJBGQG-UHFFFAOYSA-N	221.300	1.576	10	20	BDCD	
OC[C@@H](CC1CC1)NCc1ccc2c(c1)CCO2	754835029	QZLMEJNYXYEXKS-CQSZACIVSA-N	247.338	1.872	10	20	BDCD	
CC[C@H](CO)NCc1cccc(Cl)c1O	162736144	FJMVWYLFCNOFOC-SECBINFHSA-N	229.707	1.906	10	20	BDCD	
C[C@H]1C[C@@H]1C(=O)NCc1ccc(O)c(O)c1	158898228	FRQQLKZUSDGAPU-CBAPKCEASA-N	221.256	1.370	10	20	BDCD	
COC(=O)CN(Cc1ccc(N)cc1)C(C)C	35365374	BTTFBUFHXRVLTE-UHFFFAOYSA-N	236.315	1.652	10	20	BDCD	
CC1(C)[C@H](O)C[C@H]1NC(=O)Nc1ccc(N)cc1	841296541	UZDZZUKOURAXQG-GHMZBOCLSA-N	249.314	1.550	10	20	BDCD	
C[C@H](NCCOCC(=O)O)c1ccccc1O	1589128190	BTOYNRZQVHJEPA-VIFPVBQESA-N	239.271	1.144	10	20	BDCD	
CCOC[C@@H]1CN(CCN=[N+]=[N-])C[C@H]1C	409429905	HYUXHBQDFBDADH-ZJUUUORDSA-N	212.297	1.901	10	20	BDCD	
COC[C@@H](CO)NCc1c(O)cccc1Cl	234866041	RMPGGICXDGBJRI-MRVPVSSYSA-N	245.706	1.143	10	20	BDCD	
CC(C)CONC(=O)c1c(F)ccc(O)c1O	295427897	MIRXYAFBCMQXNI-UHFFFAOYSA-N	243.234	1.554	10	20	BDCD	
C[C@@H](CN)N[C@H](C)c1cc(F)cc(F)c1O	817969363	CPRHXCGBDGRQNH-NKWVEPMBSA-N	230.258	1.668	10	20	BDCD	
CN(CC(=O)O)Cc1cc2c(cc1O)CCCC2	820569570	ZHIOJSPOPNMTAU-UHFFFAOYSA-N	249.310	1.787	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H]1C[C@H](N)C1	906517975	LPWUDMQZPKRRQH-JOCQHMNTSA-N	233.359	1.640	10	20	BDCD	
C[C@@H](NC[C@]1(C)CCC(=O)N1)c1ccccc1O	834907737	AZZKJIDDABMXSU-YGRLFVJLSA-N	248.326	1.712	10	20	BDCD	
C[C@@H]1C[C@H](NCc2cc(F)ccc2O)CCN1	841062930	ZMOZHXMWGBPUSZ-BXKDBHETSA-N	238.306	1.761	10	20	BDCD	
C[C@H](CN)CNCc1cccc(Cl)c1O	841049790	WKFULCNIHXSPNW-MRVPVSSYSA-N	228.723	1.730	10	20	BDCD	
CCO[C@H](C)C(=O)NCc1ccc(O)cc1O	910951650	KIMRGNGBGOCGGG-MRVPVSSYSA-N	239.271	1.139	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)Cn2cccc2)C1	409422781	IPPUHPRMPQPFEO-UHFFFAOYSA-N	205.221	1.009	10	20	BDCD	
NC(=O)[C@H]1CC[C@@H](NCc2ccc(N)cc2)C1	1580099273	VEGQOTBVWGAUKR-CMPLNLGQSA-N	233.315	1.012	10	20	BDCD	
Nc1ccc(CN(C2CCNCC2)C2CC2)cc1	1336287224	YFXZUBATALXKQS-UHFFFAOYSA-N	245.370	1.985	10	20	BDCD	
CC[S@](=O)CCNCc1c(C)cccc1O	877041117	IDTAISBXGWEIRS-INIZCTEOSA-N	241.356	1.559	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](CCN)C2)c1	723670184	QDTBUDCYPHZLBK-GFCCVEGCSA-N	234.343	1.871	10	20	BDCD	
Cc1nnsc1CNCc1ccccc1O	291807636	XVDYNDWDFBEQMF-UHFFFAOYSA-N	235.312	1.842	10	20	BDCD	
CC(=O)C(=O)COC(=O)[C@H]1CC=CCC1	808492780	FKYBJZRJMJOVSK-VIFPVBQESA-N	210.229	1.044	10	20	BDCD	
CN(C(=O)c1cc(O)cs1)[C@H]1CCCOC1	807678261	HCMCNPBUSYZVFW-QMMMGPOBSA-N	241.312	1.705	10	20	BDCD	
O=C(NCc1cc(Cl)ccc1O)C(F)F	857547183	TXRBTFKHAXFVSA-UHFFFAOYSA-N	235.617	1.927	10	20	BDCD	
COCC1(C(=O)NCc2cc(C)ccc2O)CC1	862757147	JBQYTWJDPFZBLS-UHFFFAOYSA-N	249.310	1.743	10	20	BDCD	
O=C(O)C1CC(NCc2ccccc2O)C1	874056558	WUDIGSNZALAUKE-UHFFFAOYSA-N	221.256	1.345	10	20	BDCD	
CCOC(=O)C1=NN(c2ccccc2)C(=O)[C@@H]1C	105360375	VYWCMILBLGMHDX-SECBINFHSA-N	246.266	1.588	10	20	BDCD	
CN(CC[C@@H]1CCNC1)Cc1ccccc1O	842472457	YLVNBKKNBKNPGS-LBPRGKRZSA-N	234.343	1.824	10	20	BDCD	
Oc1ccccc1CNCc1cnc2n1CCC2	719180358	SFHDVUFXUWZPAB-UHFFFAOYSA-N	243.310	1.825	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)c2cn[nH]c2)c1	224935422	AVERPQRYTUTPMX-VIFPVBQESA-N	247.298	1.975	10	20	BDCD	
COCCCN(C)Cc1cc(OC)ccc1O	134044635	FBWBECVGPOBUFL-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
CCOc1cccc(CN(C)CCN)c1O	54416733	PMIARZDSCLSGEM-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@H](O)C2(C)C)c1O	128233190	XMQCEBJYXGJSSU-RYUDHWBXSA-N	235.327	1.950	10	20	BDCD	
CN1[C@H]2CC[C@H]1CN(Cc1ccc(N)cc1)CC2	252647787	URPKAPUYNRHWQO-GJZGRUSLSA-N	245.370	1.937	10	20	BDCD	
C[C@@H](N[C@@H]1CC[C@H]1O)c1ccccc1O	378718531	DKSPLOJTIMDIEM-HLUHBDAQSA-N	207.273	1.566	10	20	BDCD	
CO[C@@H]1CC[C@@H](NC(=O)Nc2ccc(N)cc2)C1	234825404	KFCDGYVSDBYNKV-VXGBXAGGSA-N	249.314	1.958	10	20	BDCD	
CCN(Cc1cccc(C)c1O)[C@H](C)CO	292856373	UVBWGOVPHXIRCM-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
COc1ccc(O)c(CNc2cnccn2)c1	811806079	JAKBOSLMFWSUCN-UHFFFAOYSA-N	231.255	1.803	10	20	BDCD	
C[C@@H](CN)CN[C@H](C)c1cc(F)ccc1O	817962471	MTBXEYZVGZKRDF-DTWKUNHWSA-N	226.295	1.777	10	20	BDCD	
COc1cccc(CN2CC[C@@H](O)[C@H]2C)c1O	825103359	CVTSFEVCBDQCOW-MWLCHTKSSA-N	237.299	1.356	10	20	BDCD	
O=C(NO[C@H]1CCCCO1)c1cc(O)cs1	731872445	KOGGHAFVLCAQPB-VIFPVBQESA-N	243.284	1.642	10	20	BDCD	
O=C(NC(CF)CF)c1cccc(O)c1O	833425982	JQDJYLUGFDNTJM-UHFFFAOYSA-N	231.198	1.135	10	20	BDCD	
Cc1n[nH]c(C)c1/C=C1\SC(=S)NC1=O	915653633	FFKXWIHFEDIZGD-CLTKARDFSA-N	239.325	1.515	10	20	BDCD	
CCO[C@H](C(=O)NCc1ccc(N)cc1)C1CC1	859594111	QDPWGNQRWDGALX-ZDUSSCGKSA-N	248.326	1.700	10	20	BDCD	
CCOC(=O)C1(CNCc2ccccc2O)CC1	770665944	QHLJBSWCLIXLTC-UHFFFAOYSA-N	249.310	1.825	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CC[C@@H](CN)C2)cc1	724060888	XVHKWDSERYZAKT-ZIAGYGMSSA-N	247.386	1.970	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1C[C@]12CCOC2	764251180	QBEHQKIRUCHMGI-RISCZKNCSA-N	247.294	1.435	10	20	BDCD	
C[C@H]1[C@@H](C)N(C)CCN1Cc1ccc(N)cc1	1334754799	RQPQKKMVWMTCRB-NEPJUHHUSA-N	233.359	1.793	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1CCCO1)CCO2	1743410	IEYPWNCLKNXLKY-CYBMUJFWSA-N	233.311	1.890	10	20	BDCD	
Cc1cccc(O)c1CNC1CCN(C)CC1	876897357	BMLLWDPTGNXPEG-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
c1nc(CNCc2ccc3c(c2)CCO3)co1	397875727	VOUVOFVYYJGNEW-UHFFFAOYSA-N	230.267	1.899	10	20	BDCD	
COc1ccc(O)c(CNCC2(CO)CC2)c1	122350335	JEUVDWTUOZXYBW-UHFFFAOYSA-N	237.299	1.263	10	20	BDCD	
COc1ccc(N(C)CCCO)cc1F	258990978	LTWOMMOHBWBSDL-UHFFFAOYSA-N	213.252	1.653	10	20	BDCD	
CCNCCN[C@@H](C)c1cc(F)cc(F)c1O	817952810	UFYPZYLYJSGDOK-QMMMGPOBSA-N	244.285	1.931	10	20	BDCD	
C[C@@H]1C[C@H](NCCN)c2c(O)ccc(F)c21	817935450	WERXVXVPVNSXCG-APPZFPTMSA-N	224.279	1.628	10	20	BDCD	
CN1CCCc2cc(CNC(=O)CCO)ccc21	902834578	YUADRSSGMXCMRQ-UHFFFAOYSA-N	248.326	1.068	10	20	BDCD	
C[C@H](N)C[C@H](C)NCc1ccccc1O	843129427	OOXYJMCUIMRRDC-UWVGGRQHSA-N	208.305	1.608	10	20	BDCD	
CN[C@@H](C)CCNCc1cc(OC)ccc1O	1325268069	OTPFSAPTEBMEDF-JTQLQIEISA-N	238.331	1.488	10	20	BDCD	
CC1CC(CNC(=O)c2cccc(O)c2O)C1	691086861	ZGCXPEPPDLVFLF-UHFFFAOYSA-N	235.283	1.874	10	20	BDCD	
CC1(C)[C@@H](O)C[C@@H]1NCc1ccc2c(c1)CCO2	129578183	ZCALMRZPUBUJTQ-KBPBESRZSA-N	247.338	1.871	10	20	BDCD	
C[C@H]1COCCN1C(=O)Cc1ccc(N)cc1	35773348	WWNQTVAXPIVPFP-JTQLQIEISA-N	234.299	1.059	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C[C@@H]2C[C@H]2C1	380361222	ARFHIPHEXOEVEX-YUMQZZPRSA-N	219.240	1.190	10	20	BDCD	
COc1cccc(CN2C[C@H]3C[C@H]3C2)c1O	862439957	CINGKJBOMQNAFS-PHIMTYICSA-N	219.284	1.853	10	20	BDCD	
CCn1nnnc1N(C)Cc1ccccc1O	1119646228	DETFAZMJDCBREY-UHFFFAOYSA-N	233.275	1.035	10	20	BDCD	
COc1cccc(O)c1CN(CCO)C1CC1	768330170	OHRLWNBOVDQZSU-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1[C@H]2CCC[C@H]12	1123977419	FLINFUIJXMDGJE-UWVGGRQHSA-N	247.294	1.760	10	20	BDCD	
CCc1cccc(CN[C@H]2C[C@@H](CO)C2)c1O	707580697	QYMFAYSGRGDHBL-GSJFWJNXSA-N	235.327	1.815	10	20	BDCD	
CC(C)[C@H]1CN(Cc2ccc(N)cc2)CCN1	1336287007	VYYSKNZIQNXJLJ-CQSZACIVSA-N	233.359	1.699	10	20	BDCD	
CN(C)c1cc(F)c(CNCC(=O)O)cc1F	1348502933	NUNZTXKWUGWPEZ-UHFFFAOYSA-N	244.241	1.205	10	20	BDCD	
Oc1cc(F)c(Cl)cc1CNC[C@@H]1CCN1	1580888781	ZGPRRCZDUGKCPY-QMMMGPOBSA-N	244.697	1.636	10	20	BDCD	
Cc1ccc(CNC[C@H]2CC[C@@H](O)C2)c(O)c1	877468609	KXUIHLHFVQWGLU-WCQYABFASA-N	235.327	1.951	10	20	BDCD	
CC[C@](C)(O)CNCc1cc(F)cc(F)c1O	708481364	CTEVOCVPPJSHAQ-LBPRGKRZSA-N	245.269	1.921	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H]3CC[C@H](C2)N3)c1	873216083	IJILDRPDYZLUIS-BETUJISGSA-N	232.327	1.637	10	20	BDCD	
COCCNCc1ccc(OC)c(C)c1	35052512	OPPOGWLZPKTKTF-UHFFFAOYSA-N	209.289	1.740	10	20	BDCD	
CCn1cc(NC(=O)Cc2ccc(N)cc2)cn1	35779633	NXHHZYHHDHSYDU-UHFFFAOYSA-N	244.298	1.666	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@](C)(O)C2)c1	180197270	WXFZNDAYUURPRP-CYBMUJFWSA-N	221.300	1.657	10	20	BDCD	
O=C(NCc1ccoc1)c1cccc(O)c1O	126562009	MZXSLSPWGJWAKZ-UHFFFAOYSA-N	233.223	1.621	10	20	BDCD	
COC(=O)[C@H](C)NCc1c(O)cccc1Cl	127283526	JAHYFRZSLKQRHK-ZETCQYMHSA-N	243.690	1.697	10	20	BDCD	
COC(=O)[C@H](C)NCc1cc(C)ccc1O	70955220	QLWCAORVNVAZEE-VIFPVBQESA-N	223.272	1.352	10	20	BDCD	
O=C(O)CN(Cc1cc(F)ccc1O)C1CC1	236428865	ARXXKSNVEBMMHN-UHFFFAOYSA-N	239.246	1.580	10	20	BDCD	
C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(F)cc1O	817977639	MFCQYIGPYXNUKX-UVRHIYEWSA-N	236.290	1.400	10	20	BDCD	
C[C@@H](NCc1ccc(N(C)C)c(F)c1)C(=O)O	739030962	IHBURRIXMJNLEZ-MRVPVSSYSA-N	240.278	1.454	10	20	BDCD	
Cc1cc(NC(=O)c2cc(O)cs2)nn1C	749293034	YWPYSDSMYZEIBO-UHFFFAOYSA-N	237.284	1.748	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@H](C)CN)cc1C	843053038	YMBHBPNBJCBQCO-LLVKDONJSA-N	222.332	1.788	10	20	BDCD	
CN(C)c1ccc(CN(C)S(C)(=O)=O)cc1	70247544	ZJUARFADMCABRU-UHFFFAOYSA-N	242.344	1.144	10	20	BDCD	
OC[C@H](CC1CC1)NCc1ccc2c(c1)CCO2	754835027	QZLMEJNYXYEXKS-AWEZNQCLSA-N	247.338	1.872	10	20	BDCD	
CCc1cccc(CN[C@H]2C[C@H](C(=O)O)C2)c1O	1593642425	NKWHRQNJVSOAKD-HAQNSBGRSA-N	249.310	1.907	10	20	BDCD	
O=C(O)CCNCc1cccc(Cl)c1O	165148598	ZSLWOTZMCKGWTB-UHFFFAOYSA-N	229.663	1.610	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@@H]1CCOC1	127352099	QMNATUYHAHDHJL-MRVPVSSYSA-N	227.691	1.924	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1CCN1C	896593949	DAJBGHDDIBVEJJ-LLVKDONJSA-N	220.316	1.494	10	20	BDCD	
CCOc1ccc(O)c(CN2CC[C@@H](O)C2)c1	305730308	LCANGIFNLCIULO-LLVKDONJSA-N	237.299	1.358	10	20	BDCD	
C[C@H](NC[C@]1(O)CCOC1)c1ccccc1O	183629642	JOQGPRGPCPOCSW-GXFFZTMASA-N	237.299	1.194	10	20	BDCD	
C[C@H](N[C@@H]1CCCNC1)c1cc(F)ccc1O	817940476	ICLBGZVTQSBFHF-GXSJLCMTSA-N	238.306	1.934	10	20	BDCD	
Nc1ccc(CCN[C@H]2CCCNC2)cc1	843126658	SFHVTBCJKYNXAB-ZDUSSCGKSA-N	219.332	1.153	10	20	BDCD	
COC(=O)[C@H]1C[C@H](NCc2ccc(C)cc2O)C1	877641566	ZDXWIDDVYLSMPM-HAQNSBGRSA-N	249.310	1.742	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@H]2CCCC[C@]2(CO)C1	409435215	SZBRCKWOLJYBGI-GHMZBOCLSA-N	224.308	1.781	10	20	BDCD	
CCc1cccc(CNCC[C@H](C)O)c1O	691479293	GKOHWBMGOSXREP-JTQLQIEISA-N	223.316	1.815	10	20	BDCD	
COc1ccc(CNC(=O)c2ccco2)c(O)c1	794383474	OXWAPGYWSWKBLD-UHFFFAOYSA-N	247.250	1.924	10	20	BDCD	
Cc1cc(O)c(CNCCCCO)cc1C	193255736	XZVIXJPIUOHUGD-UHFFFAOYSA-N	223.316	1.871	10	20	BDCD	
CCOC(=O)c1cnc(SCCO)s1	308458474	DVGACPKAYSSPDF-UHFFFAOYSA-N	233.314	1.404	10	20	BDCD	
CC(C)[C@H](CO)CNCc1ccccc1O	309643548	VGMLXKHNYMDCBV-LBPRGKRZSA-N	223.316	1.746	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C(C)C)c1	114542826	XIKMIKOBLPELBZ-UHFFFAOYSA-N	223.272	1.673	10	20	BDCD	
CN(Cc1cc(F)ccc1O)CC(C)(C)O	180156868	LTBBRUSOUYPGGS-UHFFFAOYSA-N	227.279	1.734	10	20	BDCD	
CNCCCC(=O)NCc1ccc(N(C)C)cc1	40825893	UJAPRYPBQWUKJI-UHFFFAOYSA-N	249.358	1.368	10	20	BDCD	
C[C@@H]1CCN(Cc2ccccc2O)[C@@H]1CO	191179426	ZVPANAHJGCLZTH-ZYHUDNBSSA-N	221.300	1.595	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1O	367777115	IANJXJBWEYKJEB-ITGUQSILSA-N	233.311	1.371	10	20	BDCD	
NC[C@@H](N[C@H]1CCc2cccc(O)c21)C1CC1	817960265	LHBYWTJRECOYTK-NWDGAFQWSA-N	232.327	1.706	10	20	BDCD	
C[C@H](N)CN[C@H](C)c1cc(F)ccc1O	817972760	OIOFJEYESTZWBM-JGVFFNPUSA-N	212.268	1.529	10	20	BDCD	
CC(C)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1	832284805	MSFTVTFPJIOEIO-ZDUSSCGKSA-N	249.358	1.525	10	20	BDCD	
N=C(NCc1ccccc1O)NC1CCC1	848984832	IIKJQNYKSOCNGX-UHFFFAOYSA-N	219.288	1.559	10	20	BDCD	
Cc1ccc(C(=O)NC2CSC2)c(O)c1O	912632020	YIQMSXMNYYEEQM-UHFFFAOYSA-N	239.296	1.251	10	20	BDCD	
C[C@@H]1COCCN(C(=O)c2cc(O)cs2)C1	754512704	RPGYPMWQUVUEOL-QMMMGPOBSA-N	241.312	1.562	10	20	BDCD	
CN(Cc1cnon1)Cc1ccccc1O	851840228	CPDGRJBHSKQQJS-UHFFFAOYSA-N	219.244	1.407	10	20	BDCD	
O=C(OCc1ccon1)c1cccc(O)c1O	758560000	UKNRXVCGDQVCHF-UHFFFAOYSA-N	235.195	1.443	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)OCCF	867416699	GDSNLRVXORVFNR-UHFFFAOYSA-N	229.207	1.294	10	20	BDCD	
Cc1ccc(CN(C)[C@H]2CCN(C)C2=O)c(O)c1	876754597	UDEYTJKBFASBEZ-LBPRGKRZSA-N	248.326	1.363	10	20	BDCD	
CCCOc1ccc(CNCCO)cc1C	873007783	FNQPXZXCKGORHB-UHFFFAOYSA-N	223.316	1.866	10	20	BDCD	
C[C@H](N)c1cn(Cc2ccc(N(C)C)cc2)nn1	881270876	CZBMCGCGYSTACA-JTQLQIEISA-N	245.330	1.412	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@H](C)c1c(O)cccc1F	886543169	LIVPPSBYLVVUBP-JGVFFNPUSA-N	240.278	1.446	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C[C@H](O)C1CC1	785700062	VFVJSTAZIHGODJ-HNNXBMFYSA-N	248.370	1.955	10	20	BDCD	
O=C(O)CCNCc1cc(F)cc(F)c1O	708074782	FUPJROGASGAEJY-UHFFFAOYSA-N	231.198	1.235	10	20	BDCD	
Cc1cn(C)nc1C(=O)NCc1ccccc1O	723504160	ZHTIGWBUOZHCHF-UHFFFAOYSA-N	245.282	1.364	10	20	BDCD	
CCCN(CC(=O)O)Cc1cccc(F)c1O	1589669656	LQVFTADGSPSWGC-UHFFFAOYSA-N	241.262	1.828	10	20	BDCD	
Nc1ccc(CCNC(=O)N[C@@H]2C=CCC2)cc1	851663192	VORXJEYZIPMWTG-CYBMUJFWSA-N	245.326	1.829	10	20	BDCD	
CC[C@@H](N[C@H](C)c1ccccc1O)C(N)=O	310005225	GIZSQSNYJJPFJH-PSASIEDQSA-N	222.288	1.307	10	20	BDCD	
COC(=O)[C@H](C)N(C)Cc1ccccc1O	119527536	ZCLDXXOWBOBWQK-VIFPVBQESA-N	223.272	1.386	10	20	BDCD	
COCCN[C@@H](C)c1cc(F)ccc1O	87111305	YKDWRNBLDPUVGG-QMMMGPOBSA-N	213.252	1.828	10	20	BDCD	
COc1ccc(O)c(CNCCn2ccnc2)c1	41119344	VJHRNEORHOZIOX-UHFFFAOYSA-N	247.298	1.387	10	20	BDCD	
CO[C@@H](C)CNCc1cc([N+](=O)[O-])ccc1O	191139745	CJAWQSUOMCJTND-QMMMGPOBSA-N	240.259	1.425	10	20	BDCD	
CN1CC(=O)N[C@H]1c1cccc(Cl)c1O	298795160	SKBPOJWCLGDARE-SNVBAGLBSA-N	226.663	1.106	10	20	BDCD	
CNC(=S)N[C@@H](C)c1cc(OC)ccc1O	728792927	MRDHIERWUOGPFS-ZETCQYMHSA-N	240.328	1.556	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@H]1CC1(F)F	910943396	BOLMVGSKAIKCHK-MRVPVSSYSA-N	243.209	1.369	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](N)C(C)C)c1	841031794	YAFDVUQVXRSIJU-LBPRGKRZSA-N	238.331	1.474	10	20	BDCD	
CNC[C@H]1CCCN1Cc1cccc(C)c1O	843055206	GTINOONIZKBDSM-CYBMUJFWSA-N	234.343	1.884	10	20	BDCD	
Nc1ccc(CNC(=O)COC(F)(F)F)cc1	927767792	KTUBBUYDESNZLQ-UHFFFAOYSA-N	248.204	1.421	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2COC[C@H]2C)c1	699482842	ZXPHGQAODWQMES-PWSUYJOCSA-N	221.300	1.825	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H](C)N(C)C)c1	862758202	SLCNISGHMRLGGU-JTQLQIEISA-N	236.315	1.267	10	20	BDCD	
CO[C@H]1C[C@H](NC(=O)c2cc(O)cs2)C1	863672658	NNBJRARMWMLLJK-FKQCQYRASA-N	227.285	1.361	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CC[C@H](N)CC2)cc1	1122444389	AQXNZYFHVSUADZ-AULYBMBSSA-N	247.342	1.403	10	20	BDCD	
CN1CCCN=C1NCc1ccccc1O	386100798	JSJGRKCQBIECTF-UHFFFAOYSA-N	219.288	1.173	10	20	BDCD	
Cc1ccc(CN[C@@H]2C(=O)NCC2(C)C)c(O)c1	895324854	NCKLCVQQQVWYHV-GFCCVEGCSA-N	248.326	1.315	10	20	BDCD	
CC(C)C[C@H](N)C(=O)NCCc1ccc(N)cc1	169816249	FFOUXXVBANSGHB-ZDUSSCGKSA-N	249.358	1.301	10	20	BDCD	
Cc1cccc(CNCCCCO)c1O	193275265	XIWMHYCSTYLKHI-UHFFFAOYSA-N	209.289	1.563	10	20	BDCD	
CC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O	818317121	NVCOOJLFTAXDNK-LLVKDONJSA-N	235.283	1.574	10	20	BDCD	
CN(Cc1ccccc1O)[C@@H](C(=O)O)C1CC1	873641354	TUFQQKAXTNZABQ-GFCCVEGCSA-N	235.283	1.687	10	20	BDCD	
COC1CC(C(=O)N(C)Cc2ccccc2O)C1	703332869	JEYQDQJWRMLFHH-UHFFFAOYSA-N	249.310	1.776	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC2(CC2)C1	926457715	JBUJRVZTIAIFMT-UHFFFAOYSA-N	219.240	1.334	10	20	BDCD	
Oc1ccccc1CNC(CF)CF	824555033	PKOWXLHSSIKYAR-UHFFFAOYSA-N	201.216	1.789	10	20	BDCD	
CC[C@@H](NCCN)c1ccc(C)cc1O	817934281	FYROUMLXLOXEMT-LLVKDONJSA-N	208.305	1.700	10	20	BDCD	
Cc1ccc(O)c(CNC[C@]2(C)CCC(=O)N2)c1	835061643	UGXLYVUTJMHPMM-AWEZNQCLSA-N	248.326	1.459	10	20	BDCD	
CNC1(C(=O)NCCc2ccc(N)cc2)CCC1	911783731	XZEOXPWEPSPNKM-UHFFFAOYSA-N	247.342	1.070	10	20	BDCD	
CCOc1ccc(CN(CC)CCN)c(O)c1	863644957	NHZCHEMUPIUBSW-UHFFFAOYSA-N	238.331	1.572	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1cnco1	778921454	BDWGLHMJEASEIH-UHFFFAOYSA-N	234.211	1.016	10	20	BDCD	
CC[C@@H](O)CNCc1cc(F)cc(F)c1O	708394242	TVGRAERKFRRHSH-SECBINFHSA-N	231.242	1.531	10	20	BDCD	
COCSc1ncc(C(=O)O)s1	1599277568	GLFAKZOQBOPXST-UHFFFAOYSA-N	205.260	1.537	10	20	BDCD	
Cc1cccc(CNC[C@H]2CCCCN2)c1O	841033622	YCLKGVALSPZMEM-CYBMUJFWSA-N	234.343	1.932	10	20	BDCD	
CC(C)CONC(=O)c1cccc(O)c1O	126610575	FKRJRZDNJNSBIK-UHFFFAOYSA-N	225.244	1.415	10	20	BDCD	
C[C@H](CCO)CCNCc1ccccc1O	295149505	QZLUPBGCGRUVFY-NSHDSACASA-N	223.316	1.890	10	20	BDCD	
CN(C)c1ccc(OCc2cnnn2C)cc1	289362563	JAHHULMKNGCEPW-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@@H]2CCNC2)c1	817944781	LRCLZLLCIOMEPU-WDEREUQCSA-N	220.316	1.713	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CC[C@H]2CO)c1	902629894	JQONPYUALCYPEY-LBPRGKRZSA-N	221.300	1.576	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@@H]1CCC=CO1	910949674	OOLLURCBTZEZGT-LBPRGKRZSA-N	249.266	1.407	10	20	BDCD	
CC(C)(CO)Cc1cn(-c2ccc(N)cc2)nn1	849134845	RVTLKWTWDGSKQP-UHFFFAOYSA-N	246.314	1.411	10	20	BDCD	
CC(C)(CO)CNC(=O)c1cc(O)cs1	771686468	ACMWSTLTWYSQNE-UHFFFAOYSA-N	229.301	1.202	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@H]1C[C@H]1F	1123669322	OVENCJRKZPNVLD-JGVFFNPUSA-N	225.219	1.072	10	20	BDCD	
CCC[C@H]1CN(C(=O)CN=[N+]=[N-])CC[C@H]1O	409434359	OUMXGGWRZNIASL-DTWKUNHWSA-N	226.280	1.306	10	20	BDCD	
O=C1c2ccc(O)cc2C(=O)c2cc(O)ccc21	5844921	RZTIWMXQXBQJNE-UHFFFAOYSA-N	240.214	1.873	10	20	BDCD	in-vitro
CCN(CCO)Cc1ccc(N(C)C)c(F)c1	158657819	JEQVHWQHEMBHMI-UHFFFAOYSA-N	240.322	1.706	10	20	BDCD	
CCN[C@H](C)C(=O)N(C)Cc1ccccc1O	707977972	DCYYMNLZHLDGPZ-SNVBAGLBSA-N	236.315	1.349	10	20	BDCD	
OCC1(CCNCc2ccc3c(c2)CCO3)CC1	395963814	YCPYYRACDJQFNX-UHFFFAOYSA-N	247.338	1.874	10	20	BDCD	
CN[C@@H]1CCN(Cc2cc(C)ccc2O)C1	150064477	BLGCXZKVTNYQKF-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
CCOc1cccc(CN[C@@H]2CCOC2)c1O	131159829	LXOCWNOPANIRLM-LLVKDONJSA-N	237.299	1.669	10	20	BDCD	
Nc1ccc(CN2CC[C@H](CO)C2)cc1	161586056	OYFPHOMFBGBTMI-NSHDSACASA-N	206.289	1.083	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(N(C)C)cc1	808488443	HXELGJODGKWLTH-UHFFFAOYSA-N	249.266	1.068	10	20	BDCD	
C[C@@H]1CSC[C@@H]1NC(=O)c1cc(O)cs1	807692530	ZSIGOEPJJIKWNZ-SVRRBLITSA-N	243.353	1.935	10	20	BDCD	
CC(C)(NCc1cc(Cl)ccc1O)C(=O)O	833461469	YFLWLGGRGOCXKU-UHFFFAOYSA-N	243.690	1.998	10	20	BDCD	
N[C@@H]1CCC[C@H](NCc2cccc(F)c2O)C1	841058262	RJWQTQKSDMQWMA-MNOVXSKESA-N	238.306	1.891	10	20	BDCD	
C[C@@H](NC(=O)[C@@]1(C)CCOC1)c1ccccc1O	827940496	DQKWIHIRRCQIJM-YGRLFVJLSA-N	249.310	1.996	10	20	BDCD	
C[C@@H](NCc1ccccc1O)C1(CO)CC1	696035641	WTCWSEOIAFIWET-SNVBAGLBSA-N	221.300	1.643	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1C[C@H]1F	1519816685	GNYPEYBYCDOQRW-RKDXNWHRSA-N	239.246	1.115	10	20	BDCD	
CS/C=C/C(=O)NCc1ccccc1O	769364603	JBOHFSNLFYQVQM-VOTSOKGWSA-N	223.297	1.885	10	20	BDCD	
CN(C[C@H]1C[C@@H](O)C1)C(=O)c1cc(O)cs1	863382856	WCSCQDIEZBUFGO-OCAPTIKFSA-N	241.312	1.297	10	20	BDCD	
Cc1ccn(C)c1C(=O)NCc1ccccc1O	784446341	PZFCPBWESOAZAS-UHFFFAOYSA-N	244.294	1.969	10	20	BDCD	
CC[C@@H](NCc1cc(F)ccc1O)[C@H](C)O	386728548	ARUAUBDJMVGVLL-GZMMTYOYSA-N	227.279	1.780	10	20	BDCD	
CC[C@H](NC(C)=O)C(=O)Nc1ccc(N)cc1	708857201	RMVSAGPWMYWVRB-NSHDSACASA-N	235.287	1.122	10	20	BDCD	
c1cc2c(cc1CN[C@H]1CCOC1)CCCO2	921930976	WXWQTNSJJMDTOF-ZDUSSCGKSA-N	233.311	1.890	10	20	BDCD	
CCOc1cccc(CNCCC(=O)O)c1O	36891999	BZDSKQZWEVBNFF-UHFFFAOYSA-N	239.271	1.355	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCCNC1	162938197	BEESRBDQLYDCGZ-NSHDSACASA-N	206.289	1.234	10	20	BDCD	
CN(C)CC1(C(=O)NCc2ccccc2O)CC1	821055597	NVIZIUNYNOGACI-UHFFFAOYSA-N	248.326	1.350	10	20	BDCD	
CC(C)(C)[C@@H](CO)NC(=O)c1cc(O)cs1	831961346	SPYNFILQXKUEDA-SECBINFHSA-N	243.328	1.591	10	20	BDCD	
CC(C)[C@H]1CN(Cc2ccccc2O)CCN1	843105680	VSXPAQCUDCKLQC-CYBMUJFWSA-N	234.343	1.822	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)[C@@H](C)O	840949035	OPSMMOOGILMMSE-VXGBXAGGSA-N	236.359	1.920	10	20	BDCD	
CCOc1ccc(O)c(CN(C)[C@@H](C)CN)c1	843051758	LKCFMTOOAMJHNS-JTQLQIEISA-N	238.331	1.570	10	20	BDCD	
CN(C)c1ccc(CNCCN2CCC2)cc1	697380551	TYWLCMMPBZFZID-UHFFFAOYSA-N	233.359	1.548	10	20	BDCD	
C[C@H](N[C@H](CO)CCF)c1c(O)cccc1F	886632760	DFWJNPMHJRFDEQ-IUCAKERBSA-N	245.269	1.902	10	20	BDCD	
CCCNC(=O)NCc1ccc(OC)cc1O	792778328	MWHSCBVDDRCTLF-UHFFFAOYSA-N	238.287	1.610	10	20	BDCD	
NCC[C@@H]1CCN(Cc2ccc(N)cc2)C1	1356083523	QYQLHGYPNSELIU-GFCCVEGCSA-N	219.332	1.440	10	20	BDCD	
OC[C@@H]1CCC[C@@H]1NCc1ccccc1O	164763120	OOZNTBHQRFESLJ-RYUDHWBXSA-N	221.300	1.643	10	20	BDCD	
CCN1CCN(Cc2c(C)cccc2O)CC1	876524686	VPNUKLOIZVWFRH-UHFFFAOYSA-N	234.343	1.838	10	20	BDCD	
Cn1cc(CN[C@@H]2CCc3cccc(O)c32)cn1	295836005	FHRHUNZCSPCBHF-GFCCVEGCSA-N	243.310	1.903	10	20	BDCD	
CN1CC[C@@H]1CN[C@H]1CCc2cccc(O)c21	712581803	PSYZIFWNDNLLNS-NEPJUHHUSA-N	232.327	1.673	10	20	BDCD	
COCC1(NCc2cccc(OC)c2O)CC1	697493572	YXYQXXOXCRJZGB-UHFFFAOYSA-N	237.299	1.669	10	20	BDCD	
COc1ccc(CN[C@H](CO)C2CC2)cc1C	734161248	OIFQUQSOYIDLMV-CYBMUJFWSA-N	235.327	1.864	10	20	BDCD	
CCOCCOCCN(C)c1ccc(N)cc1	923399813	GZYMEPPPRKIFPU-UHFFFAOYSA-N	238.331	1.758	10	20	BDCD	
O=C(O)c1cnc(NCc2ccccc2O)nc1	1610863621	PQORRFJIWQUPPR-UHFFFAOYSA-N	245.238	1.493	10	20	BDCD	
CCOc1cccc(CNC[C@H](C)CO)c1O	112017458	YOOKFZVFJVTBEO-JTQLQIEISA-N	239.315	1.509	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@H](C(N)=O)C2)cc1C	54543741	DCDVVEHDAYHIFD-NSHDSACASA-N	248.326	1.316	10	20	BDCD	
Nc1ccc(NC(=O)c2ccc[nH]2)cc1	63063477	TURNHGUNFSXRJC-UHFFFAOYSA-N	201.229	1.849	10	20	BDCD	
CN1CCC(NCc2ccc3c(c2)CCO3)CC1	37363036	MARYOCLELZHXFO-UHFFFAOYSA-N	246.354	1.805	10	20	BDCD	
CNCCCNCc1cc(C)ccc1O	83345528	SCNSGGZVUMLING-UHFFFAOYSA-N	208.305	1.400	10	20	BDCD	
C[C@H](N[C@H]1CCOC1)c1cc(F)ccc1O	87784333	ZROBVWDEYMQABN-WPRPVWTQSA-N	225.263	1.971	10	20	BDCD	
CC(C)(CN[C@@H]1CCc2cccc(O)c21)C(N)=O	296766397	KIAICKZQGBIELF-SNVBAGLBSA-N	248.326	1.481	10	20	BDCD	
CN(CCN)Cc1c(O)ccc(Cl)c1F	841100173	FELRVHDZXKQJFB-UHFFFAOYSA-N	232.686	1.575	10	20	BDCD	
CNC[C@@H](C)NCc1ccc(N(C)C)c(F)c1	853249794	VVJIPAYHGWCBNX-SNVBAGLBSA-N	239.338	1.589	10	20	BDCD	
CC1(COC(=O)c2cccc(O)c2O)COC1	758547386	KLUTWJCTUBIKDS-UHFFFAOYSA-N	238.239	1.291	10	20	BDCD	
COc1ccc(N(C)Cc2cnon2)cc1	852209884	VONCWUQGZHHEFF-UHFFFAOYSA-N	219.244	1.715	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C(C)(F)F)c1	862754627	HQINMEZYPFACHN-UHFFFAOYSA-N	229.226	1.972	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](CO)C2)c(O)c1	876659834	HISFNTPZNJYKRH-LLVKDONJSA-N	221.300	1.515	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)N1CC=CCC1	779546330	NSDYJGWTSZEOAW-ALCCZGGFSA-N	245.278	1.900	10	20	BDCD	
O=C(N[C@H]1CCCOCC1)c1cc(O)cs1	776498341	JXPYZCBDSAVVDG-QMMMGPOBSA-N	241.312	1.753	10	20	BDCD	
CN1CC[C@@H](NCc2ccc3c(c2)CCCO3)C1	386486412	WVZRIKMEJRXMKM-CQSZACIVSA-N	246.354	1.805	10	20	BDCD	
CCN(CCO)Cc1cc(C)cc(OC)c1O	893872282	QBZHHJBDOWIKDT-UHFFFAOYSA-N	239.315	1.523	10	20	BDCD	
CC1(CNCc2ccc(C(=O)O)cc2O)CC1	1776577160	DVDGZJMVCKPOKC-UHFFFAOYSA-N	235.283	1.980	10	20	BDCD	
Cc1ccc(CNCc2cnnn2C)c(O)c1	877534972	RDQUBKFZZIFFRM-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
COc1cccc(CN[C@@]2(C)CCOC2)c1O	120242524	ROOCMPHTNIZJDR-ZDUSSCGKSA-N	237.299	1.669	10	20	BDCD	
CC[C@H](O)CCNCc1ccc2c(c1)CCO2	127390416	YKCPOVLXYWVJDP-ZDUSSCGKSA-N	235.327	1.872	10	20	BDCD	
Cc1cc(O)c(CN2CCO[C@@H]3C[C@@H]32)cc1C	368143251	RVGLAHVIOJPGRC-GXTWGEPZSA-N	233.311	1.982	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC/C=C\CO)c1	717532692	OPYSXNVWTCHTFU-DLRQAJBASA-N	221.300	1.900	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@H]2CCNC2)c1	817944780	LRCLZLLCIOMEPU-QWRGUYRKSA-N	220.316	1.713	10	20	BDCD	
CC(C)(N)CCNCc1cccc(F)c1O	903939185	TTWNZHINDROCBJ-UHFFFAOYSA-N	226.295	1.748	10	20	BDCD	
C[C@@H]1[C@H](C(=O)Nc2ccc(N)cc2)CCN1C	832250024	JOTUGKSRBHFJFH-BXKDBHETSA-N	233.315	1.548	10	20	BDCD	
C[C@@H]1C[C@H](N)CCN1Cc1cccc(F)c1O	846701861	DUANCMORAXKYFR-MWLCHTKSSA-N	238.306	1.843	10	20	BDCD	
C[C@@H]1OCC[C@@]1(C)NC(=O)c1cc(O)cs1	753504976	WRQYHMUYSRPBEU-WRWORJQWSA-N	241.312	1.751	10	20	BDCD	
C[C@H]1CCN1C(=O)c1c(F)ccc(O)c1O	881481817	JRLFBYNEHGBPTB-LURJTMIESA-N	225.219	1.471	10	20	BDCD	
[N-]=[N+]=NCCn1nc(-c2cccnc2)cc1N	409441210	XKLMFMGEUHNIQX-UHFFFAOYSA-N	229.247	1.838	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)NCC1(N)CC1	1262597896	BLPSQEHQMZEUKN-UHFFFAOYSA-N	249.314	1.025	10	20	BDCD	
CN1C[C@@H](N(C)Cc2ccccc2O)CCC1=O	862429002	ZIUWNUDJQDSKQT-LBPRGKRZSA-N	248.326	1.445	10	20	BDCD	
COc1cccc(O)c1CNCc1conc1C	865679083	XKUWUCGQERBEIN-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
Cc1ccc(O)c(CNCCc2cnccn2)c1	389928770	IHSZEDIHIXPPLO-UHFFFAOYSA-N	243.310	1.823	10	20	BDCD	
Cc1c[nH]nc1CNCc1ccc2c(c1)CCO2	716439043	FEHFCLAXTRQQNK-UHFFFAOYSA-N	243.310	1.943	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C[C@H](CO)C2)c1	923003324	FKZVXEOYSHLXLO-UMSPYCQHSA-N	221.300	1.561	10	20	BDCD	
CN(Cc1ccccc1O)[C@H]1CCOC1=O	109769946	GTTAUPDDVZXOKF-JTQLQIEISA-N	221.256	1.140	10	20	BDCD	
CN(CCCCCO)Cc1ccc(N)cc1	51021352	HRXXQVYVXSDRRX-UHFFFAOYSA-N	222.332	1.863	10	20	BDCD	
CCOc1ccc(O)c(CN(C)CCO)c1	127929145	NZVMTTYIRKWYNK-UHFFFAOYSA-N	225.288	1.215	10	20	BDCD	
Cc1ccc(C(=O)Nc2ccnn2C)c(O)c1O	182275215	QSSVUSREVPGWLV-UHFFFAOYSA-N	247.254	1.392	10	20	BDCD	
CC/C=C/CNC(=O)c1c(F)ccc(O)c1O	296027185	VORDNIMHLGWWTR-ONEGZZNKSA-N	239.246	1.933	10	20	BDCD	
CC[C@@H](N[C@H]1CCNC1)c1ccc(F)cc1O	817945164	WARRLEVCSNVKJT-CMPLNLGQSA-N	238.306	1.934	10	20	BDCD	
C[C@@H]1O[C@H](C)C[C@H]1NCCc1ccc(N)cc1	817956797	DBVJPFMIXBEELH-UHIISALHSA-N	234.343	1.967	10	20	BDCD	
C[C@@H](CN)CN[C@@H](C)c1ccccc1O	817961684	CHXFIXBAVWZMKV-UWVGGRQHSA-N	208.305	1.638	10	20	BDCD	
NC1(CNCc2ccc3c(c2)CCCO3)CCC1	904355225	LSFMBXZMMAFVHD-UHFFFAOYSA-N	246.354	1.983	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@@H]1CCO	832544419	ZPNNEAIIOAXKMG-MRVPVSSYSA-N	241.312	1.441	10	20	BDCD	
CCNCCNCc1ccc(N(C)C)cc1C	841035735	LDFIFKDBGGSKIF-UHFFFAOYSA-N	235.375	1.760	10	20	BDCD	
CN(CC(=O)NCC1CCC1)c1ccc(N)cc1	863557015	GTWREKCLWALMKW-UHFFFAOYSA-N	247.342	1.621	10	20	BDCD	
CCO[C@@H](C(=O)NCc1ccccc1O)C1CC1	860233935	PYSNFOJZAXXAMQ-CYBMUJFWSA-N	249.310	1.824	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCC[C@H]2CN)cc1	89147862	QUVALSMNYAEKQX-DZGCQCFKSA-N	247.386	1.970	10	20	BDCD	
CN(Cc1ccccc1O)c1nccc(CO)n1	786793631	POBHTGFPBPGJBO-UHFFFAOYSA-N	245.282	1.311	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC[C@@H](F)C1	1330817908	AKDCLPMWOHTCBF-ZCFIWIBFSA-N	215.249	1.638	10	20	BDCD	
C[C@@H](NC1CC1)C(=O)NCc1ccc(N)cc1	1341923093	IUDJKHBCCGCDNX-SECBINFHSA-N	233.315	1.026	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)C[C@@H](C)O)c1	164504061	CPTHIUNDRQPSNZ-GHMZBOCLSA-N	223.316	1.950	10	20	BDCD	
CN(CCO)Cc1ccc(N(C)C)c(F)c1	127913992	GXEZCQVFRQLEHD-UHFFFAOYSA-N	226.295	1.316	10	20	BDCD	
C[C@@H]1C(=O)NCCN1Cc1ccc(N(C)C)cc1	123385009	AYLPATVYSGDERT-LLVKDONJSA-N	247.342	1.073	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](O)C(C)(C)C2)c1	280554036	UIJVOCZEQYAMMZ-CYBMUJFWSA-N	235.327	1.903	10	20	BDCD	
Cc1cccc(CN(C)[C@H](C)C(=O)O)c1O	821111928	BLUULXBKLCBFHF-SECBINFHSA-N	223.272	1.606	10	20	BDCD	
CO[C@@H](C)CC(=O)NCc1ccc(O)cc1O	910956765	YVOBXRTZRNANDY-QMMMGPOBSA-N	239.271	1.139	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1[C@@H]2CCC[C@@H]12	910950462	FTSSQFVYMLINEQ-GHMZBOCLSA-N	247.294	1.760	10	20	BDCD	
COc1cccc(CN[C@H](C)CCN)c1O	841050993	MFACBJSNIOFSLA-SECBINFHSA-N	224.304	1.228	10	20	BDCD	
Oc1ccc(Cl)cc1CNC[C@H]1CCCN1	841036715	WGRBEZAYUHWODN-LLVKDONJSA-N	240.734	1.887	10	20	BDCD	
CNC[C@@H](C)N[C@H](C)c1cc(OC)ccc1O	854231373	GSKJPQUSAUWNCD-NXEZZACHSA-N	238.331	1.659	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@H](CO)C1	768943321	BBUXBTBLTPRUSQ-QMMMGPOBSA-N	241.312	1.298	10	20	BDCD	
C[C@@H](O)CCN(C)C(=O)c1cc(O)cs1	764324442	NCVHNJIYDWFDKD-SSDOTTSWSA-N	229.301	1.297	10	20	BDCD	
CC[C@H](F)C(=O)NCc1ccc(N)cc1	1122538207	BCYPXCAAESSLTF-JTQLQIEISA-N	210.252	1.633	10	20	BDCD	
Cc1ccc(C(=O)NCc2cocn2)c(O)c1O	780931819	DRMQMBRXPVJTRS-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
Oc1ccccc1CN1CC[C@@H](C2OCCO2)C1	896383885	GDFMPMQGEJJFPT-GFCCVEGCSA-N	249.310	1.587	10	20	BDCD	
Oc1ccc(Cl)cc1CNC[C@H]1C[C@H](O)C1	720907835	RTDUKLTTZOBGFX-JLIMDTESSA-N	241.718	1.906	10	20	BDCD	
C[C@H]1COC[C@@H]1NCc1cc(F)ccc1O	699745848	UQIKLMXBKNDMST-KWQFWETISA-N	225.263	1.656	10	20	BDCD	
C[C@H]1C[C@@H](C)O[C@H]1C(=O)NCc1ccc(N)cc1	1343473117	LBVINNSXBPZOPP-OPQQBVKSSA-N	248.326	1.699	10	20	BDCD	
N[C@H]1CCC[C@H]1NCc1ccc2c(c1)CCO2	259024267	OGXBHZJNOYARLE-QWHCGFSZSA-N	232.327	1.591	10	20	BDCD	
C[C@H](N)[C@@H]1CCN(Cc2ccccc2O)C1	168514854	KXMIPCKVRURRCB-WDEREUQCSA-N	220.316	1.561	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)CCCO1	61912848	BQWQYPRTWLEMNY-LLVKDONJSA-N	220.316	1.880	10	20	BDCD	
CC(=O)NCCCN(C)Cc1ccccc1O	111235784	UMFWPXBENRNZTN-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
C[C@H](N[C@H](C)CCO)c1ccc(F)cc1O	132564482	FVXYZVVNJUXEBA-BDAKNGLRSA-N	227.279	1.953	10	20	BDCD	
Cc1ccc([C@H](C)NC[C@@H](C)CO)c(O)c1	83219202	DMCHHMIEBFEDPQ-MNOVXSKESA-N	223.316	1.980	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCC(C)(C)N)c1	817960567	OKAGZENZMJUEBO-SECBINFHSA-N	238.331	1.789	10	20	BDCD	
CNC[C@H]1CCN(Cc2cccc(F)c2O)C1	843053366	XZYFYXWZAICXCT-SNVBAGLBSA-N	238.306	1.573	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@@H]1CC12CCC2	778918279	KDLPGMRLIBLLJD-JTQLQIEISA-N	247.294	1.904	10	20	BDCD	
CON(C)CCN[C@@H](C)c1c(O)cccc1F	886634864	OQSBGDXBRWNSKW-VIFPVBQESA-N	242.294	1.675	10	20	BDCD	
COC(=O)[C@H]1CCN(Cc2ccccc2O)[C@H]1C	787420565	IYECOHSCTKIPNA-JQWIXIFHSA-N	249.310	1.776	10	20	BDCD	
Cc1ccc(CNC2CCN(C)CC2)c(O)c1	83361139	WEWXYARUQAVRLR-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)C(=O)O)cc1Cl	1574697210	GGSAQLNJDXUXAH-SSDOTTSWSA-N	243.690	1.917	10	20	BDCD	
CN1CC=C(CNCc2ccccc2O)CC1	272100371	VNJPAILKPUUOCU-UHFFFAOYSA-N	232.327	1.744	10	20	BDCD	
CCNC(=O)/C=C/c1ccc(O)c(O)c1	26272748	RJWIODMCPUQQLM-GQCTYLIASA-N	207.229	1.247	10	20	BDCD	
c1csc(Sc2ccc3nnnn3n2)n1	48894068	PQEDKDGPLRWIDR-UHFFFAOYSA-N	236.285	1.127	10	20	BDCD	
CCOCCN(C)Cc1ccccc1O	96868852	WHSJLUCAZYEMSX-UHFFFAOYSA-N	209.289	1.861	10	20	BDCD	
Cc1ccc([C@H](C)NC[C@H](C)CN)c(O)c1	817962048	HFEPSGURSZGYAX-MNOVXSKESA-N	222.332	1.946	10	20	BDCD	
Cc1cc(C)c([C@@H](C)NC2CNC2)c(O)c1	817956205	SZFZXEHQWWYQTC-SNVBAGLBSA-N	220.316	1.631	10	20	BDCD	
C[C@@H](C(=O)O)N(C)Cc1cccc(F)c1O	819896068	RSKPGGBEDKJAIY-ZETCQYMHSA-N	227.235	1.436	10	20	BDCD	
CC[C@@H](CNCc1ccccc1O)C(=O)O	903704858	MTUMWUODSUSVAT-VIFPVBQESA-N	223.272	1.593	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H]1CCCNC1	841043871	YBUWOJJOZLFIIP-CQSZACIVSA-N	247.386	1.903	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)C[C@@H]1O	897681308	QTPLAMHWUUHTPT-UFBFGSQYSA-N	225.263	1.344	10	20	BDCD	
CNC[C@@H](C)CN[C@@H](C)c1ccccc1O	1326036700	UDWHVIOLMQNYLF-MNOVXSKESA-N	222.332	1.898	10	20	BDCD	
Cc1ccc(CN(C)[C@H](C)C(=O)O)c(O)c1	1600410100	HMVJDAKYZVAGRQ-SECBINFHSA-N	223.272	1.606	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC[C@H]2C[C@@H]21	804300712	ZJEZVANOECOHDL-WPRPVWTQSA-N	233.267	1.722	10	20	BDCD	
C[C@H]1C[C@@H]1C(=O)NCc1ccccc1O	136334827	SKJBFURHGSNPQI-WPRPVWTQSA-N	205.257	1.664	10	20	BDCD	
NCCCCNCc1ccc2c(c1)CCO2	37715583	QAHBKOJCDMSPDV-UHFFFAOYSA-N	220.316	1.450	10	20	BDCD	
OCC1(CNCc2ccccc2O)CCC1	184359779	XMDKSYYXDSGQSL-UHFFFAOYSA-N	221.300	1.644	10	20	BDCD	
CC1(C)C[C@@H]1NC(=O)NCc1ccccc1O	263727577	MLFRDUQUOOHPCU-NSHDSACASA-N	234.299	1.990	10	20	BDCD	
Cc1cc(O)c(CNc2nnc(CO)o2)cc1C	275255547	PVUGPRIOQIKKGZ-UHFFFAOYSA-N	249.270	1.496	10	20	BDCD	
CCN(Cc1nnn(C)n1)c1ccc(OC)cc1	281426352	IOCUIQUZTGAOET-UHFFFAOYSA-N	247.302	1.245	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H]3CCN(C)[C@H]3C2)c1	824892879	DNFWGVYJBKGGTL-OCCSQVGLSA-N	246.354	1.837	10	20	BDCD	
O=C(NC[C@H](O)C1CCC1)c1cc(O)cs1	839790261	PQLJUKRMVLWSLP-VIFPVBQESA-N	241.312	1.345	10	20	BDCD	
COc1cccc([C@H](C)NC[C@H](C)O)c1O	846138303	QEOVCYYSVFFBJN-IUCAKERBSA-N	225.288	1.432	10	20	BDCD	
C[C@@H](NC(=O)C1CCOCC1)c1ccccc1O	827923136	KBBOPQADGMVCBG-SNVBAGLBSA-N	249.310	1.996	10	20	BDCD	
CNC[C@@H](C)NCc1c(O)cccc1OC	853248714	IVWYSDLXQDSXSR-SECBINFHSA-N	224.304	1.098	10	20	BDCD	
CN(C)c1ccnc(Nc2ccc(N)cc2)n1	409429906	UGVQBZAEDCOXBR-UHFFFAOYSA-N	229.287	1.868	10	20	BDCD	
COc1ccc(CN[C@H]2CCOC2=O)cc1C	895795974	IWEMDDAGQWHTFS-NSHDSACASA-N	235.283	1.409	10	20	BDCD	
CNC(=O)C[C@@H](C)NCc1ccccc1O	167192883	UKOBEGBESHJVHO-SECBINFHSA-N	222.288	1.006	10	20	BDCD	
C[C@@H]1C[C@@H]1CNC(=O)NCc1ccc(N)cc1	1346191590	OESOVZTXCSDJNQ-MWLCHTKSSA-N	233.315	1.724	10	20	BDCD	
CCOc1ccc(N(C)C[C@H](C)N)cc1	20239538	MCHRTQUTBPNBGE-JTQLQIEISA-N	208.305	1.869	10	20	BDCD	
COC(=O)C(C)(C)CNCc1ccccc1O	167059477	AGGWFZPEEZYJNP-UHFFFAOYSA-N	237.299	1.681	10	20	BDCD	
COC[C@@](C)(CO)NCc1cc(C)ccc1O	716954077	JHTRQQFRBZMSPQ-CYBMUJFWSA-N	239.315	1.188	10	20	BDCD	
CN(C(=O)CSc1nccs1)C1CC1	66409857	OFMXLRSJCZIXQF-UHFFFAOYSA-N	228.342	1.856	10	20	BDCD	
CCCN(C)Cc1cc2c(cc1O)OCO2	63730662	NKHHWAFZBCYECX-UHFFFAOYSA-N	223.272	1.963	10	20	BDCD	
C[C@H](C(=O)NCCc1ccc(O)c(O)c1)C1CC1	122662367	DIGYVCZUACWGFZ-VIFPVBQESA-N	249.310	1.803	10	20	BDCD	
CCOC(=O)CN(Cc1ccc(N)cc1)C1CC1	35081120	XDXUYARMAVENIM-UHFFFAOYSA-N	248.326	1.796	10	20	BDCD	
CC1(CN[C@H]2CCc3cccc(O)c32)OCCO1	296660744	FDQVOYXBEWMOHE-NSHDSACASA-N	249.310	1.732	10	20	BDCD	
Cc1ccc(O)c(CN2[C@@H](C)CNC[C@H]2C)c1	843066378	VXOJVYTXLPHANH-TXEJJXNPSA-N	234.343	1.883	10	20	BDCD	
Oc1cc2c(cc1CN1CCCCC1)[C@H](O)CO2	768438705	XFIFZIAQEZZRGU-CYBMUJFWSA-N	249.310	1.804	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@H]2C[C@]2(CO)C1	877463037	YYMQTQMLMWKSTD-BXUZGUMPSA-N	233.311	1.515	10	20	BDCD	
CO[C@@H]1CN(CCN=[N+]=[N-])C[C@H]1n1ccnc1	409435570	VLLSPEQZZXTPKS-NXEZZACHSA-N	236.279	1.065	10	20	BDCD	
Cc1cccc(CNCCCN(C)C)c1O	83352240	GYRPETILDPFIRR-UHFFFAOYSA-N	222.332	1.742	10	20	BDCD	
CNC[C@@H](C)C(=O)N(C)Cc1ccccc1O	92134795	CFIJWDGWPCHNNF-SNVBAGLBSA-N	236.315	1.206	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCCNC2)cc1	1246170973	PLHGRBNVWXYNKG-GFCCVEGCSA-N	205.305	1.110	10	20	BDCD	
Cc1nnc(N(C)Cc2ccccc2O)o1	804579237	VZUTUURLPFYNCE-UHFFFAOYSA-N	219.244	1.720	10	20	BDCD	
O=C(O)[C@H](CF)NCc1cc(F)c(F)cc1O	1601650898	RRRYMRRVEUPMPX-QMMMGPOBSA-N	249.188	1.183	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCC[C@@H]1N)c1ccccc1O	870988535	SAFYUEUXMXKPBF-JLLWLGSASA-N	248.326	1.697	10	20	BDCD	
COC[C@H](C)NCc1ccc2c(c1)CCO2	37362459	QXOXYNKOGWRUQL-JTQLQIEISA-N	221.300	1.746	10	20	BDCD	
O=C(CSc1nccs1)NCC1CC1	47297740	YRNBFVRDFFMYMI-UHFFFAOYSA-N	228.342	1.761	10	20	BDCD	
Oc1ccccc1CNC[C@H](O)c1ccco1	135559984	NTAGSVITIXLRQH-LBPRGKRZSA-N	233.267	1.808	10	20	BDCD	
CCCN(CC(=O)O)Cc1ccccc1O	83411607	ZUQDTJFHAGNABL-UHFFFAOYSA-N	223.272	1.689	10	20	BDCD	
Oc1c(F)cccc1CNC[C@H]1CCCCN1	841033624	YCOUPOSMSUHCTF-LLVKDONJSA-N	238.306	1.763	10	20	BDCD	
CSC1(C(=O)NCc2ccccc2O)CC1	789816395	OCFRNOIIVOYJOB-UHFFFAOYSA-N	237.324	1.904	10	20	BDCD	
CC(C)(C)[C@@H](NCc1ccccc1O)C(=O)O	395664337	FMVSEIYDPZOWEB-NSHDSACASA-N	237.299	1.981	10	20	BDCD	
CN(C(=O)[C@@H]1C[C@@H]2CC[C@H]1N2)c1ccc(N)cc1	1357946422	XSSGLIZPLNJOIT-CYZMBNFOSA-N	245.326	1.372	10	20	BDCD	
Cc1nnc(CCC(=O)Oc2ccc(N)cc2)o1	1579900458	KFWBNNBLRUTDCS-UHFFFAOYSA-N	247.254	1.498	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccccc2O)CCCNC1	166202886	FZNFDBSJFSWLJW-CQSZACIVSA-N	248.326	1.398	10	20	BDCD	
COc1ccc(O)c(CNCCOC(C)C)c1	168956049	RGJLJRNEKZOBEK-UHFFFAOYSA-N	239.315	1.915	10	20	BDCD	
COc1ccc(N(C)Cc2cnn(C)n2)cc1	844354814	HQBBMSMCEKRROG-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
CC[C@H](CNCc1cccc(OC)c1O)OC	289926689	VTYQZGNYRCPMLM-LLVKDONJSA-N	239.315	1.915	10	20	BDCD	
CCN(CCN)Cc1cc(C)ccc1O	300771255	CUKQVPMIYQVSOR-UHFFFAOYSA-N	208.305	1.481	10	20	BDCD	
CN(Cc1cnn(C)n1)c1ccc(N)cc1	309242835	LDAIQXBGJLWNDM-UHFFFAOYSA-N	217.276	1.034	10	20	BDCD	
C[C@@H](O)CNCc1ccc(N2CCCC2)cc1	37257706	RESAEJOONNSFPW-GFCCVEGCSA-N	234.343	1.757	10	20	BDCD	
CC[C@H](C)NC(=O)c1cccc(O)c1O	126191059	INJAXIIOTUAGLB-ZETCQYMHSA-N	209.245	1.626	10	20	BDCD	
Cc1cccc(CN2CC[C@H](C)[C@@H]2CO)c1O	191181084	NWQFSAFSAFKIFK-GWCFXTLKSA-N	235.327	1.903	10	20	BDCD	
Cc1cc(O)c(CNC2CCNCC2)cc1C	841026847	SKHPGLQFCDTPMV-UHFFFAOYSA-N	234.343	1.851	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)CCCN	843050690	PMPDUCGBSWHIKR-UHFFFAOYSA-N	235.375	1.842	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@@H](CO)C1	768943303	BBUXBTBLTPRUSQ-MRVPVSSYSA-N	241.312	1.298	10	20	BDCD	
Nc1ccc(CN2CCC[C@H](O)C2)cc1	36798428	SKMXFCWLTWDGCV-LBPRGKRZSA-N	206.289	1.226	10	20	BDCD	
COc1cc(C)cc(CN[C@H](C)CCO)c1O	894284641	RQUOAELJMMKPJE-SNVBAGLBSA-N	239.315	1.570	10	20	BDCD	
CO[C@@H]1COC[C@@H]1N[C@H](C)c1ccccc1O	840824848	QFSQDXWWDBEWHG-SUZMYJTESA-N	237.299	1.457	10	20	BDCD	
Cc1ccc(CN2CCOC[C@H]2C)c(O)c1	876610851	KEDJJIOIGAAZNH-LLVKDONJSA-N	221.300	1.921	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@H]1C[C@@H]1C(=O)O	1593303161	DGQRJLQGOSIMFY-GDPRMGEGSA-N	235.283	1.591	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1CCCC1	26276873	LUQXEZRPCVWLEH-GQCTYLIASA-N	233.267	1.733	10	20	BDCD	
C[C@H](N[C@H]1CCCNC1)c1ccccc1O	817939747	BMYSOVIDKKVCGA-QWRGUYRKSA-N	220.316	1.795	10	20	BDCD	
CCOC(=O)[C@H](C)NCc1cccc(C)c1O	83364806	BETKFKFPVGNNSI-JTQLQIEISA-N	237.299	1.742	10	20	BDCD	
CCOc1cccc(CN(C)CCCN)c1O	133735513	SNUCLYBVQPMNLK-UHFFFAOYSA-N	238.331	1.572	10	20	BDCD	
C[C@]1(C(=O)Nc2ccc(N)cc2)CCNC1	237772593	BSUMEUHLPWSUQB-LBPRGKRZSA-N	219.288	1.207	10	20	BDCD	
C[C@H]1OCC[C@@]1(C)NC(=O)Nc1ccc(N)cc1	235703249	BSSTUCMMGFMUNW-NOZJJQNGSA-N	249.314	1.958	10	20	BDCD	
Cc1cccc(CN2CCn3cncc3C2)c1O	291514455	IONBHQHSOKEFNG-UHFFFAOYSA-N	243.310	1.913	10	20	BDCD	
NC[C@@H](NCc1cccc(Cl)c1O)C1CC1	841029676	YDXTWMFSLHUHNI-LLVKDONJSA-N	240.734	1.873	10	20	BDCD	
COC/C(C)=C\C(=O)N(C)Cc1ccccc1O	845790761	CWITVGDBFMVPLF-FLIBITNWSA-N	249.310	1.943	10	20	BDCD	
C[C@H]1C[C@@H](NCc2cc(F)ccc2O)CCN1	841062932	ZMOZHXMWGBPUSZ-CABZTGNLSA-N	238.306	1.761	10	20	BDCD	
C[C@@H](NC[C@H]1CCC(=O)O1)c1ccccc1O	879649572	WIOLWSFETJTVBO-NXEZZACHSA-N	235.283	1.748	10	20	BDCD	
CC1(C(=O)NCc2ccccc2O)CCOCC1	726798625	GZNCSIXSPSQBJI-UHFFFAOYSA-N	249.310	1.825	10	20	BDCD	
Cc1ccc(CNCC(=O)NC(C)C)c(O)c1	876881805	PTIYIEOOTMJXDP-UHFFFAOYSA-N	236.315	1.315	10	20	BDCD	
COCCN[C@H](C)c1ccc(F)cc1O	62744697	STNRTYCKGNRJTQ-MRVPVSSYSA-N	213.252	1.828	10	20	BDCD	
COC(=O)[C@@H](C)NCc1ccccc1O	42303999	GFYYFTHUQFUFNK-MRVPVSSYSA-N	209.245	1.043	10	20	BDCD	
CN1CCN(Cc2cc(Cl)ccc2O)CC1	82306180	GPZFTHSNSQIGTO-UHFFFAOYSA-N	240.734	1.793	10	20	BDCD	
Nc1ccc(CC(=O)NOCC(F)(F)F)cc1	135263352	XIIXTEMFFIQXEW-UHFFFAOYSA-N	248.204	1.421	10	20	BDCD	
Cc1cccc(CNCC2(CC(N)=O)CC2)c1O	817411650	WXDHLJLUOLPDAT-UHFFFAOYSA-N	248.326	1.446	10	20	BDCD	
CCNCCN[C@H](C)c1cc(F)cc(F)c1O	817952809	UFYPZYLYJSGDOK-MRVPVSSYSA-N	244.285	1.931	10	20	BDCD	
CCOc1ccc(CNCCC(=O)O)c(O)c1	818240063	MTIIDVQQCCLNAD-UHFFFAOYSA-N	239.271	1.355	10	20	BDCD	
COc1cccc(CNC(=N)NC2CCC2)c1O	849002669	OMXKKZSAHLVRFI-UHFFFAOYSA-N	249.314	1.567	10	20	BDCD	
O=C(NCc1cc[nH]n1)NCc1ccccc1O	748458682	AUSSFZPMSQYNKH-UHFFFAOYSA-N	246.270	1.115	10	20	BDCD	
Cc1cc(O)c(CNCCN2CCC2)cc1C	752099993	FFUDFKZKDCRJSY-UHFFFAOYSA-N	234.343	1.804	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCO[C@@H]2C)c1	862757868	GXVFXQLDVFRQQG-ZYHUDNBSSA-N	249.310	1.742	10	20	BDCD	
Oc1ccccc1CN1CCc2c[nH]nc2C1	779017784	BPRBOSGAYIALEO-UHFFFAOYSA-N	229.283	1.674	10	20	BDCD	
C[C@H](NC[C@@H](O)C(F)(F)F)c1ccccc1O	228791599	MJQPSMBSCAOCDA-OIBJUYFYSA-N	249.232	1.966	10	20	BDCD	
COc1ccc(CNC(C)(C)C(=O)O)cc1C	258840104	QWFFBRBYIYOJMX-UHFFFAOYSA-N	237.299	1.956	10	20	BDCD	
C[C@H]1CCNC[C@H]1NCc1ccc(N(C)C)cc1	841059396	RMGNIIKWWRGANC-SWLSCSKDSA-N	247.386	1.840	10	20	BDCD	
Oc1ccc(Cl)cc1CNCCN1CCC1	309505108	MVGMMZSWEQWSQH-UHFFFAOYSA-N	240.734	1.841	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC[C@@H](C)CO)c1	86629176	KKTRZHYDABDAFJ-NXEZZACHSA-N	239.315	1.680	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1CCC1	272375004	DYAAQRBSAIVRFU-HWKANZROSA-N	219.240	1.343	10	20	BDCD	
C[C@@H](CF)NC(=O)NCc1ccccc1O	287609590	ROYBQYGKCNQGGB-QMMMGPOBSA-N	226.251	1.549	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(C)c(F)c1	808491826	STZXAAYYAMSDBZ-UHFFFAOYSA-N	238.214	1.449	10	20	BDCD	
CN(C)c1ccc2c(c1)OCCN2CC(=O)O	818390701	GZPPYCJQBWDKAR-UHFFFAOYSA-N	236.271	1.036	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](N)[C@@H](C)C2)c1O	843053090	YMDUMSBVQDQNOW-WCQYABFASA-N	234.343	1.870	10	20	BDCD	
Oc1c(F)cccc1CNCCCNC1CC1	841093498	UEIZGXNRYANDSG-UHFFFAOYSA-N	238.306	1.763	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2[C@@H]3CNC[C@@H]32)cc1F	841078535	UNVNWVTZQQGJSO-YABSGUDNSA-N	249.333	1.199	10	20	BDCD	
CN1CCCN(C(=O)c2cc(O)cs2)CC1	854178291	ZQSHQBMIIVZKBR-UHFFFAOYSA-N	240.328	1.231	10	20	BDCD	
COc1cc(CN(C)OC)c(O)cc1C	768441454	LPYFFOYABQLCGY-UHFFFAOYSA-N	211.261	1.702	10	20	BDCD	
[N-]=[N+]=NCCn1nc(-c2cnccn2)cc1N	409439208	OIQXHIBBNZZVQL-UHFFFAOYSA-N	230.235	1.233	10	20	BDCD	
COc1ccc(CNC(=O)[C@H]2C[C@@H]2C)c(O)c1	794373174	INVIKXCFSMYPJJ-KWQFWETISA-N	235.283	1.673	10	20	BDCD	
CO[C@@H](C)CNCc1cc(F)cc(F)c1O	708393267	AUEKEUBXOFPTKQ-ZETCQYMHSA-N	231.242	1.795	10	20	BDCD	
COCCN(C)Cc1c(O)cccc1OC	768241225	PFLOEQUYWNKILF-UHFFFAOYSA-N	225.288	1.479	10	20	BDCD	
C[C@H]1C[C@@H](NCc2cc(F)ccc2O)CO1	402183630	BQCFVGZFAGROPQ-GZMMTYOYSA-N	225.263	1.798	10	20	BDCD	
CCc1cccc(CN[C@@H](CO)COC)c1O	691512843	NZSZOUKJPXCMOL-LBPRGKRZSA-N	239.315	1.052	10	20	BDCD	
CCc1nnc(CN(C)Cc2ccccc2O)o1	109773616	UJMYTOTVMNAIQN-UHFFFAOYSA-N	247.298	1.970	10	20	BDCD	
Nc1ccc(CC(=O)NCCC(F)(F)F)cc1	63098549	GCZXNAJXMGBYCU-UHFFFAOYSA-N	246.232	1.880	10	20	BDCD	
CC1(C)[C@@H](O)C[C@H]1NCc1ccc2c(c1)CCO2	129577972	ZCALMRZPUBUJTQ-KGLIPLIRSA-N	247.338	1.871	10	20	BDCD	
C[C@@H](NCC1(CO)CC1)c1ccccc1O	154741879	QATNFOVSOLLTIC-SNVBAGLBSA-N	221.300	1.815	10	20	BDCD	
C[C@H](NC(=O)NCc1ccccc1O)C1CC1	299483962	HRDBDLRSTGPRQL-VIFPVBQESA-N	234.299	1.990	10	20	BDCD	
CC[C@@H]1CN(C(=O)c2cc(O)cs2)CCO1	732266444	BNYUOBVRXSZFJX-SECBINFHSA-N	241.312	1.705	10	20	BDCD	
CCOc1ccc(CNC[C@@H](N)CC)c(O)c1	841070584	REIMDTZNUAEDFC-NSHDSACASA-N	238.331	1.618	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H]1CCNC1	841045326	SVVBEJPBXMBIND-CYBMUJFWSA-N	233.359	1.513	10	20	BDCD	
CC[C@@H](N)CNCc1cccc(F)c1O	841071393	FTAHEMBXOHZEQD-SECBINFHSA-N	212.268	1.358	10	20	BDCD	
C[C@H](O)CNCc1ccc2c(c1)CCCN2C	50286479	BEHMIXQSJCJYLQ-NSHDSACASA-N	234.343	1.539	10	20	BDCD	
OCCCN(Cc1ccccc1O)C1CC1	779020492	VEKKKJRSEGCZFU-UHFFFAOYSA-N	221.300	1.739	10	20	BDCD	
Cc1cnn(C)c1/C=C1/SC(=S)NC1=O	794687042	FBVDIGFFZJZXBI-XVNBXDOJSA-N	239.325	1.217	10	20	BDCD	
Cn1cc(NC(=O)NCc2ccccc2O)cn1	748442362	JFVOQOHVYSCOCZ-UHFFFAOYSA-N	246.270	1.447	10	20	BDCD	
CC[C@@H](NCc1ccccc1O)C(=O)NC	697888988	KBAVPDUXTCIQJO-SNVBAGLBSA-N	222.288	1.006	10	20	BDCD	
CCc1nc(CN[C@H](C)c2ccccc2O)n[nH]1	274564204	CYMVXTPQDCPPBF-SECBINFHSA-N	246.314	1.924	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCOC1	66918520	AKUNFEMBGLLAOC-LLVKDONJSA-N	235.283	1.387	10	20	BDCD	
COc1ccc(N(C)CCCO)c(OC)c1	49820094	VNFJEEIDHYBCGL-UHFFFAOYSA-N	225.288	1.522	10	20	BDCD	
C[C@@H](O)C(=O)NCc1ccc2c(c1)CCCN2C	270807564	OTSJVMHJYVYYDO-SNVBAGLBSA-N	248.326	1.066	10	20	BDCD	
CCN(C)C(=O)COc1ccc(N(C)C)cc1	289474194	XIGSYQVCBGHMMG-UHFFFAOYSA-N	236.315	1.610	10	20	BDCD	
CCO[C@@H]1COC[C@H]1NCc1ccccc1O	825197212	VERMVHLNMGJCQL-DGCLKSJQSA-N	237.299	1.286	10	20	BDCD	
CCNC(=O)NCc1cc(C)ccc1O	858086912	POKUDYSIKACVCE-UHFFFAOYSA-N	208.261	1.520	10	20	BDCD	
CCOc1ccc(CN2CC[C@@H](O)C2)c(O)c1	768238382	ZCIJCJORUUHJEV-LLVKDONJSA-N	237.299	1.358	10	20	BDCD	
Cc1cccc(O)c1CN(C)Cc1nc[nH]n1	876748483	CXTKVJACQUFGMQ-UHFFFAOYSA-N	232.287	1.451	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2F)c1	1123941176	WRSYRKRLVBNGEU-NXEZZACHSA-N	223.247	1.675	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C[C@@H](C)O)c1	164503942	CPTHIUNDRQPSNZ-WDEREUQCSA-N	223.316	1.950	10	20	BDCD	
C[C@@H](NCc1ccc(N(C)C)cc1)[C@H]1CCCN1	400714369	FHLTUKRMAUATTN-IUODEOHRSA-N	247.386	1.983	10	20	BDCD	
COC(=O)NCc1ccc(N(C)C)cc1	82254760	UZLONUZRERPKEM-UHFFFAOYSA-N	208.261	1.609	10	20	BDCD	
CC[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(N)=O	379212073	FJHDJWYREYHCFS-MFKMUULPSA-N	249.358	1.667	10	20	BDCD	
C[C@H](O)CN[C@H](C)c1cc(F)cc(F)c1O	134899880	OCEFYCUWARQNOH-NKWVEPMBSA-N	231.242	1.702	10	20	BDCD	
C[C@@H]1OCC[C@@]1(O)CNCc1ccccc1O	227976210	GVMJINDZUHHTOR-GXFFZTMASA-N	237.299	1.022	10	20	BDCD	
CN1CCC[C@@H](CNCc2ccccc2O)C1	44535358	BTCPKWITVRYGRB-LBPRGKRZSA-N	234.343	1.824	10	20	BDCD	
Cn1cnc(C(=O)NCc2ccccc2O)c1	230185003	TYKHGGMWIARKTE-UHFFFAOYSA-N	231.255	1.056	10	20	BDCD	
CO[C@@H]1CCCN(Cc2ccc(N)cc2)C1	230226489	XGZDGUFAMPJFCB-CYBMUJFWSA-N	220.316	1.880	10	20	BDCD	
COc1cc(O)c(CN[C@H](C)CF)cc1OC	289247164	ASGBKBGWCHUWTA-MRVPVSSYSA-N	243.278	1.857	10	20	BDCD	
CC(=O)C(=O)COc1ccsc1C(C)=O	808033697	NNTHDORUUZVINS-UHFFFAOYSA-N	226.253	1.488	10	20	BDCD	
CC[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccccc1O	817977179	DHIHXVWLBQTNSS-CZXHOFHRSA-N	232.327	1.651	10	20	BDCD	
CN(CCCN)Cc1c(O)ccc(Cl)c1F	843051041	WQWUXWYVXMPXDQ-UHFFFAOYSA-N	246.713	1.965	10	20	BDCD	
COC[C@H](C)CNC(=O)Cc1ccc(N)cc1	45660580	MBNDUQCFPYQZBC-SNVBAGLBSA-N	236.315	1.210	10	20	BDCD	
C[C@@H](CN)NCc1cccc(Cl)c1O	841062785	GDVWGDWBEOWAGN-ZETCQYMHSA-N	214.696	1.482	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC(n2ccnc2)C1	750237188	WZGFYTFXFVNZRI-UHFFFAOYSA-N	249.295	1.347	10	20	BDCD	
O=C(NCCC1CSC1)c1cc(O)cs1	854975151	LLYODZUTCAQRQA-UHFFFAOYSA-N	243.353	1.937	10	20	BDCD	
CC1(NC(=O)/C=C/c2ccc(O)c(O)c2)COC1	870664775	YKQDAHWCNQMPLC-HWKANZROSA-N	249.266	1.016	10	20	BDCD	
CCO[C@H]1CCN(C(=O)c2cc(O)cs2)C1	885332074	DOSSQHYSQKTEIR-VIFPVBQESA-N	241.312	1.705	10	20	BDCD	
C[C@H](O)CNCc1ccc2c(c1)CCCO2	82538503	VLVKVLIACPGYNN-JTQLQIEISA-N	221.300	1.482	10	20	BDCD	
C[C@H](CCO)N(C)Cc1cc(F)cc(F)c1O	895149179	CTCLTFOBHHPOCP-MRVPVSSYSA-N	245.269	1.873	10	20	BDCD	
COc1cccc(CNCc2ncc(C)[nH]2)c1O	693493890	ZPVJRHZITOHYOE-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
C[C@@H](CO)N[C@H](C)c1cc(C(=O)O)ccc1O	1593353491	YEBWLOHBIWUVIV-JGVFFNPUSA-N	239.271	1.122	10	20	BDCD	
Cc1ccc(CNC[C@H]2CCCNC2=O)c(O)c1	877586937	YLATXURFIABTTC-GFCCVEGCSA-N	248.326	1.316	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C2CCC1CC2	398937514	IENAPOHPRAMOFE-UHFFFAOYSA-N	233.267	1.865	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1CCNC1	843357326	INUPKRWIXVXEFO-LLVKDONJSA-N	220.316	1.434	10	20	BDCD	
Nc1ccnc(CSc2nccs2)n1	307539425	QFXMKVSSCMBOEU-UHFFFAOYSA-N	224.314	1.808	10	20	BDCD	
COc1ccc(O)c(CN2CCC[C@H]2CO)c1	179845023	OXUWXHSZPZDCII-NSHDSACASA-N	237.299	1.358	10	20	BDCD	
C[C@@H](NCc1ccccc1O)[C@H]1CCOC1	127042852	UKCTUNZLCHDHGP-PWSUYJOCSA-N	221.300	1.907	10	20	BDCD	
CNC(=O)CN(C)c1ccc(OC)c(Cl)c1	131444961	OICVCXVGQCRDPB-UHFFFAOYSA-N	242.706	1.531	10	20	BDCD	
C[C@H](NC(=O)CC(=O)O)c1ccccc1O	381469165	MATVVNYVFJSVBO-ZETCQYMHSA-N	223.228	1.044	10	20	BDCD	
C[C@H](N)CCN[C@@H](C)c1ccccc1O	817952226	IRJLRNSTGUMCKE-UWVGGRQHSA-N	208.305	1.780	10	20	BDCD	
C[C@@H](CN)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O	817969891	HSBGQOJGUUCJRH-YUMQZZPRSA-N	239.275	1.298	10	20	BDCD	
C[C@H](NC[C@H]1CCN1C)c1c(O)cccc1F	903316348	OCHASULLHVTJEC-VHSXEESVSA-N	238.306	1.886	10	20	BDCD	
N[C@@]12CCC[C@H]1CN(Cc1ccccc1O)C2	857226540	QUCPGBJOYHLZPH-GXTWGEPZSA-N	232.327	1.705	10	20	BDCD	
c1cc2c(cc1CN[C@@H]1CCOC1)CCCO2	921930975	WXWQTNSJJMDTOF-CYBMUJFWSA-N	233.311	1.890	10	20	BDCD	
COc1cccc(CN[C@@H]2CCO[C@@H]2C)c1O	134247226	AAENLCDLRXBGHD-MWLCHTKSSA-N	237.299	1.668	10	20	BDCD	
Oc1ccc(Cl)cc1CNC[C@H](O)C1CC1	70880908	RAIQJKRIBQUSSJ-LBPRGKRZSA-N	241.718	1.906	10	20	BDCD	
CCn1ncnc1CNCc1ccccc1O	228413823	JMHBFCPJILCFFX-UHFFFAOYSA-N	232.287	1.293	10	20	BDCD	
CC(C)[C@H](NCc1ccc2c(c1)CCO2)C(=O)O	43431328	LFSQKJCPABNEQC-ZDUSSCGKSA-N	249.310	1.820	10	20	BDCD	
CC[C@@](C)(O)CNCc1ccc2c(c1)CCO2	96478847	SZXLIDWDOZATJG-CQSZACIVSA-N	235.327	1.872	10	20	BDCD	
Nc1ccc(CN2CC[C@@](F)(CO)C2)cc1	1120370957	KZGFZNGIBQTFBG-LBPRGKRZSA-N	224.279	1.175	10	20	BDCD	
CC[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(C)cc1O	817977231	FDZSPMGZRZYSRG-SFDCQRBFSA-N	246.354	1.959	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)c1ncc[nH]1	817956757	CEZXVQSHYVOATR-JTQLQIEISA-N	230.315	1.885	10	20	BDCD	
NC[C@@H]1CC[C@@H](NCc2ccccc2O)C1	724090549	SAZYQIYSHTUEAV-ZYHUDNBSSA-N	220.316	1.609	10	20	BDCD	
C[C@]1(CNCc2ccccc2O)CCC(=O)N1	835059828	DXAFVEJOFDEYCU-CYBMUJFWSA-N	234.299	1.151	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2C[C@H](N)C2)cc1C	906507782	BYUJQBCWVIBMPJ-HAQNSBGRSA-N	220.316	1.588	10	20	BDCD	
COCCCc1nc(Cc2ccc(N)cc2)no1	843158711	HSHLCRXCSZAJBK-UHFFFAOYSA-N	247.298	1.822	10	20	BDCD	
COc1cccc(O)c1CNC/C=C\CO	850358032	ZRFDDFAJGGPTQD-IHWYPQMZSA-N	223.272	1.039	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1CCCNC1	841032660	IRETYQPLQSGJAZ-JTQLQIEISA-N	238.306	1.621	10	20	BDCD	
COc1ccc(O)c(CNC2CCNCC2)c1	841026499	FFLVJTYRMFHBSI-UHFFFAOYSA-N	236.315	1.242	10	20	BDCD	
CNC[C@H](C)N[C@H](C)c1ccc(F)cc1O	854231101	DTCFXQOFXRBPGM-DTWKUNHWSA-N	226.295	1.790	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C[C@H]2CCOC2)c1	862757063	GDVIKKJQMNRHKO-LLVKDONJSA-N	249.310	1.743	10	20	BDCD	
C[C@H]1[C@@H](O)CCN1Cc1ccc(N)cc1	1579508238	YTIIFTGOXITBEI-CABZTGNLSA-N	206.289	1.224	10	20	BDCD	
CN(Cc1ccc(N)cc1)[C@@H]1CCNC1	1334774751	MUQXGLQOBLMUCK-GFCCVEGCSA-N	205.305	1.063	10	20	BDCD	
C[C@@H](CC(N)=O)NCc1ccc2c(c1)CCCO2	921863395	VGXVIWIVTBWWOJ-JTQLQIEISA-N	248.326	1.365	10	20	BDCD	
CCOCCNCc1cc(C)ccc1O	70955209	LPXHDOSPZSJHQO-UHFFFAOYSA-N	209.289	1.827	10	20	BDCD	
C[C@@H](N[C@H](C)c1ccccc1O)C(=O)O	49353277	APSSINNZPFUMQH-HTQZYQBOSA-N	209.245	1.516	10	20	BDCD	
Cc1cccc(CN2CC[C@H]([C@@H](C)O)C2)c1O	272568230	VHBPEGLBXDRAEN-NEPJUHHUSA-N	235.327	1.903	10	20	BDCD	
COCCC(C)(C)NC(=O)c1cc(O)cs1	802579632	DRTPXYGXELLZKV-UHFFFAOYSA-N	243.328	1.999	10	20	BDCD	
C[C@@H](CN)CN[C@@H]1CCc2cccc(O)c21	817963905	YBKNCGLKGQRWFR-GXSJLCMTSA-N	220.316	1.564	10	20	BDCD	
CN(C(=O)/C=C/c1cnn(C)c1)c1cccnc1	733968976	ZJEIHLHXESJIKG-AATRIKPKSA-N	242.282	1.491	10	20	BDCD	
C[C@@H](NC(=O)NCc1ccc(N)cc1)C1CC1	1337623284	XPZARSQTINFIAW-SECBINFHSA-N	233.315	1.867	10	20	BDCD	
O=C(c1cc(O)cs1)N(CCO)CC1CC1	765242538	SGGCNUZDQBYMMZ-UHFFFAOYSA-N	241.312	1.298	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1=CCOCC1	769711449	QZUPEGDMOFLMMH-UHFFFAOYSA-N	247.294	1.697	10	20	BDCD	
C[C@@H](O)CN(C)Cc1cc(Cl)cc(F)c1O	776521803	UNNVBAISOWFRPL-SSDOTTSWSA-N	247.697	1.997	10	20	BDCD	
COC[C@H]1CN(C(=O)CN=[N+]=[N-])CC12CCC2	409427922	FUKATKRMOLFLCS-SECBINFHSA-N	238.291	1.572	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccccc2O)CCOC1	687410018	MKEPSJFXKZBILM-CYBMUJFWSA-N	235.283	1.435	10	20	BDCD	
CN[C@H]1CCCN(Cc2ccc(N)cc2)C1	1334775457	YHMILKHXUWOLKS-ZDUSSCGKSA-N	219.332	1.453	10	20	BDCD	
CCN1C[C@@H](NCc2ccc(C)cc2O)CC1=O	877566892	BNJRGGNUFSYVLL-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
Cc1cc(NC(=O)c2cccc(O)c2O)nn1C	305890606	XJPKAQWYKZUVON-UHFFFAOYSA-N	247.254	1.392	10	20	BDCD	
CC[C@@H](C)NC(=O)c1cccc(O)c1O	126190874	INJAXIIOTUAGLB-SSDOTTSWSA-N	209.245	1.626	10	20	BDCD	
OCCCCCNCc1cc(F)ccc1O	83355412	DKBABUFBXROPID-UHFFFAOYSA-N	227.279	1.784	10	20	BDCD	
CC1(CNCc2ccc3c(c2)CCO3)COC1	83523157	GUHHGZJCGQUCOP-UHFFFAOYSA-N	233.311	1.748	10	20	BDCD	
CC[C@@H]1C[C@H]1NC(=O)c1ccc(C)c(O)c1O	281752076	HYTPXFRNEIKAFX-PSASIEDQSA-N	235.283	1.935	10	20	BDCD	
CCOc1cccc(CN[C@H]2CCNC2)c1O	841045088	OFGVIADWYRCUCC-NSHDSACASA-N	236.315	1.242	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCCO	840935734	BWABIXJQXNAREX-UHFFFAOYSA-N	208.305	1.143	10	20	BDCD	
COCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O	756339206	CJDXCMDCRLDQFL-QMMMGPOBSA-N	240.259	1.597	10	20	BDCD	
COC1(C(=O)NCc2cc(C)ccc2O)CCC1	862757330	PLGLZTPLXSRVRW-UHFFFAOYSA-N	249.310	1.886	10	20	BDCD	
CC[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@H]1O	760978887	CRLMGALHHGWRGG-VXNVDRBHSA-N	241.312	1.297	10	20	BDCD	
COC(=O)C1(C(=O)N(C)c2ccc(N)cc2)CC1	877076246	OYRUPEBTSPMKAE-UHFFFAOYSA-N	248.282	1.185	10	20	BDCD	
C[C@@H](N[C@H]1CCCN(C)C1=O)c1ccccc1O	707764254	ZUKHDPDGGBZLLL-PWSUYJOCSA-N	248.326	1.664	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@H]2C[C@H](N)C2)cc1	693619541	KHCNLKQVVCQZPS-HAQNSBGRSA-N	247.342	1.106	10	20	BDCD	
CC1(NC(=O)/C=C\c2ccc(O)c(O)c2)CC1	1254338819	OWBGPGKXWSFPKF-HYXAFXHYSA-N	233.267	1.780	10	20	BDCD	
C[C@@](O)(C(=O)NCc1ccc(N)cc1)C1CCC1	1343579307	ZQMUOTIQUKOXIM-AWEZNQCLSA-N	248.326	1.436	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCOC2)c1O	162872115	IRMUPONZZVJBKU-LLVKDONJSA-N	207.273	1.579	10	20	BDCD	
Cc1cccc(O)c1CNCCC1(CO)CC1	877571326	VFJMDWDAWOSOPO-UHFFFAOYSA-N	235.327	1.953	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@@H](C2CC2)C1	365967416	LZSLDDRVFMGPTL-SNVBAGLBSA-N	247.294	1.970	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1ccncn1	397014155	OTBJUQDLAZZBEY-UHFFFAOYSA-N	243.266	1.454	10	20	BDCD	
CC[C@@H](NCCOCCO)c1ccccc1O	20198900	RRKHTSQVELCDHR-GFCCVEGCSA-N	239.315	1.442	10	20	BDCD	
CCOC(=O)CN(C)Cc1cccc(C)c1O	179672863	XIMVBBCUBGCEDA-UHFFFAOYSA-N	237.299	1.696	10	20	BDCD	
COC(=O)[C@@H](C)NCc1ccc(N(C)C)cc1	42303891	PRSDWRZFCDQMCP-SNVBAGLBSA-N	236.315	1.404	10	20	BDCD	
COc1ccc(O)c(CN2CCOC[C@H]2C)c1	132172051	AOZFFBLRWHGKAX-SNVBAGLBSA-N	237.299	1.622	10	20	BDCD	
CCN(CC)c1ccc(CNC(=O)CO)cc1	294576421	UULBKLIJGIQXHK-UHFFFAOYSA-N	236.315	1.141	10	20	BDCD	
COC1CN(Cc2ccc(N(C)C)cc2)C1	839128699	SICIWGJIONBEJC-UHFFFAOYSA-N	220.316	1.583	10	20	BDCD	
Oc1cc2c(cc1CN1CC[C@H]3C[C@@H]3C1)OCO2	853581669	WXJYUGCPYSAQGL-VHSXEESVSA-N	247.294	1.963	10	20	BDCD	
O=CN1CCC(NCc2ccccc2O)CC1	774162597	QEZUKANTYLTNTB-UHFFFAOYSA-N	234.299	1.103	10	20	BDCD	
CC1=NO[C@@H](CNCc2cccc(C)c2O)C1	895307066	NYODNHDQYHYELB-GFCCVEGCSA-N	234.299	1.955	10	20	BDCD	
CN(C)C1(CNCc2ccccc2O)CC1	397767804	KORNDMSJNNSVFL-UHFFFAOYSA-N	220.316	1.576	10	20	BDCD	
CCc1cccc(CNCCn2cccn2)c1O	691450620	XSCIYZBPWBETLO-UHFFFAOYSA-N	245.326	1.941	10	20	BDCD	
COc1cc(C)cc(CNC(C)(C)CN)c1O	1579144866	JWJRQIGMGQOADK-UHFFFAOYSA-N	238.331	1.536	10	20	BDCD	
CCCNC(=O)CCC(=O)Nc1ccc(N)cc1	160425538	WNQDNFQZOCZRGR-UHFFFAOYSA-N	249.314	1.514	10	20	BDCD	
CCOC(=O)c1cnc(SC2COC2)s1	309006350	NGCMPPGXJOJHIY-UHFFFAOYSA-N	245.325	1.811	10	20	BDCD	
CCn1cc(CNCc2cccc(C)c2O)nn1	404517851	XUHJKYOOLBRYBA-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
CC[C@@H](O)CCNCc1cc(F)cc(F)c1O	708487593	ZEXHMHADTWTGMR-SNVBAGLBSA-N	245.269	1.921	10	20	BDCD	
Cc1cccc(CN[C@H](CO)CC2CC2)c1O	776251983	GUMOENMZPYXTFE-ZDUSSCGKSA-N	235.327	1.951	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCCC1	126189332	YDQWTYXCSTZEII-UHFFFAOYSA-N	207.229	1.334	10	20	BDCD	
C[C@@H](NCC(=O)N(C)C)c1ccc(N(C)C)cc1	37254255	CFZQIFYCVROCGY-LLVKDONJSA-N	249.358	1.491	10	20	BDCD	
CC(=O)c1cc(F)cc(Cn2ccnc2)c1O	79396634	WKYGCGFTVWXZLV-UHFFFAOYSA-N	234.230	1.979	10	20	BDCD	
NC1(C(=O)NCc2ccccc2O)CCCCC1	228422227	HUUUQTXLIQINMU-UHFFFAOYSA-N	248.326	1.670	10	20	BDCD	
COc1cccc(CN(C)[C@H](C)CN)c1O	383002063	VHTSFIKQYYLDDL-SECBINFHSA-N	224.304	1.180	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](O)C1)c1cc(F)ccc1O	295907316	IYUCEQYNSRSHPF-UJNFCWOMSA-N	225.263	1.705	10	20	BDCD	
O=C(NCc1ccccc1O)C1CCC(O)CC1	281671813	TZCQQGRHEPVTCT-UHFFFAOYSA-N	249.310	1.560	10	20	BDCD	
COc1ccc(O)c(CNCCC(C)(C)N)c1	903938871	NZUFJRMUDVDJOP-UHFFFAOYSA-N	238.331	1.618	10	20	BDCD	
NC[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1	50245125	SQZWEWHZIIVYDR-VIFPVBQESA-N	240.734	1.826	10	20	BDCD	
CCOCCC(=O)NCc1cc(C)ccc1O	862759748	IGXJZVTXCJHLNW-UHFFFAOYSA-N	237.299	1.743	10	20	BDCD	
C[C@@H](O)[C@H]1CCCCN1C(=O)CN=[N+]=[N-]	409424649	CNFSTFGEOAEKIY-HTQZYQBOSA-N	212.253	1.059	10	20	BDCD	
CCN(CC(=O)O)Cc1cc(F)cc(F)c1O	708076081	RMTSFPLYMGRHTO-UHFFFAOYSA-N	245.225	1.577	10	20	BDCD	
CC(F)(F)CNCc1cc2c(cc1O)OCO2	697594169	LMKRBTACSYPKMB-UHFFFAOYSA-N	245.225	1.866	10	20	BDCD	
C[C@H](N[C@@H](CN)C1CC1)c1ccccc1O	817959436	FYNNPADIMNHZSS-CABZTGNLSA-N	220.316	1.780	10	20	BDCD	
C[C@H](C(=O)N(C)Cc1ccccc1O)N(C)C	820879404	SBIAMATWGOAYSD-SNVBAGLBSA-N	236.315	1.301	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H](N)[C@H](C)C2)c1	300050362	ZEHABPDOEIDVAI-BXKDBHETSA-N	236.315	1.180	10	20	BDCD	
CC(=O)NCc1ccc(N(C)C)cc1C	115281613	YBIFKAZNPVUPQR-UHFFFAOYSA-N	206.289	1.697	10	20	BDCD	
C[C@H](CNCc1ccc(N(C)C)cc1)N(C)C	38088907	AEXYQKYPVKDSBY-GFCCVEGCSA-N	235.375	1.792	10	20	BDCD	
CC[C@@H](N)CN[C@H](C)c1cc(OC)ccc1O	817980862	XQJKKTRMAGGVFJ-NXEZZACHSA-N	238.331	1.789	10	20	BDCD	
CC(C)[C@@H](C(=O)Nc1ccc(N)cc1)[C@@H](C)N	818556216	BLRQSZJEEZVFFG-BXKDBHETSA-N	235.331	1.827	10	20	BDCD	
Nc1ccc(NC(=O)C[C@H](N)C2CC2)cc1	832244831	ZJNJCTSMRYSGAC-NSHDSACASA-N	219.288	1.335	10	20	BDCD	
Cc1cccc(CN[C@@H](CO)CCF)c1O	846098391	AYBOKINOVNCRCC-LLVKDONJSA-N	227.279	1.511	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC1CCNCC1	841029387	OAOMOLPDQTVICH-UHFFFAOYSA-N	247.386	1.903	10	20	BDCD	
CC(C)CCNC(=O)CN1CC(N=[N+]=[N-])C1	409424836	YPHZISZUGRDZOA-UHFFFAOYSA-N	225.296	1.143	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@@H]2CCCCO2)cc1	95030805	SEOIYYMXUKFQDT-ZDUSSCGKSA-N	248.326	1.844	10	20	BDCD	
C[C@H](CC(=O)O)NC(=O)c1cc(O)cs1	1599888168	DFJZXCAHVWPAFQ-RXMQYKEDSA-N	229.257	1.047	10	20	BDCD	
O=C1CCC[C@@H]([C@@H]2CCCCCN2)C1=O	164514823	FFXRYYXWSUOTDV-UWVGGRQHSA-N	209.289	1.457	10	20	BDCD	
CSC[C@H](C)NC(=O)Cc1ccc(N)cc1	158427477	XNOCHWDDIVUHNX-VIFPVBQESA-N	238.356	1.679	10	20	BDCD	
COCCNCc1ccc2c(c1)CCCO2	62351278	FADVVXYEEIZZOJ-UHFFFAOYSA-N	221.300	1.748	10	20	BDCD	
CC1(C)CNCC[C@@H]1NCc1ccccc1O	379860829	ROCXDMOCNXJGPV-ZDUSSCGKSA-N	234.343	1.870	10	20	BDCD	
OCCCCNCc1ccc2c(c1)CCO2	193279842	ZQNOKPNDCCVVAP-UHFFFAOYSA-N	221.300	1.484	10	20	BDCD	
COc1cccc(CN2CCCOCC2)c1O	134189627	YMXSJRWDFKZCJA-UHFFFAOYSA-N	237.299	1.623	10	20	BDCD	
O=[N+]([O-])c1cnc(Sc2ncc[nH]2)s1	144254171	XORKFVGREVPZBD-UHFFFAOYSA-N	228.258	1.926	10	20	BDCD	
C[C@@H](N[C@@H]1CCCNC1)c1ccc(F)cc1O	817942132	XADDSTHUDCLDOS-MWLCHTKSSA-N	238.306	1.934	10	20	BDCD	
CC1(COC(=O)c2cc(O)cs2)COC1	745002442	JYJJBOQJRSNMGO-UHFFFAOYSA-N	228.269	1.647	10	20	BDCD	
CCOC[C@@H](C)NCCc1ccc(N)cc1	841036575	WFSJZKPUUKWKBA-LLVKDONJSA-N	222.332	1.826	10	20	BDCD	
C[C@H](N)C[C@H](C)NCc1cccc(F)c1O	843129580	PXIDOIYLXMHSMR-IUCAKERBSA-N	226.295	1.747	10	20	BDCD	
Cc1ccc(CN2C[C@H]3C[C@]3(CO)C2)c(O)c1	877461719	JLJXSVJWXOLFLU-TZMCWYRMSA-N	233.311	1.515	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](CF)C(=O)O)cc1C	1600286615	SBZOURKTQPOIGV-JTQLQIEISA-N	241.262	1.521	10	20	BDCD	
Oc1ccccc1CNC[C@]1(O)CCSC1	165144923	OGWNJSDIDZPSRQ-GFCCVEGCSA-N	239.340	1.350	10	20	BDCD	
Cc1cccc(O)c1CNCc1cc[nH]n1	876914970	JPMUODBIHZQFPP-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)O)CN(Cc2ccccc2O)C1	399049894	KPTNWSISZYHDPU-PWSUYJOCSA-N	249.310	1.935	10	20	BDCD	
CC(C)[C@@H](C)NC(=O)Cc1ccc(N)cc1	20522394	FRIRJXKMBLBXFL-SNVBAGLBSA-N	220.316	1.972	10	20	BDCD	
CC[C@@H](O)CN(C)Cc1ccccc1O	128446206	NIHQGOKRKFNXTA-LLVKDONJSA-N	209.289	1.595	10	20	BDCD	
Cc1ccc(O)c(CN2CCNCC2(C)C)c1	88138426	NJEOFUGCLJCMBI-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
C[C@H](O)CNc1ccccc1OCCF	819488185	KXQQXAIXCFHIKG-VIFPVBQESA-N	213.252	1.828	10	20	BDCD	
CCCOCC(=O)NCc1ccc(O)cc1O	910955805	USBVNAKKLCJYBZ-UHFFFAOYSA-N	239.271	1.141	10	20	BDCD	
COC/C(C)=C\C(=O)NCc1ccccc1O	845832284	AKWGDGRKGNUBCQ-YFHOEESVSA-N	235.283	1.601	10	20	BDCD	
Cc1cc(O)c(CNCC2(N)CCC2)cc1C	841051616	RFRSRPSRQCETCU-UHFFFAOYSA-N	234.343	1.980	10	20	BDCD	
Cc1cc(O)c(CNCC(F)(F)CN)cc1C	841059591	GIPXMYKZUABBAF-UHFFFAOYSA-N	244.285	1.693	10	20	BDCD	
CNC[C@@H](C)NCc1cccc(Cl)c1O	853248278	CVACAEBEKNKVHV-MRVPVSSYSA-N	228.723	1.743	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)COC(F)F)c1	862755081	BUVOARMPTLDAJL-UHFFFAOYSA-N	245.225	1.556	10	20	BDCD	
Cc1ccc(CN[C@H]2CCOC2)c(O)c1	877113016	XXDWDGNXMUHVKK-NSHDSACASA-N	207.273	1.579	10	20	BDCD	
C[C@H]1CCN[C@@H](C(=O)N(C)c2ccc(N)cc2)C1	877076701	UDDXLQQQDSQLFI-GXFFZTMASA-N	247.342	1.620	10	20	BDCD	
OC[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1	893985817	HOWZSQBZHDVHRB-QMMMGPOBSA-N	243.253	1.485	10	20	BDCD	
COc1cccc(CNC(=O)[C@@H]2C[C@H]2F)c1O	1521265822	ISVLACGKSOTNQH-RKDXNWHRSA-N	239.246	1.375	10	20	BDCD	
CCOCCCNCc1ccccc1O	19962880	UUQOHHOURDGAKD-UHFFFAOYSA-N	209.289	1.908	10	20	BDCD	
Cc1cccc(CN2CCCOCC2)c1O	162814046	PADKMHUERLMYDJ-UHFFFAOYSA-N	221.300	1.923	10	20	BDCD	
COc1ccc(CNCc2ncc(C)o2)c(O)c1	234939278	FPRAHBYZRNLOSX-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
Nc1ccc(CC(=O)NCCCNC2CC2)cc1	843513104	SZFSDGZVUMDIEN-UHFFFAOYSA-N	247.342	1.070	10	20	BDCD	
CCNC(=O)[C@H](C)NCc1ccccc1O	36794755	FNGYXNZCTHFGAR-VIFPVBQESA-N	222.288	1.006	10	20	BDCD	
CCn1cc(CN(C)c2ccc(OC)cc2)nn1	899879339	CPNKSFMJCAXDTO-UHFFFAOYSA-N	246.314	1.943	10	20	BDCD	
Nc1ccc(CN2CCOC[C@H]2C2CC2)cc1	1334775363	XVJVUDHESUKMJI-AWEZNQCLSA-N	232.327	1.880	10	20	BDCD	
CCN(CC)c1ccc(CNC(=N)N)cc1F	67004588	QOUHIBJNGCXNKZ-UHFFFAOYSA-N	238.310	1.655	10	20	BDCD	
C[C@@H](NCCN(C)C)c1ccccc1O	21962112	OWDXXRPQJUHHRT-SNVBAGLBSA-N	208.305	1.604	10	20	BDCD	
C[C@@H](N[C@H]1CCN(C)C1)c1ccc(F)cc1O	62748159	DAUYLUTXJRVQSQ-KOLCDFICSA-N	238.306	1.886	10	20	BDCD	
Cc1ccc(O)c(CNCCn2cccn2)c1	71408330	LJDWWQUONNGQHB-UHFFFAOYSA-N	231.299	1.687	10	20	BDCD	
Cc1cccc(CN2CCC[C@H](CO)C2)c1O	271841932	TYWXWDHTQIGACN-LBPRGKRZSA-N	235.327	1.905	10	20	BDCD	
O=S(=O)(CCC1CC1)Nc1ccc(O)cc1	271915678	CDZDRDVTQYYCRV-UHFFFAOYSA-N	241.312	1.934	10	20	BDCD	
Cc1ccc(O)c(CN2CCNC(=O)C[C@H]2C)c1	377888769	LYTNKKBEFQGABI-LLVKDONJSA-N	248.326	1.411	10	20	BDCD	
CC(=O)C1(C(=O)NCc2ccccc2O)CC1	293660325	JBQJFXGFCWFCFY-UHFFFAOYSA-N	233.267	1.378	10	20	BDCD	
CC[C@@H](OC)C(=O)NCc1ccc(O)cc1O	910954197	JPXWEGSDAASCIW-LLVKDONJSA-N	239.271	1.139	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](N)C2CC2)c1	841048130	BWEHSUKCJZRXDL-GFCCVEGCSA-N	236.315	1.228	10	20	BDCD	
Cc1cc(CN2CC=CCN2)ccc1N(C)C	923429511	WDCXRILOHABGLB-UHFFFAOYSA-N	231.343	1.937	10	20	BDCD	
C[C@H](CO)CCCNC(=O)c1cc(O)cs1	760834151	MGWBFYLBKKLYMP-QMMMGPOBSA-N	243.328	1.592	10	20	BDCD	
C[C@H](NCCS(C)(=O)=O)c1ccccc1O	37740563	XDTUPCLSHKKSKQ-VIFPVBQESA-N	243.328	1.087	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H](CCN)C2)cc1	723678484	UFGFUXURHAYYQI-CQSZACIVSA-N	247.386	1.923	10	20	BDCD	
COc1cc(C)c(CNCCC(=O)O)c(O)c1	1604695285	IQBVSBTUOCPWKR-UHFFFAOYSA-N	239.271	1.274	10	20	BDCD	
C[C@@](CCF)(NCc1ccc(N)cc1)C(=O)O	1604141419	CNLSYDJUJKLRNE-LBPRGKRZSA-N	240.278	1.561	10	20	BDCD	
COc1cccc(O)c1CN[C@H](C)CC(=O)O	1594131622	HMUVHAOCEHPXNI-MRVPVSSYSA-N	239.271	1.354	10	20	BDCD	
CCN(C)c1ccc([C@H](C)NCCO)cc1	166477186	VSIWJEDNNZJBLY-NSHDSACASA-N	222.332	1.786	10	20	BDCD	
NCCCCNCc1c(O)cccc1Cl	127303175	XPZJFJOMEZHRHZ-UHFFFAOYSA-N	228.723	1.874	10	20	BDCD	
C[C@H](N[C@H](CN)C1CC1)c1ccccc1O	817959438	FYNNPADIMNHZSS-JOYOIKCWSA-N	220.316	1.780	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCO3)CCN1	841062476	XDYVJAZUXKFROK-RISCZKNCSA-N	246.354	1.852	10	20	BDCD	
CN(CCCN)Cc1cccc(F)c1O	381787362	ZETAEQOBQSIHHN-UHFFFAOYSA-N	212.268	1.312	10	20	BDCD	
CN(CC(=O)O)Cc1ccc(N(C)C)cc1	32014227	IHTFYYXGHNXYOA-UHFFFAOYSA-N	222.288	1.269	10	20	BDCD	
CC1(C)CN(c2ccc(N)cc2)C(=O)N1	257824171	FEVKWXXFHXPISK-UHFFFAOYSA-N	205.261	1.577	10	20	BDCD	
C[C@H]1OCC[C@@]1(O)CNCc1ccccc1O	227976218	GVMJINDZUHHTOR-ZWNOBZJWSA-N	237.299	1.022	10	20	BDCD	
Nc1ccc(CN2CCC[C@H](CCO)C2)cc1	227390483	UEQRERWFTXOJJV-GFCCVEGCSA-N	234.343	1.863	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCCCCN2)cc1	364475682	BZHWCHCRMUVELR-GFCCVEGCSA-N	233.315	1.740	10	20	BDCD	
CC[C@@H](NCc1cccc(Cl)c1O)C(=O)O	820419212	QPSQJQLUCVRSOS-SECBINFHSA-N	243.690	1.998	10	20	BDCD	
CNCCC(=O)NCc1ccc(N(C)C)cc1C	829764504	NIGNDNKRQYWKNR-UHFFFAOYSA-N	249.358	1.287	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCSCC1	731871373	DXYZCFLWSLYNIG-UHFFFAOYSA-N	229.326	1.643	10	20	BDCD	
COc1cccc(O)c1CN1CC(OC)C1	839129052	VTUNDEISQNJURU-UHFFFAOYSA-N	223.272	1.231	10	20	BDCD	
CCOc1cccc(CNC[C@H](C)CN)c1O	841049209	OCTWTHFJTCBRPQ-SNVBAGLBSA-N	238.331	1.475	10	20	BDCD	
C[C@H]1CCN[C@H](C(=O)N(C)c2ccc(N)cc2)C1	877076699	UDDXLQQQDSQLFI-GWCFXTLKSA-N	247.342	1.620	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@H](O)C(C)(C)C1	877485762	GHVFELUUMLFOQX-ZDUSSCGKSA-N	235.327	1.903	10	20	BDCD	
COC[C@H](CO)N[C@H](C)c1c(O)cccc1F	886604920	GELUGBFLSDQFBL-BDAKNGLRSA-N	243.278	1.189	10	20	BDCD	
COc1cc(C)cc(CNCc2ncc[nH]2)c1O	895423046	WEICUHHUUAEUEK-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
C[C@@H](NCCOCCO)c1ccccc1O	20198665	PBTPIRZNGQDKSH-SNVBAGLBSA-N	225.288	1.052	10	20	BDCD	
Nc1ccc(NC(=O)NCC[C@H](O)C2CC2)cc1	904502511	ZRBSGNURMOMDBB-LBPRGKRZSA-N	249.314	1.551	10	20	BDCD	
C[C@H]1C[C@@H](CN)CN1C(=O)Cc1ccc(N)cc1	834361293	HLSQBNXQQPUVST-JQWIXIFHSA-N	247.342	1.007	10	20	BDCD	
Cc1ccc(CN[C@H]2CCN(C)C2)c(O)c1	877019458	MQGXBXRWLOEXRE-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
C[C@H]1C[C@H](NC(=O)Nc2ccc(N)cc2)CO1	402046784	NPQYFUKFVYJNDL-KWQFWETISA-N	235.287	1.568	10	20	BDCD	
C[C@@H](N[C@@H]1CCC[C@H]1O)c1ccccc1O	834913064	GJRWTRFGDASHGU-IRUJWGPZSA-N	221.300	1.956	10	20	BDCD	
CCOc1cccc(CN2CCNCC2)c1O	38086694	LPUCCBWVQULKFR-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
C[C@@H](NCCCCN)c1ccccc1O	37714789	BTSBLHWHXROTCK-SNVBAGLBSA-N	208.305	1.782	10	20	BDCD	
CC[C@@H](COC)NC(=O)Cc1ccc(N)cc1	79731688	AWYAVDGNWDULKJ-LBPRGKRZSA-N	236.315	1.353	10	20	BDCD	
C[C@H](CO)NCc1cc(Cl)ccc1O	35602969	MJGUYZISENODNV-SSDOTTSWSA-N	215.680	1.516	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c(O)c1	817977582	KXCIJTQRZCSISJ-WUWHUORYSA-N	232.327	1.569	10	20	BDCD	
O=C(Nc1cc[nH]n1)c1cc(O)cs1	731870579	QZZURFIDUPDZGM-UHFFFAOYSA-N	209.230	1.429	10	20	BDCD	
C[C@@H](CN)CNCc1ccc(N(C)C)c(F)c1	841047920	DNRZHMOXDWANAG-JTQLQIEISA-N	239.338	1.576	10	20	BDCD	
O=C(OC[C@H]1CCOC1)c1cccc(O)c1O	758559038	CAIXFSYSFDSMPJ-QMMMGPOBSA-N	238.239	1.291	10	20	BDCD	
Cc1cc(COC(=O)c2cccc(O)c2O)no1	776278664	DBTUPKKEQQRANJ-UHFFFAOYSA-N	249.222	1.751	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](C)N[C@H](C)C2)c1	70075569	CUGTXCUNGVNVJU-VXGBXAGGSA-N	234.343	1.883	10	20	BDCD	
CC[C@@H](F)C(=O)NCc1ccc(O)cc1O	1120745537	ABDWWGLHBOLDBF-SECBINFHSA-N	227.235	1.462	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H](C)[C@@H](O)C2)c1	897681365	SQYCQZDEEOPFET-RNCFNFMXSA-N	237.299	1.213	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@@H]2CO)cc1	11727391	TWCAYHROZDSMHW-CQSZACIVSA-N	234.343	1.709	10	20	BDCD	
C[C@H](NCc1ccccc1O)c1ncn(C)n1	391853515	RUIQZOSNAAPJGP-VIFPVBQESA-N	232.287	1.372	10	20	BDCD	
C[C@@H](C(=O)N(C)Cc1ccccc1O)N(C)C	750017282	SBIAMATWGOAYSD-JTQLQIEISA-N	236.315	1.301	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)C(=O)CCN	32104826	OZHMWCVDCCXPGD-UHFFFAOYSA-N	249.358	1.450	10	20	BDCD	
C[C@@H](N[C@H](C)c1ccccc1O)C(=O)NC1CC1	135718942	WGDJEZFLUWTWHE-NXEZZACHSA-N	248.326	1.710	10	20	BDCD	
Cc1cc(N2C(=O)[C@H]3[C@@H](C2=O)C3(C)C)ccc1N	85404165	BRAYONAHCCZIDS-PHIMTYICSA-N	244.294	1.723	10	20	BDCD	
COC(=O)[C@H]1CC[C@@H](NCc2ccccc2O)C1	193500037	ZBIUMUBHKAQFHO-CMPLNLGQSA-N	249.310	1.824	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCC(=O)C1)c1ccccc1O	827952030	DRHMEFPKRVOQEY-NXEZZACHSA-N	247.294	1.939	10	20	BDCD	
C[C@@H](NC[C@@]1(C)CCC(=O)N1)c1ccccc1O	834907736	AZZKJIDDABMXSU-QMTHXVAHSA-N	248.326	1.712	10	20	BDCD	
C[C@@H](NC(=O)c1cc(O)cs1)[C@@H]1CCOC1	743670882	VXHILZCFHYMAMO-HTQZYQBOSA-N	241.312	1.609	10	20	BDCD	
CC(C)[C@@H](CO)ONC(=O)c1cc(O)cs1	854830822	XOIJNSRLNAVTSV-MRVPVSSYSA-N	245.300	1.132	10	20	BDCD	
CCOc1ccc(O)c(CN2CCNCC2)c1	71455128	YQAAOGOSYWWBKW-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
C[C@H](N[C@@H]1CC[C@H]1O)c1c(O)cccc1F	886629575	IRTIBOZLBGKLHA-FXBDTBDDSA-N	225.263	1.705	10	20	BDCD	
CO[C@H]1CN(CCN=[N+]=[N-])C[C@@H]1n1ccnc1	409435571	VLLSPEQZZXTPKS-UWVGGRQHSA-N	236.279	1.065	10	20	BDCD	
Cc1[nH]nc(-c2cnccn2)c1CN=[N+]=[N-]	409442275	YJHFNDRYVKMXBQ-UHFFFAOYSA-N	215.220	1.985	10	20	BDCD	
COc1cccc(C(=O)N2CC(N=[N+]=[N-])C2)c1	409422225	CALGJNQWNVTESF-UHFFFAOYSA-N	232.243	1.830	10	20	BDCD	
Nc1ccc(CNCC2(O)CCC2)cc1	669367686	JGWMPKVKZYGPCA-UHFFFAOYSA-N	206.289	1.273	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCCC(=O)O)c1	35629032	PFTUKLGQBGIVCA-VIFPVBQESA-N	223.272	1.826	10	20	BDCD	
CC[C@@](C)(CO)NCc1ccc(C)cc1O	877143378	MVNFGJVZFGUEOU-ZDUSSCGKSA-N	223.316	1.951	10	20	BDCD	
Cc1cccc(CNCC2(N(C)C)CC2)c1O	398010205	XWFHSNHOIHRLLW-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@H](C)C(=O)O	820870936	JIXCSWWFPLQPFI-MRVPVSSYSA-N	239.271	1.306	10	20	BDCD	
C[C@@H](NCC(F)(F)CO)c1ccc(F)cc1O	184698475	XDESEPYKEZSQGV-SSDOTTSWSA-N	249.232	1.810	10	20	BDCD	
CC[C@@H](NC[C@H](C)N)c1ccccc1O	817974001	XIPRRAVLJKVWCY-GXSJLCMTSA-N	208.305	1.780	10	20	BDCD	
C[C@H]1CCNC[C@@H]1NCCc1ccc(N)cc1	817957615	NGHUBLSRBYLLIF-FZMZJTMJSA-N	233.359	1.399	10	20	BDCD	
CN(C)CCCCNC(=O)c1cc(O)cs1	827516015	SOMUKEAEOGWKRD-UHFFFAOYSA-N	242.344	1.525	10	20	BDCD	
CNC(=O)CCNCc1cc(Cl)ccc1O	44988376	YSRFYTAKVHNAIP-UHFFFAOYSA-N	242.706	1.271	10	20	BDCD	
C[C@H]1C[C@H]1CNC(=O)NCCc1ccc(N)cc1	841710700	HTUMGHPMUDYQAV-JQWIXIFHSA-N	247.342	1.767	10	20	BDCD	
CCc1cccc(CN(C)[C@H](C)CO)c1O	848909909	CNEADEASHCGXNO-SNVBAGLBSA-N	223.316	1.767	10	20	BDCD	
COc1ccc(N2CC[C@@H](CNC(=N)N)C2)cc1	849043964	NETXLMUWHJSOGS-JTQLQIEISA-N	248.330	1.005	10	20	BDCD	
C/C=C\C(=O)NCc1cccc(OC)c1O	769499405	ZGVHACVLGVENCU-HYXAFXHYSA-N	221.256	1.593	10	20	BDCD	
C[C@@H](N[C@H]1CCOC1)c1c(O)cccc1F	886554746	BICCFANHUVTQOJ-BDAKNGLRSA-N	225.263	1.971	10	20	BDCD	
CCN(C)c1ccc(CN2CC[C@H](O)C2)cc1	773749407	VWPBXWLZVZHJQJ-AWEZNQCLSA-N	234.343	1.709	10	20	BDCD	
CC1CC(NC(=O)NCc2ccc(N)cc2)C1	1357667300	CGMZIGLHGWAKGH-UHFFFAOYSA-N	233.315	1.867	10	20	BDCD	
COc1ccc(CNC[C@@H]2C[C@@H]2C(=O)O)cc1C	258877905	LQCWSHFPUCSXKJ-RYUDHWBXSA-N	249.310	1.814	10	20	BDCD	
COC[C@H](O)CCNCc1c(C)cccc1O	877123843	PRAWLXJUTGXBPG-LLVKDONJSA-N	239.315	1.188	10	20	BDCD	
OC[C@@H]1CC[C@H](NCc2ccccc2O)C1	295089038	RJOMDZSPYLBNOP-PWSUYJOCSA-N	221.300	1.643	10	20	BDCD	
Oc1ccccc1CNCC[C@@H](O)C1CC1	898205359	COBHYQPYWREMKB-CYBMUJFWSA-N	221.300	1.643	10	20	BDCD	
CC(C)(F)C(=O)NCCc1ccc(N)cc1	309325595	RGQXNAYTKMFVHP-UHFFFAOYSA-N	224.279	1.676	10	20	BDCD	
CC(=O)CCC(=O)NCc1ccc(O)c(O)c1	147310883	LVBYQYJLVGENEN-UHFFFAOYSA-N	237.255	1.083	10	20	BDCD	
NC[C@H](N[C@@H]1CCc2cccc(O)c21)C1CC1	817960264	LHBYWTJRECOYTK-NEPJUHHUSA-N	232.327	1.706	10	20	BDCD	
CCOc1ccc(N(C)CC[S@](C)=O)cc1	827872630	FARGVXWUAJJKGD-INIZCTEOSA-N	241.356	1.900	10	20	BDCD	
C[C@H](NC/C=C/c1ccc(N(C)C)cc1)C(=O)O	901463379	RRHRJMSETLVUET-ZWNMCFTASA-N	248.326	1.829	10	20	BDCD	
C[C@@H](NC(=O)CCO)c1ccc(N(C)C)cc1	902923232	GYNTYYYYEWAZMK-SNVBAGLBSA-N	236.315	1.312	10	20	BDCD	
Cc1cccc(CN2CC(O)(C(C)C)C2)c1O	839132592	DINFNMHKMOWTRY-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
Cc1cccc(CN[C@H](CCN)C(F)F)c1O	841075068	VLFSONPPIXEMGH-SNVBAGLBSA-N	244.285	1.773	10	20	BDCD	
CCCN1CC(=O)N[C@H]1c1cc(C)c(C)cc1O	840823729	BXYRRMTYTZJQDX-CQSZACIVSA-N	248.326	1.849	10	20	BDCD	
C[C@H](CNCc1c(O)cccc1Cl)C(=O)O	848638834	WJVWAOAONRFAEE-SSDOTTSWSA-N	243.690	1.856	10	20	BDCD	
C[C@H](N[C@H]1CCOC1)c1c(O)cccc1F	886554748	BICCFANHUVTQOJ-IUCAKERBSA-N	225.263	1.971	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@@H](CO)C2)c1O	707632406	MVLNDKLCDFILMR-KLPPZKSPSA-N	221.300	1.561	10	20	BDCD	
Nc1ccc(CNC(=O)CC[C@@H]2CCCN2)cc1	1356229075	XDEWFHZDIJFNMK-ZDUSSCGKSA-N	247.342	1.417	10	20	BDCD	
CC[C@]1(C(=O)NCc2ccc(N)cc2)CCCN1	1515330969	CGYXENWDRGGRGE-CQSZACIVSA-N	247.342	1.417	10	20	BDCD	
CC[C@H](NCc1ccc(Cl)cc1O)C(=O)O	1593623742	JBBRGQFRKWKOPJ-VIFPVBQESA-N	243.690	1.998	10	20	BDCD	
C[C@@H](NC1CCNCC1)c1ccccc1O	817936704	QCWHHMJSBHJMIP-SNVBAGLBSA-N	220.316	1.795	10	20	BDCD	
C[C@@H]1C[C@H](NCc2ccc3c(c2)CCO3)CCN1	841062473	XDYVJAZUXKFROK-BXUZGUMPSA-N	246.354	1.852	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@H](CN)C1	843048501	CNJYAOGHLAIKCU-SNVBAGLBSA-N	236.315	1.181	10	20	BDCD	
CC1(C)[C@@H](O)C[C@@H]1NC(=O)Nc1ccc(N)cc1	841296545	UZDZZUKOURAXQG-QWRGUYRKSA-N	249.314	1.550	10	20	BDCD	
COc1cccc(O)c1CNCC[C@H](C)O	309917389	QEJUIIYBGDSKMD-VIFPVBQESA-N	225.288	1.261	10	20	BDCD	
CC[C@@]1(NC(=O)Nc2ccc(N)cc2)CCOC1	394090249	HFLDLFLNGDDWDZ-CYBMUJFWSA-N	249.314	1.959	10	20	BDCD	
N=C(NCc1ccccc1O)N1CCCCC1	848984803	FLNVIZMNRYHLSX-UHFFFAOYSA-N	233.315	1.902	10	20	BDCD	
COc1cccc(CNC(C)(C)CO)c1O	20196443	NFSFAZUDGOXEJC-UHFFFAOYSA-N	225.288	1.261	10	20	BDCD	
C[C@@H](CN)CNCc1ccc(N(C)C)cc1	381507814	FLZSRPBQLLLFPO-NSHDSACASA-N	221.348	1.437	10	20	BDCD	
O=C(NCc1ccccc1O)c1cccc(F)n1	161403826	UBZALYNDBZLYPA-UHFFFAOYSA-N	246.241	1.856	10	20	BDCD	
COc1ccc(N(C)CC(=O)O)cc1F	82713100	CHARMBDIFYJBHE-UHFFFAOYSA-N	213.208	1.355	10	20	BDCD	
CN(Cc1ccc(N)cc1)C1CC(O)C1	1120370813	FVPNHWRSOFKHNK-UHFFFAOYSA-N	206.289	1.224	10	20	BDCD	
CC(C)n1cc(CNCc2ccccc2O)nn1	384953965	GMOQPAQXVYDOPT-UHFFFAOYSA-N	246.314	1.854	10	20	BDCD	
CCN(Cc1ccccc1O)[C@@H](C)CO	293516794	APZYSPPQZJMINS-JTQLQIEISA-N	209.289	1.595	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)[C@@H]1CCCO1	817957876	QIRNHEGRXCKETH-FZMZJTMJSA-N	234.343	1.968	10	20	BDCD	
CC[C@@H]1CN(C)CCN1Cc1ccccc1O	816660764	OMPUITCXWNTFCO-CYBMUJFWSA-N	234.343	1.918	10	20	BDCD	
Nc1ccc(NC[C@@H](N)CC(F)F)cc1	903917483	MESROCWVNWDEAR-QMMMGPOBSA-N	215.247	1.663	10	20	BDCD	
CCOC(=O)[C@H](C)OC(=O)c1cc(O)cs1	732353301	FJDSVJNYKGLMFH-LURJTMIESA-N	244.268	1.562	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@@H](O)CC1	854671563	LEQJEGIYFLTGQZ-MRVPVSSYSA-N	241.312	1.441	10	20	BDCD	
CNC[C@@H](C)CNCc1ccc2c(c1)CCO2	1118020718	XQOHDPGXWNUQDV-LLVKDONJSA-N	234.343	1.567	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H]2C[C@@]2(CO)C1	783735429	QEODIIAWHJBMJX-HZMBPMFUSA-N	249.310	1.215	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC(C)(O)C1	1262011185	BJNWIZIAVLWVAO-UHFFFAOYSA-N	234.343	1.628	10	20	BDCD	
CC(C)NC(=O)CNCc1cc(F)ccc1O	226581898	ZBWVQXVFBNNLNC-UHFFFAOYSA-N	240.278	1.146	10	20	BDCD	
C[C@]1(C(=O)NCc2ccccc2O)CCNC1	228420658	LWUNGFLQLDLZNZ-ZDUSSCGKSA-N	234.299	1.008	10	20	BDCD	
CC(C)C[C@@H](CN)NC(=O)Cc1ccc(N)cc1	262592007	CLBKDDMVUZWKFD-ZDUSSCGKSA-N	249.358	1.301	10	20	BDCD	
Oc1ccc(F)cc1CNCC12CC(CO1)C2	529661292	BKMGDTRZIBFSPR-UHFFFAOYSA-N	237.274	1.800	10	20	BDCD	
CNC(=O)CCCN[C@@H]1CCc2cccc(O)c21	297589313	HOEPDKUFLZIJQC-LLVKDONJSA-N	248.326	1.495	10	20	BDCD	
CC1CCN(c2ccc(CNC(=N)N)cc2)CC1	264734581	LPXRQDXPNBPOKD-UHFFFAOYSA-N	246.358	1.906	10	20	BDCD	
COc1cccc(CN2CCOCC23CC3)c1O	802658896	UFWVQRXDLZMXFY-UHFFFAOYSA-N	249.310	1.766	10	20	BDCD	
Cc1cc(C)c([C@@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c(O)c1	817978091	VTXAHTMJVUGNRM-FJJYHAOUSA-N	246.354	1.877	10	20	BDCD	
Cc1ccc(O)c(CN2CCCN(C=O)CC2)c1	827872496	VYCBJVZOCJEVTF-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@H](N)C2)cc1F	906508356	OOGUHHMDAUQHRL-XYPYZODXSA-N	237.322	1.471	10	20	BDCD	
NCC[C@@H]1CCN(Cc2cccc(F)c2O)C1	904405450	JANPNSPCACDTTR-SNVBAGLBSA-N	238.306	1.702	10	20	BDCD	
Cc1cc(O)c(CNC[C@H]2CCCN2)cc1C	841036046	NPIAWVOWYOORFM-CYBMUJFWSA-N	234.343	1.851	10	20	BDCD	
Cn1ccsc1=NC(=O)Cc1ccc(N)cc1	746403922	UYYHIEGPLJFVLJ-UHFFFAOYSA-N	247.323	1.339	10	20	BDCD	
C[C@H](CN)CNCc1ccc(N(C)C)c(F)c1	841047921	DNRZHMOXDWANAG-SNVBAGLBSA-N	239.338	1.576	10	20	BDCD	
C[C@H](CCNC(=O)c1cc(O)cs1)N(C)C	855417658	MHAGKMSWWQZGSN-MRVPVSSYSA-N	242.344	1.524	10	20	BDCD	
CN1CC(=O)N[C@@H]1c1cc(Cl)cc(F)c1O	768273043	CZGQARJYMZSCHV-JTQLQIEISA-N	244.653	1.245	10	20	BDCD	
C[C@H](O)CN1CCOc2cc(N(C)C)ccc21	194952181	HPFNYFMUHJKQAV-JTQLQIEISA-N	236.315	1.332	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1N	1336286197	OLRAFEYBVLLPBU-OCCSQVGLSA-N	233.359	1.828	10	20	BDCD	
CCO[C@@H]1COC[C@H]1NCc1ccc(N)cc1	1578158495	FGXNCURBLXHAMX-CHWSQXEVSA-N	236.315	1.162	10	20	BDCD	
CCC(=O)NCc1cc(OC)ccc1O	78726214	IXWWRVCUPLZMRB-UHFFFAOYSA-N	209.245	1.427	10	20	BDCD	
CN1CCN(c2ccc(CNC3CC3)cc2)CC1	34823186	KMLXSUDYVWLDNK-UHFFFAOYSA-N	245.370	1.690	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@@H]1CCOC1	162872385	JLHVRUKTIBACLQ-SECBINFHSA-N	227.691	1.924	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H]([C@@H](C)O)C2)c1	272531827	NDLUTXPRJBSOLX-NEPJUHHUSA-N	235.327	1.903	10	20	BDCD	
OCCC[C@H]1CCN(Cc2ccccc2O)C1	825338942	WXWQCBCVYFMAOP-LBPRGKRZSA-N	235.327	1.987	10	20	BDCD	
COC(=O)C(C)(C)NC(=O)c1cc(O)cs1	821722193	IESUXCVBWBDHGV-UHFFFAOYSA-N	243.284	1.135	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2(O)CCCC2)c1	862758059	NHZYLFGGQFAADO-UHFFFAOYSA-N	249.310	1.622	10	20	BDCD	
CC(=O)COC(=O)/C=C/c1ccc(O)c(O)c1	772777623	WLNGXKXCFCYCGV-HWKANZROSA-N	236.223	1.243	10	20	BDCD	
C[C@@H](NC(N)=O)c1ccc(N(C)C)cc1	774019119	WCPQNXRFMMXCNE-MRVPVSSYSA-N	207.277	1.482	10	20	BDCD	
Cc1ccc(O)c(CNCCC(C)(C)O)c1	274727159	GPPCTFHHHUXURA-UHFFFAOYSA-N	223.316	1.951	10	20	BDCD	
COc1cccc(CN[C@H]2C[C@@H](CO)C2)c1O	707509024	WDDDVDFLQXLRAK-JGZJWPJOSA-N	237.299	1.261	10	20	BDCD	
CC[C@@]1(C(=O)N(C)c2ccc(N)cc2)CCNC1	1330625538	ONUIDWMSPZTDOW-CQSZACIVSA-N	247.342	1.621	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2CC[C@H](N)CC2)cc1	877291854	PFFGYMKJOTXCFN-JOCQHMNTSA-N	247.342	1.197	10	20	BDCD	
CC[C@@H](NC(=O)Cc1ccc(N)cc1)C(F)F	877455513	KNDQXUIRUVLEAR-SNVBAGLBSA-N	242.269	1.971	10	20	BDCD	
C[C@@H]1C[C@H]1C(=O)NCc1ccccc1O	136334863	SKJBFURHGSNPQI-PSASIEDQSA-N	205.257	1.664	10	20	BDCD	
CCCN(CCO)Cc1cc(C)ccc1O	128037947	CITQESJJLIJNBE-UHFFFAOYSA-N	223.316	1.905	10	20	BDCD	
COc1ccc(O)c(CN2CCC[C@H](N)C2)c1	41027944	DFFHIAXTDUIVOQ-NSHDSACASA-N	236.315	1.324	10	20	BDCD	
COc1ccc(O)c(CN(C)CC[C@@H](C)O)c1	271796996	KCVWRWONCQNXSD-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
CC(=O)C(=O)COc1ccc([N+](=O)[O-])c(F)c1	808021579	ACQKXBOHRZVEEB-UHFFFAOYSA-N	241.174	1.271	10	20	BDCD	
COc1ccc(CNc2nnc(C)o2)c(O)c1	804683608	ZTPALXZKXJXBCK-UHFFFAOYSA-N	235.243	1.704	10	20	BDCD	
Cc1cc(CN2CCOCC2)ccc1N(C)C	815008616	ZPAROPHMHJVKED-UHFFFAOYSA-N	234.343	1.893	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@H]2CCNC2)c1	817944779	LRCLZLLCIOMEPU-MNOVXSKESA-N	220.316	1.713	10	20	BDCD	
Cc1cccc(CN2C[C@H]3CCN(C)[C@H]3C2)c1O	824893446	SBZRROFEGWBXNF-OCCSQVGLSA-N	246.354	1.837	10	20	BDCD	
O=C(C=C1CCC1)NCc1ccc(O)cc1O	910950845	KUIPYZBCHFWHKL-UHFFFAOYSA-N	233.267	1.824	10	20	BDCD	
CC(C)C[C@H](N)CC(=O)Nc1ccc(N)cc1	911661905	ZQZYQCGOXWOQIH-NSHDSACASA-N	235.331	1.971	10	20	BDCD	
CC1(C)NCC[C@H]1NCCc1ccc(N)cc1	925691694	JTSGSAVAYOCCAL-CYBMUJFWSA-N	233.359	1.541	10	20	BDCD	
C[C@@H](NC/C=C\CO)c1cc(F)cc(F)c1O	850510713	ZSDCAGVEYXHOSJ-YAJNLLPGSA-N	243.253	1.870	10	20	BDCD	
Cc1ccc(CN[C@@H]2CC[C@H]2O)c(O)c1	877597638	SMCBGFONONNNRU-GHMZBOCLSA-N	207.273	1.314	10	20	BDCD	
CCN(C)c1ccc(CN2C[C@@H](C)[C@@H](O)C2)cc1	773819061	OBLFKLCHNAKRMB-DOMZBBRYSA-N	248.370	1.955	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C(C)(C)CO	776336573	TYEXZLINOZTDPG-UHFFFAOYSA-N	237.299	1.369	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2CCN(C)C2)cc1C	776175030	VWYWJPRRHCUJIA-ZDUSSCGKSA-N	234.343	1.803	10	20	BDCD	
CCN1CC(=O)N[C@@H]1c1cc(F)cc(F)c1O	887329698	MUPYZXMLCJDODM-NSHDSACASA-N	242.225	1.121	10	20	BDCD	
C[C@H](N[C@@H]1CC(=O)N(C)C1)c1ccccc1O	272919355	XULWYGVCQKNPKI-VHSXEESVSA-N	234.299	1.274	10	20	BDCD	
COc1ccc(CNCc2ncn(C)n2)cc1C	218961021	STASMNYJMFZVNU-UHFFFAOYSA-N	246.314	1.422	10	20	BDCD	
CN1CC[C@@H]1CNCc1cc(F)cc(F)c1O	712583096	WZDANEXUJNUIOS-SNVBAGLBSA-N	242.269	1.464	10	20	BDCD	
NC[C@@H]1CC[C@H](NCc2ccc(N)cc2)C1	1335288133	DNZDXVMAVLVUEB-YPMHNXCESA-N	219.332	1.486	10	20	BDCD	
Nc1ccc(CNC(=O)CC2(N)CCC2)cc1	1346219619	IACLLTSEBWFIOG-UHFFFAOYSA-N	233.315	1.157	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCCC(=O)O)c1	35629031	PFTUKLGQBGIVCA-SECBINFHSA-N	223.272	1.826	10	20	BDCD	
CS[C@H](C)CNC(=O)c1cccc(O)c1O	163277775	MENSYLDJJPJYNH-SSDOTTSWSA-N	241.312	1.579	10	20	BDCD	
C[C@@H]1NCCC[C@@H]1NCc1ccc2c(c1)CCO2	841064776	JLAWDFRSBBKWGC-FZMZJTMJSA-N	246.354	1.852	10	20	BDCD	
Cc1cccc(CNCCN2CCCC2=O)c1O	405397111	JVKIVPYAJYVWBV-UHFFFAOYSA-N	248.326	1.413	10	20	BDCD	
Cc1ccc([C@H](C)NCCO)c(O)c1C	134911063	KUYMPOPFDIGABL-JTQLQIEISA-N	209.289	1.652	10	20	BDCD	
C/C=C\C(=O)N(C)Cc1ccccc1O	211369669	ZMHOBELPNJXJKF-UTCJRWHESA-N	205.257	1.927	10	20	BDCD	
O=C(CC(F)(F)F)NCc1ccccc1O	136334345	PKRFGBXVTATKOS-UHFFFAOYSA-N	233.189	1.961	10	20	BDCD	
Cc1cccc(CNC2CSC2)c1O	701971820	ATXMXTOPNKWUQM-UHFFFAOYSA-N	209.314	1.906	10	20	BDCD	
N[C@H]1C[C@H](NCc2ccc3c(c2)CCCO3)C1	906518020	NFHBNQQPSCVWFW-JOCQHMNTSA-N	232.327	1.591	10	20	BDCD	
Cc1cccc(CN2CCNC[C@@H]2C)c1O	843047822	XEVWUVNRSUHHCQ-NSHDSACASA-N	220.316	1.494	10	20	BDCD	
O=C(OCc1ccon1)c1cc(O)cs1	745002477	KMYXLPCUEUFJBT-UHFFFAOYSA-N	225.225	1.799	10	20	BDCD	
CN(Cc1cc(F)ccc1O)CC1(O)CCC1	761218320	AXYQBGJBUMWJBW-UHFFFAOYSA-N	239.290	1.878	10	20	BDCD	
CCOC(=O)[C@H](C)NCc1cc(C)ccc1O	71408432	ILTPBAIHXUKZTH-JTQLQIEISA-N	237.299	1.742	10	20	BDCD	
COc1cccc(O)c1CN1CCCOCC1	768889746	QIRWTOUISXDANN-UHFFFAOYSA-N	237.299	1.623	10	20	BDCD	
CNC(=O)CCCN[C@H](C)c1ccccc1O	272834238	IPEZIIMXUHMJNN-SNVBAGLBSA-N	236.315	1.569	10	20	BDCD	
C[C@H]1[C@@H](C)NCCN1Cc1cc(F)ccc1O	379439312	PWTSYSAGSOBINC-ZJUUUORDSA-N	238.306	1.714	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2C(=O)NCC[C@H]2C)c1	193692250	UIIMQPUZGSFFKD-MFKMUULPSA-N	248.326	1.315	10	20	BDCD	
Cc1cccc(CN2CCOC[C@H]2C)c1O	162813610	HLSLAWRMBLJUNJ-LLVKDONJSA-N	221.300	1.921	10	20	BDCD	
CCN1CCN(Cc2cc(C)ccc2O)CC1=O	273377325	GDGRUUIMIFVAPP-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
Cc1cccc(CN2CC(=O)NCC2(C)C)c1O	282662991	GWRVVSCBPKSBED-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
O=[N+]([O-])c1ccc(O)c(CNCC(F)F)c1	839089933	DMUZXDZLNPOAKD-UHFFFAOYSA-N	232.186	1.655	10	20	BDCD	
O=C(N=c1cc[nH]cc1)c1cc(O)cs1	732262727	XHHLTRCZNIBTIV-UHFFFAOYSA-N	220.253	1.523	10	20	BDCD	
Cc1ccc(CN2CCC(CO)CC2)c(O)c1	876564433	KIIIIKVQTQKIDQ-UHFFFAOYSA-N	235.327	1.905	10	20	BDCD	
CN[C@@H](CC(C)C)C(=O)Nc1ccc(N)cc1	884009460	WZFMPNOVXPSHRC-LBPRGKRZSA-N	235.331	1.841	10	20	BDCD	
COC[C@@H](CO)N[C@@H](C)c1c(O)cccc1F	886604921	GELUGBFLSDQFBL-DTWKUNHWSA-N	243.278	1.189	10	20	BDCD	
COCCOCCN(C)c1ccc(OC)cc1	36471988	PGJIENVPRJELPN-UHFFFAOYSA-N	239.315	1.794	10	20	BDCD	
CN(CCCF)C(=O)c1cc(O)cs1	899815961	JYYBZLCHVFEUTO-UHFFFAOYSA-N	217.265	1.885	10	20	BDCD	
CCc1cccc(CNC[C@H]2CCN2C)c1O	712580653	NRHUCDKOCNGBBD-CYBMUJFWSA-N	234.343	1.748	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)[C@H](C(N)=O)C1	1337838292	NHWXLNKQJIZWLW-GWCFXTLKSA-N	247.342	1.355	10	20	BDCD	
C[C@@H](NC[C@@H]1CCCN1)c1ccccc1O	817953306	ZTIDAOBFFIIORT-MNOVXSKESA-N	220.316	1.795	10	20	BDCD	
Nc1ccc(NC(=O)NC[C@H](O)C2CCC2)cc1	841298642	RKFXYZAMRQSFSZ-LBPRGKRZSA-N	249.314	1.551	10	20	BDCD	
Oc1cccc2c1[C@@H](NCCn1cccn1)CC2	394143687	MTMQPONQDYTTBA-LBPRGKRZSA-N	243.310	1.866	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCNC(=O)CC2)c1	396664564	VDZPQDTXWSVJRB-LBPRGKRZSA-N	248.326	1.459	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@H]1C[C@H](O)C1	850417885	PWMFBZJZGQOEMI-MGCOHNPYSA-N	227.691	1.659	10	20	BDCD	
CCOCCC(=O)N(C)c1ccc(N)cc1	53732567	MZVBTPOAKZEDFP-UHFFFAOYSA-N	222.288	1.658	10	20	BDCD	
NC[C@H]1CCN(Cc2cc(F)ccc2O)C1	67805778	BHYBWOKWLYQADC-SECBINFHSA-N	224.279	1.312	10	20	BDCD	
C[C@@H](NC(=O)c1cc(O)cs1)C1CC1	732258547	UAJPGLYTZUEYJB-ZCFIWIBFSA-N	211.286	1.982	10	20	BDCD	
CN(C)C1(C(=O)NCc2ccccc2O)CC1	830526578	OJOXNFNZIQOHFV-UHFFFAOYSA-N	234.299	1.103	10	20	BDCD	
CCOCCNC(=O)c1cc(O)cs1	731871736	LMRAHIPQIJUTHU-UHFFFAOYSA-N	215.274	1.220	10	20	BDCD	
CCC1(O)CN(C(=O)c2cc(O)cs2)C1	839759580	AHTPTESTNXTZQY-UHFFFAOYSA-N	227.285	1.051	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H]1CCCCN1	841032990	LJCDORZLEHISME-LBPRGKRZSA-N	238.306	1.763	10	20	BDCD	
COc1cccc([C@H](C)N[C@H]2C[C@H](O)C2)c1O	850578604	LZMMZDFMZMCHJO-GUBZILKMSA-N	237.299	1.575	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@H](N)C1)c1cc(F)ccc1O	873258737	VSDALQXVAIZWDZ-FXPVBKGRSA-N	238.306	1.919	10	20	BDCD	
CC(=O)C1=NN(c2cc(C)ccc2F)C(=O)C1	871955945	WERJEADZRMENDE-UHFFFAOYSA-N	234.230	1.816	10	20	BDCD	
COC[C@H]1CN(C(=O)CN=[N+]=[N-])C[C@@H]1C	409434040	NYFJDOPLAUFQQR-JGVFFNPUSA-N	212.253	1.038	10	20	BDCD	
O=C(NCC[C@@H](O)C1CC1)c1cc(O)cs1	890717849	MIBMSCGKSPOSCD-SECBINFHSA-N	241.312	1.345	10	20	BDCD	
COC(=O)C1(CNCc2cccc(C)c2O)CC1	188668223	WTJZZNUVWUUFOS-UHFFFAOYSA-N	249.310	1.743	10	20	BDCD	
C[C@@H](NC(=O)C[C@@H]1CCNC1)c1ccccc1O	870988675	WNXNPEQXXGGETJ-MNOVXSKESA-N	248.326	1.569	10	20	BDCD	
C[C@H](NCc1cc(F)c(F)cc1O)C(=O)O	1574289749	RSIZOWJUIWHQTK-YFKPBYRVSA-N	231.198	1.233	10	20	BDCD	
Nc1ccc(NC(=O)c2cnncc2O)cc1	1580449373	KEQPGOBOKDKGJT-UHFFFAOYSA-N	230.227	1.017	10	20	BDCD	
CCCCC(=O)NCCc1ccc(O)c(O)c1	11638463	UTQHHIQJRVUOGB-UHFFFAOYSA-N	237.299	1.947	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)[C@H](C)CN1	300434971	DNWZVPBYUJOPDC-VHSXEESVSA-N	238.306	1.714	10	20	BDCD	
CO[C@@H](C)CC(=O)NCCc1ccc(N)cc1	152587266	NKKGWIVYQONJKT-JTQLQIEISA-N	236.315	1.353	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)C(=O)N(C)C	37363096	XYRUUYSMDJWXPI-JTQLQIEISA-N	248.326	1.188	10	20	BDCD	
C[C@H](NCC1CNC1)c1cc(F)ccc1O	817964939	JUOILRQNKSLOLU-QMMMGPOBSA-N	224.279	1.401	10	20	BDCD	
O=C(O)[C@@H]1CCN(C(=O)c2cc(O)cs2)C1	739594369	HHLDAZTWTBZSDZ-ZCFIWIBFSA-N	241.268	1.000	10	20	BDCD	
Cc1cccc(CN(C)C[C@@H](C)N)c1O	863651448	JBBABRCXAWJANJ-SNVBAGLBSA-N	208.305	1.480	10	20	BDCD	
Cc1ccc(CN2C[C@H](O)C[C@@H]2C)c(O)c1	877468069	YCMCPUSIMCDOAG-CMPLNLGQSA-N	221.300	1.656	10	20	BDCD	
CN(C(=O)[C@@H]1NCC1(C)C)c1ccc(N)cc1	877077624	OZHRDYWUQSXPSH-NSHDSACASA-N	233.315	1.230	10	20	BDCD	
CN[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C1	708483052	ZILBHOGEDDHQLR-SNVBAGLBSA-N	242.269	1.464	10	20	BDCD	
CC(=O)NCCCSc1nccs1	67945300	XHRKENUTAPFRKB-UHFFFAOYSA-N	216.331	1.761	10	20	BDCD	
Nc1ccc(CN2CC[C@@H]3CNC[C@@H]32)cc1	1335290102	SAZIENZRQDLSTO-YPMHNXCESA-N	217.316	1.063	10	20	BDCD	
C[C@H](NC[C@@H](C)N)c1cc(C(=O)O)ccc1O	1604260770	YRZSNSJWUZYLEF-SFYZADRCSA-N	238.287	1.088	10	20	BDCD	
CC[C@@H](CNC(=O)Nc1ccc(N)cc1)OC	310513860	VADBLQWRWBQADF-NSHDSACASA-N	237.303	1.815	10	20	BDCD	
C[C@@H](O)[C@@H]1CCCN1c1ccc(N)cc1	409426779	IRHNDIUKANLSKC-SKDRFNHKSA-N	206.289	1.618	10	20	BDCD	
C[C@H](Cc1ccc(O)c(O)c1)Nc1ncccn1	184146548	FTYYNUPOUJFYCL-SECBINFHSA-N	245.282	1.931	10	20	BDCD	
C[C@H](NCC1(CO)CC1)c1ccc(F)cc1O	122314806	ZHGYSMUBAVMVGD-VIFPVBQESA-N	239.290	1.954	10	20	BDCD	
CC[C@H](N[C@@H](C)CO)c1ccccc1O	35602842	YWQZBLCLTGPWSI-ONGXEEELSA-N	209.289	1.814	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H]1COCCO1	226585515	JUUDPLWHSZPMTR-LLVKDONJSA-N	241.262	1.036	10	20	BDCD	
CN(C)CCCOC(=O)c1cccc(O)c1O	195963332	JCZNMGFZMJUSOX-UHFFFAOYSA-N	239.271	1.206	10	20	BDCD	
Cc1ccc([C@@H](C)NC[C@@H](C)CO)c(O)c1	83219200	DMCHHMIEBFEDPQ-GHMZBOCLSA-N	223.316	1.980	10	20	BDCD	
Oc1c(Cl)cccc1CN1CCNCC1	83056291	IPXBBTIXJZPWTN-UHFFFAOYSA-N	226.707	1.451	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)CC[C@@H]1N	220189327	VKQVLPSAKUBEOS-CABZTGNLSA-N	238.306	1.700	10	20	BDCD	
COCC[C@@H](C)NC(=O)Nc1ccc(N)cc1	81717727	JIDMIOKJBWLBBL-SECBINFHSA-N	237.303	1.815	10	20	BDCD	
CNC(=O)CN1CCCCc2cc(OC)ccc21	270862806	KHSYIRKERZXQIJ-UHFFFAOYSA-N	248.326	1.584	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CC[C@@H]2CO)c1	902629893	JQONPYUALCYPEY-GFCCVEGCSA-N	221.300	1.576	10	20	BDCD	
CCCC(=O)OCC(=O)c1ccc(O)c(O)c1	916589840	ACXZSQFAHHICRC-UHFFFAOYSA-N	238.239	1.624	10	20	BDCD	
CCOc1ccc(O)c(CN[C@H]2C[C@H](O)C2)c1	850417674	HNLYEYVPQFKGEY-XYPYZODXSA-N	237.299	1.404	10	20	BDCD	
CC[C@@H](CO)C(=O)NCc1ccccc1O	779815393	OOYMUKUGQNVEET-VIFPVBQESA-N	223.272	1.027	10	20	BDCD	
Cc1cccc(CNC[C@H]2CCCO2)c1O	83351374	VDUVSYJXBGXLOF-GFCCVEGCSA-N	221.300	1.969	10	20	BDCD	
CC[C@H](CO)NCc1cc(C)cc(OC)c1O	894157607	WLKFWEKGEYLLJT-LLVKDONJSA-N	239.315	1.570	10	20	BDCD	
COC(=O)c1cnc(S[C@H](C)C(=O)O)s1	1593893623	WUHGDWQXFTUEFZ-SCSAIBSYSA-N	247.297	1.495	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2CCC[C@@H](N)C2)cc1	834598283	AWRKAKSVCZUXQR-OLZOCXBDSA-N	247.342	1.197	10	20	BDCD	
O=C(NCCCF)c1cc(O)cs1	308411800	OPVOCFBKSZKPRK-UHFFFAOYSA-N	203.238	1.543	10	20	BDCD	
CN(CC[C@@H]1CCOC1=O)Cc1ccccc1O	120532694	YEHMZRZVOOADNG-LLVKDONJSA-N	249.310	1.777	10	20	BDCD	
CCNC(=O)[C@H](C)NCc1ccc(N(C)C)cc1	35134262	HOGDKJPXXKWUCV-NSHDSACASA-N	249.358	1.367	10	20	BDCD	
COC[C@@H](CO)N[C@@H](C)c1ccc(C)cc1O	234890299	VASWKLQCASEKSW-WDEREUQCSA-N	239.315	1.359	10	20	BDCD	
C[C@@]1(C(=O)C(=O)c2ccccn2)C=CC=CO1	253534049	XUYIFGKVHXRWFB-ZDUSSCGKSA-N	229.235	1.692	10	20	BDCD	
C[C@@H](CO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O	273614232	WWHNQNDCKOLWAB-YUMQZZPRSA-N	240.259	1.332	10	20	BDCD	
CCCN[C@@H](C)C(=O)NCCc1ccc(N)cc1	295167361	LBQSSXMFWUVFHY-NSHDSACASA-N	249.358	1.316	10	20	BDCD	
C[C@@H]1CC[C@@H](CNC(=O)c2cc(O)cs2)O1	839791595	DEHAPOMTVKVZJX-APPZFPTMSA-N	241.312	1.751	10	20	BDCD	
C[C@@H]1C[C@H](O)CN1Cc1cc(F)ccc1O	788270028	OIUGDDMGNQZWJU-KCJUWKMLSA-N	225.263	1.486	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H]2CC(=O)N(C)C2)c(O)c1	273612485	WLQPPFWFXAPTTN-MNOVXSKESA-N	248.326	1.582	10	20	BDCD	
Nc1ccc(CNC(=O)N2CC[C@@H]3C[C@H]3C2)cc1	1337070069	HPZGRQMQAPZOBV-NEPJUHHUSA-N	245.326	1.820	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@H]2C[C@@H]2F)cc1	1337079631	CVTGVIOVXORMAT-RYUDHWBXSA-N	236.290	1.727	10	20	BDCD	
CC[C@H](Sc1ncc(C(=O)O)s1)C(N)=O	1595359037	OPHVYCOBZOFCEG-BYPYZUCNSA-N	246.313	1.197	10	20	BDCD	
O=C(CNCc1ccccc1O)NCC1CC1	165909094	NKSPMYRKAFYORR-UHFFFAOYSA-N	234.299	1.008	10	20	BDCD	
CN(CC[C@H]1CCNC1)Cc1ccccc1O	842472456	YLVNBKKNBKNPGS-GFCCVEGCSA-N	234.343	1.824	10	20	BDCD	
CC[C@H](O)CCNCc1ccc(C)cc1O	877112832	YLZZGKPLKONVQM-LBPRGKRZSA-N	223.316	1.951	10	20	BDCD	
CC(C)[C@H](O)CNCc1cc(F)cc(F)c1O	708487467	XZPQSUMLOSSKBW-LLVKDONJSA-N	245.269	1.777	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@@H]2COC[C@H]2O)c1	296052679	VGJXPMAPCXAGSA-IRUJWGPZSA-N	237.299	1.111	10	20	BDCD	
C[C@H]1CNCCN1Cc1ccccc1O	107093371	PTIIEYIJBSMKBU-JTQLQIEISA-N	206.289	1.186	10	20	BDCD	
OCCNCc1cc(Cl)ccc1O	20597013	NUIBKSYYEYNMAN-UHFFFAOYSA-N	201.653	1.128	10	20	BDCD	
CN(CC1CCC1)C(=O)c1cccc(O)c1O	126391069	HRYBWCWTAVXKHO-UHFFFAOYSA-N	235.283	1.970	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC[C@H](C)O)c1	35601837	UVAXSFWALKDRRH-IUCAKERBSA-N	225.288	1.432	10	20	BDCD	
CN(C(=O)[C@@H]1CCOC1)c1ccc(N)cc1	40941371	FNPCDHJLDXUNLI-SECBINFHSA-N	220.272	1.268	10	20	BDCD	
C[C@H](CO)CNCc1ccc(N(C)C)cc1	88195048	NAGJLYSHLZJTTM-NSHDSACASA-N	222.332	1.471	10	20	BDCD	
CC[C@H](CNCc1ccccc1O)OC	289984252	ZZAYYBAPPFUZAN-LLVKDONJSA-N	209.289	1.907	10	20	BDCD	
Cc1ccc([C@H](C)NC2CNC2)c(O)c1C	817955919	LIEDBFBYMCRMOY-JTQLQIEISA-N	220.316	1.631	10	20	BDCD	
COc1ccccc1NC[C@H](O)CSC	819394354	ZPEHCBLREHPFRJ-VIFPVBQESA-N	227.329	1.831	10	20	BDCD	
CN(C)c1ccc(CNC/C=C/CO)cc1	717529657	AAMXLDYUOLOXET-ONEGZZNKSA-N	220.316	1.391	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC1=NCCN1C	849009110	COMHZXGRSJESFC-UHFFFAOYSA-N	246.358	1.452	10	20	BDCD	
COC(=O)[C@H](CC1CC1)NCc1ccccc1O	840957719	MPGJWBDCEAHKKJ-LBPRGKRZSA-N	249.310	1.824	10	20	BDCD	
CCN(C)c1ccc(CN(C)CC(=O)O)cc1	846263213	RFTJNOSKQSQZQF-UHFFFAOYSA-N	236.315	1.659	10	20	BDCD	
Oc1ccccc1CNCC[C@@H]1CCNC1	841037892	ZMRKYCKNLNWSHH-NSHDSACASA-N	220.316	1.481	10	20	BDCD	
C[C@@H]1NCCC[C@H]1NCc1ccc2c(c1)CCO2	841064778	JLAWDFRSBBKWGC-SMDDNHRTSA-N	246.354	1.852	10	20	BDCD	
CCNC(=O)[C@@H](C)NCc1c(C)cccc1O	877143016	YRZRQZWHMIHFNA-SNVBAGLBSA-N	236.315	1.315	10	20	BDCD	
CC[C@H](CCO)NCc1cc(F)cc(F)c1O	708484363	HJPPVMPZTLDUJP-SNVBAGLBSA-N	245.269	1.921	10	20	BDCD	
Cc1cccc(CNCCC2(CO)CC2)c1O	395889511	RDDWDBRXURIMBW-UHFFFAOYSA-N	235.327	1.953	10	20	BDCD	
CO[C@H]1CCN(Cc2ccc(C)cc2O)C1	876746758	VYASDDOZUUDIRU-LBPRGKRZSA-N	221.300	1.921	10	20	BDCD	
C[C@H](O)CN[C@H](C)c1ccc(N(C)C)cc1	37257686	CZLVRXCMSXZNIW-WDEREUQCSA-N	222.332	1.784	10	20	BDCD	
CCCS(=O)(=O)NCCc1ccc(N)cc1	32100636	KSTLEHYJXUPOGF-UHFFFAOYSA-N	242.344	1.141	10	20	BDCD	
COc1cccc(CN[C@H]2CCSC2)c1O	230705120	DNFGJJUHIMLMBY-JTQLQIEISA-N	239.340	1.996	10	20	BDCD	
Cc1c(CN=c2[nH]nco2)n(C)c2ccccc12	352533901	AWVCNBJRKNHNPF-UHFFFAOYSA-N	242.282	1.904	10	20	BDCD	
COc1ccc(CNCc2nonc2C)cc1C	809744041	RQXCPVDRACUAJS-UHFFFAOYSA-N	247.298	1.985	10	20	BDCD	
OCCNCc1ccc2ccccc2c1O	816561463	YPYMDEMWFYWMKE-UHFFFAOYSA-N	217.268	1.627	10	20	BDCD	
CO[C@@H](C)CC(=O)NCc1cc(C)ccc1O	862758967	RHKPJMPLMYAOOQ-JTQLQIEISA-N	237.299	1.742	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H]3C[C@@]3(CO)C2)c1	783746561	YGLKLWHLSNMBQF-JSGCOSHPSA-N	233.311	1.515	10	20	BDCD	
C[C@H](CCCO)NCc1ccc2c(c1)CCO2	88503479	ZDUXYTYBCGMZIS-LLVKDONJSA-N	235.327	1.872	10	20	BDCD	
CNC[C@H](C)CNCc1ccc(OC)c(C)c1	1328678548	YGQBZPGACXZMBC-NSHDSACASA-N	236.359	1.949	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H](C(=O)O)[C@H]1C	1600543483	YWLCDJMWQJUTAY-GHMZBOCLSA-N	249.310	1.996	10	20	BDCD	
CC(=O)CCC(=O)N(C)Cc1ccccc1O	203582324	WPJUGUTZCVPSCE-UHFFFAOYSA-N	235.283	1.720	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@@H]1CCNC1	843049600	SJPWJGGOTJZNNV-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
CN(CC(C)(C)CN)C(=O)Cc1ccc(N)cc1	262591944	UPWVQKNRGLREJP-UHFFFAOYSA-N	249.358	1.255	10	20	BDCD	
CC(=O)NCCCN[C@@H](C)c1ccccc1O	179902620	PAGGDQKSZODYFA-JTQLQIEISA-N	236.315	1.569	10	20	BDCD	
O=C(NCCCC(F)F)c1cccc(O)c1O	1262205790	AXYGBJZZRQZYAG-UHFFFAOYSA-N	245.225	1.873	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@@H]2COC[C@H]2O)c(O)c1	296084268	XNSYNCIFKLTXEW-IRUJWGPZSA-N	237.299	1.111	10	20	BDCD	
C[C@H](CNC(=O)c1cccc(O)c1O)C1CC1	126545481	FUMLWNLMPRGMBC-MRVPVSSYSA-N	235.283	1.874	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCCOC1	71011193	NVAMIBXXCMVUAE-NSHDSACASA-N	207.273	1.661	10	20	BDCD	
CC[C@H](O)CCNCc1cc(F)ccc1O	226616552	SDLVTNZXHNJKAD-NSHDSACASA-N	227.279	1.782	10	20	BDCD	
Nc1ccc(CC(=O)N2C[C@H]3C[C@H]3C2)cc1	379522500	PECWQZDRRKKXQA-PHIMTYICSA-N	216.284	1.290	10	20	BDCD	
O=C(O)[C@H]1CCCCN1Cc1ccccc1O	86729589	CPLUGEMCYWPPAX-LLVKDONJSA-N	235.283	1.831	10	20	BDCD	
Oc1cccc2c1[C@@H](NC1CCNCC1)CC2	817937257	VZZYZKYPRSGBOY-LBPRGKRZSA-N	232.327	1.721	10	20	BDCD	
COCC(COC)Sc1nccs1	901476619	JITCEOHWEDOAJV-UHFFFAOYSA-N	219.331	1.897	10	20	BDCD	
COc1cccc([C@H](C)NCC(C)(C)O)c1O	846148192	YBHUZFSEMVBQDK-VIFPVBQESA-N	239.315	1.822	10	20	BDCD	
CCN1CCC(NCCc2ccc(N)cc2)CC1	841037171	YWDWLJXXBCNEBK-UHFFFAOYSA-N	247.386	1.885	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)N2CC[C@H](O)C2)o1	1537962507	LOWHKULJRKPJMW-ZETCQYMHSA-N	236.231	1.297	10	20	BDCD	
Oc1c(Cl)cccc1CNC1CCNCC1	841026829	RNAULVIXCJWGEQ-UHFFFAOYSA-N	240.734	1.887	10	20	BDCD	
CC(C)(N)CCNCc1ccc(N)cc1	1120268209	CCVFFXTVPSNBKC-UHFFFAOYSA-N	207.321	1.486	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C(C)(C)O)cc1	188074872	FBEOUTYMGXVALJ-UHFFFAOYSA-N	236.315	1.140	10	20	BDCD	
CO[C@@H](C)CNCc1cc(C)ccc1O	191205071	DPOQFEUKSBWGDX-JTQLQIEISA-N	209.289	1.825	10	20	BDCD	
O=C(O)CCC(=O)CSc1nccs1	1601970460	VEKPPNHVBTWNSJ-UHFFFAOYSA-N	231.298	1.669	10	20	BDCD	
N[C@@H](c1ccccc1O)[C@H](N)c1ccccc1O	22457414	MRNPLGLZBUDMRE-OKILXGFUSA-N	244.294	1.798	10	20	BDCD	
CCNC(=O)CN(CC)Cc1ccc(N)cc1	35361322	POXAHUMRBZQFTL-UHFFFAOYSA-N	235.331	1.227	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@@H](C)CC(N)=O)c(O)c1	168829961	UWARYVFRIYZWSG-VHSXEESVSA-N	236.315	1.615	10	20	BDCD	
Cc1ccc(CN[C@@](C)(CO)C2CC2)c(O)c1	877159040	REYSKXLKNXTSGX-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
Cc1ccc(CNC[C@@H](O)C(F)(F)F)c(O)c1	876965719	IUGPIJGFNFSJLY-SNVBAGLBSA-N	249.232	1.713	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1CCOC1	877112700	TXIZFJGHWFZKQK-SNVBAGLBSA-N	207.273	1.579	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)[C@H](C(=O)O)C1	1604754414	VZBPKHHLDCEGMG-MFKMUULPSA-N	248.326	1.954	10	20	BDCD	
CCN(CC)C(=O)/C=C/c1ccc(O)c(O)c1	26276877	IVRFYKXAGRJRNP-SOFGYWHQSA-N	235.283	1.979	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](C(N)=O)C2)c1O	183449127	RFOKZHIYMFVEDY-LLVKDONJSA-N	234.299	1.008	10	20	BDCD	
COc1ccc(O)c(CNCc2ccnn2C)c1	71333218	DSFBNFXVJBRCRJ-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC[C@H](C)O)c1	35601839	UVAXSFWALKDRRH-DTWKUNHWSA-N	225.288	1.432	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)CCCO)c1	87358808	UPHVBBLCZFWPJF-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
C[C@H](O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O	273427512	UPVQRPWTOYJBDI-YUMQZZPRSA-N	240.259	1.332	10	20	BDCD	
CC[C@@H](C(=O)O)C(=O)NCc1ccccc1O	911332178	XKRMSWRMRPGOFP-SECBINFHSA-N	237.255	1.119	10	20	BDCD	
COc1ccc(O)c(CN[C@H](CO)CCF)c1	846101190	RAJOMMPDFMHSCT-JTQLQIEISA-N	243.278	1.211	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H]2C[C@H]2C1	862440129	DRMMRAQJFIGLOK-UWVGGRQHSA-N	219.284	1.853	10	20	BDCD	
COC(=O)[C@@H](C)N(C)Cc1ccc(C)cc1O	877491654	UTJFNTORXZADPJ-SNVBAGLBSA-N	237.299	1.694	10	20	BDCD	
C[C@@H](CN(C)C)NCc1ccc(N(C)C)cc1	168625167	JAILGYGFEKYZBC-LBPRGKRZSA-N	235.375	1.792	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCCOC1	171295329	XMODJRCTVJBZII-LBPRGKRZSA-N	249.310	1.777	10	20	BDCD	
CO[C@@H]1CCN(Cc2c(C)cccc2O)C1	876749412	KAHQHSDLIWFDMU-LLVKDONJSA-N	221.300	1.921	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)c1cccnc1	577071	IZZLPUOSUVBBNI-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
Nc1ccc(CC(=O)Nc2ccncc2)cc1	21966836	DJPRMXRGESAMPA-UHFFFAOYSA-N	227.267	1.845	10	20	BDCD	
CCO[C@H]1C[C@@H]1C(=O)N(C)Cc1ccccc1O	298765962	ANKANIQZSAZICQ-AAEUAGOBSA-N	249.310	1.776	10	20	BDCD	
OCCNCc1c(O)cccc1Br	706808777	ZTSZDVAIELQXBK-UHFFFAOYSA-N	246.104	1.237	10	20	BDCD	
C[C@H](NCCCON)c1cc(Cl)ccc1O	902426398	SGAMIJFZOXBWOB-QMMMGPOBSA-N	244.722	1.977	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)C[C@@H](C)N)c1	843128156	IIJBBYWEMVXPEG-GHMZBOCLSA-N	222.332	1.916	10	20	BDCD	
NC[C@H](NCc1cc(Cl)ccc1O)C1CC1	841029671	YDFLDGCFJFOXRH-NSHDSACASA-N	240.734	1.873	10	20	BDCD	
C[C@H]1OCC[C@@]1(C)NC(=O)c1cc(O)cs1	753504973	WRQYHMUYSRPBEU-RDDDGLTNSA-N	241.312	1.751	10	20	BDCD	
C[C@@H](NC/C=C/CO)c1cc(F)cc(F)c1O	850510712	ZSDCAGVEYXHOSJ-UFUPEUMYSA-N	243.253	1.870	10	20	BDCD	
CCOc1ccc(N(C)CC2OCCO2)cc1	777589153	QYCLALJMSXWUIG-UHFFFAOYSA-N	237.299	1.894	10	20	BDCD	
COC(=O)[C@@H]1CCN(Cc2ccccc2O)[C@@H]1C	787420567	IYECOHSCTKIPNA-ZYHUDNBSSA-N	249.310	1.776	10	20	BDCD	
Cc1nc([C@H](C)NCc2ccccc2O)no1	1261186873	RSDCHECWXRWTOU-QMMMGPOBSA-N	233.271	1.934	10	20	BDCD	
COc1ccc(O)c(CNCc2ncc(C)o2)c1	234967601	WEVYMDLZRCJTEB-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
O=C(NCc1ccccc1O)N[C@H]1C=CCC1	852509146	VESFGDZTGVSHMU-NSHDSACASA-N	232.283	1.910	10	20	BDCD	
Cc1nccc(C(=O)Nc2ccc(N)cc2)n1	195309041	ZOOBSBYPIQNGPQ-UHFFFAOYSA-N	228.255	1.620	10	20	BDCD	
Cc1ccc([C@H](C)NCc2nnn(C)n2)c(O)c1	398084873	PLRIEHDUNWDEKU-VIFPVBQESA-N	247.302	1.075	10	20	BDCD	
CCOc1cccc(CN[C@@H]2CC[C@H]2O)c1O	818230972	KXMCKFYMNVTLGK-GHMZBOCLSA-N	237.299	1.404	10	20	BDCD	
COc1ccc(CN[C@@H](CO)C2CC2)cc1C	734161249	OIFQUQSOYIDLMV-ZDUSSCGKSA-N	235.327	1.864	10	20	BDCD	
COC(=O)[C@@H](C)Sc1ncc([N+](=O)[O-])s1	189970643	BYEKVWZAOLJGSX-SCSAIBSYSA-N	248.285	1.705	10	20	BDCD	
COCCN1CCOc2cc(N(C)C)ccc21	175031327	VHVOREGPSFNGJH-UHFFFAOYSA-N	236.315	1.598	10	20	BDCD	
C[C@H](NC[C@@H](C)O)c1cc(F)cc(F)c1O	134899862	OCEFYCUWARQNOH-RQJHMYQMSA-N	231.242	1.702	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@@H]1N	84946455	GTFRCGNUOGDCCG-WFASDCNBSA-N	247.386	1.922	10	20	BDCD	
CN1CCC[C@H](CNCc2ccccc2O)C1	44535356	BTCPKWITVRYGRB-GFCCVEGCSA-N	234.343	1.824	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cccc(N(C)C)c1	808488785	OYWZUSGEIRAKDB-UHFFFAOYSA-N	249.266	1.068	10	20	BDCD	
CC[C@H](N)CNCc1cc(OC)ccc1O	841071967	KOMSHJWRJUFASM-JTQLQIEISA-N	224.304	1.228	10	20	BDCD	
CCNC(=O)CCC(=O)N(C)c1ccc(N)cc1	877078229	ISRLGTUBYSHBNI-UHFFFAOYSA-N	249.314	1.148	10	20	BDCD	
CC1(O)CN(Cc2cc(F)ccc2O)C1	877581309	WEXLXWJEXOKURE-UHFFFAOYSA-N	211.236	1.098	10	20	BDCD	
CCN(Cc1cc(F)cc(F)c1O)[C@@H](C)CO	894863082	OIXAYVOUMDRMTH-QMMMGPOBSA-N	245.269	1.873	10	20	BDCD	
COC(=O)[C@H](NCc1ccc(N)cc1)C1CC1	1334774011	CDPWVGUCKFEPOP-GFCCVEGCSA-N	234.299	1.310	10	20	BDCD	
CCO[C@H]1C[C@@H]1C(=O)NCc1ccccc1O	299571638	PLTPADOKQSHFJU-JQWIXIFHSA-N	235.283	1.433	10	20	BDCD	
C[C@@](O)(CNCc1cc(F)ccc1O)C1CC1	310415649	MZXCMUBVEMCCRI-CYBMUJFWSA-N	239.290	1.782	10	20	BDCD	
Cc1cccc(CN2CCC3(C2)OCCO3)c1O	180028594	DZODGUCXVKVSIH-UHFFFAOYSA-N	249.310	1.649	10	20	BDCD	
CN1CC(=O)N(Cc2ccc(N(C)C)cc2)C1=O	272127233	RELVMUKJGSLOKE-UHFFFAOYSA-N	247.298	1.147	10	20	BDCD	
CS(C)(=O)=NC(=O)Cc1ccc(N)cc1	379772381	AYWPYIFFKNDVPE-UHFFFAOYSA-N	226.301	1.066	10	20	BDCD	
CN(C)c1ccc(CN(C)C(C)(C)C(N)=O)cc1	295644572	GUPDDXSHWFKIPL-UHFFFAOYSA-N	249.358	1.448	10	20	BDCD	
CN1CC[C@H]1CNCc1cc(Cl)ccc1O	712569760	CFEDBZDGEAIKGZ-NSHDSACASA-N	240.734	1.839	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC[C@@H](C)N)c1	817972707	NVQDJRBLEZNTMH-ZJUUUORDSA-N	208.305	1.698	10	20	BDCD	
C[C@H]1C[C@@H](CN)CN1Cc1cccc(F)c1O	843058046	NZRRFYRTVYDVOW-UWVGGRQHSA-N	238.306	1.700	10	20	BDCD	
COCCC(=O)NCc1cc(Cl)ccc1O	846473661	VJSKBYDKUXRMFX-UHFFFAOYSA-N	243.690	1.698	10	20	BDCD	
COC[C@@H](C)NC(=O)c1ccc(C)c(O)c1O	751530537	NOHKKBFBQFCCAX-MRVPVSSYSA-N	239.271	1.171	10	20	BDCD	
C[C@@H](NC1CC1)C(=O)N(C)c1ccc(N)cc1	877078012	ZDDHTJKVTDLCTI-SECBINFHSA-N	233.315	1.372	10	20	BDCD	
Cc1ccc(CN[C@@H]2C=C[C@H](CO)C2)c(O)c1	877159602	ZNVGXOKJRGIAFJ-WCQYABFASA-N	233.311	1.727	10	20	BDCD	
CCC[C@](C)(N)C(=O)N(C)c1ccc(N)cc1	877079114	QZVDAPZKJUYKPU-ZDUSSCGKSA-N	235.331	1.749	10	20	BDCD	
Cc1ccc(CN2CC[C@](C)(O)C2)c(O)c1	876791021	HSMIQHLVJZYACM-ZDUSSCGKSA-N	221.300	1.657	10	20	BDCD	
COc1cccc(CNCC[C@H](C)O)c1O	78780548	UYLNFNWRLJYAID-VIFPVBQESA-N	225.288	1.261	10	20	BDCD	
C[C@@H]1NC(=O)[C@H](C)N(Cc2ccccc2O)[C@H]1C	895117519	VQQCMSYZAWLOIH-DCAQKATOSA-N	248.326	1.490	10	20	BDCD	
CCNC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1	37262452	KNIWGMSXPFYIOT-NSHDSACASA-N	249.358	1.539	10	20	BDCD	
COc1ccc(O)c(CN2CCCNCC2)c1	38087042	PSVIMTBOODTLEV-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1CCCCN1)CCO2	258800265	CWLLXBLVRKMGBU-AWEZNQCLSA-N	246.354	1.853	10	20	BDCD	
CNCCCC(=O)Nc1ccc(N)cc1	237224387	NLVOERYYSZLELM-UHFFFAOYSA-N	207.277	1.207	10	20	BDCD	
Cc1ccc(CNCc2ccn(C)n2)c(O)c1	877125280	JNSFXSVPVOFUNW-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)C[C@H](C)O	877195269	FWVZDSPZDRFHBD-MNOVXSKESA-N	223.316	1.950	10	20	BDCD	
Cc1ccc(CNC[C@@H]2CC[C@@H](O)C2)c(O)c1	877468608	KXUIHLHFVQWGLU-DGCLKSJQSA-N	235.327	1.951	10	20	BDCD	
Cc1cccc(O)c1CN(C)Cc1nncn1C	877529368	APICHKXGXGLDOQ-UHFFFAOYSA-N	246.314	1.461	10	20	BDCD	
C[C@@H](C(=O)O)N1CCCc2cc(CN)ccc21	700883832	UBPOWRMLZVKOHR-VIFPVBQESA-N	234.299	1.371	10	20	BDCD	
C[C@H]1C[C@H](NCc2cc(F)cc(F)c2O)CO1	708483539	DVXZMKNGTZZYSS-XVKPBYJWSA-N	243.253	1.937	10	20	BDCD	
COC[C@H](C)N(C)C(=O)c1cccc(O)c1O	126293141	AYAUFPMGNVEREF-QMMMGPOBSA-N	239.271	1.205	10	20	BDCD	
C[C@H]1C[C@H]1C(=O)NCCc1ccc(N)cc1	40675583	MVYOQRARGBVRBZ-JOYOIKCWSA-N	218.300	1.584	10	20	BDCD	
Cc1cccc(CNCCC[C@@H](C)O)c1O	228090910	RTQSIZVSWHYOMB-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
C[C@H](O)[C@@H]1CCCN(Cc2ccccc2O)C1	136822171	JDVONYTWGVEICU-NWDGAFQWSA-N	235.327	1.985	10	20	BDCD	
CC(=O)N[C@H](C(=O)Nc1ccc(N)cc1)C(C)C	236783114	HIUZCPRHYRGSCC-LBPRGKRZSA-N	249.314	1.368	10	20	BDCD	
CN(C)c1ccc(Cn2cnc([N+](=O)[O-])n2)cc1	292573386	FEAFPEPSHOGNGY-UHFFFAOYSA-N	247.258	1.301	10	20	BDCD	
CCN(CCOCCO)Cc1ccccc1O	800532781	WUJPLYDBBLAGNA-UHFFFAOYSA-N	239.315	1.223	10	20	BDCD	
CC(=O)C(=O)COc1ccc(F)cc1F	808016222	HSBSCYKDRBHWHL-UHFFFAOYSA-N	214.167	1.502	10	20	BDCD	
CCOc1ccc(CNCCCON)c(O)c1	904457945	WLEHEQYFUHILGJ-UHFFFAOYSA-N	240.303	1.161	10	20	BDCD	
Cc1n[nH]cc1CNCCc1ccc(N)cc1	841034423	AQEJRYOVFBYRLW-UHFFFAOYSA-N	230.315	1.633	10	20	BDCD	
Cc1cccc(CNCC2(N)CCC2)c1O	841048712	LCULLSCRVHKBBX-UHFFFAOYSA-N	220.316	1.672	10	20	BDCD	
Cc1cc(CN2CC[C@H](CN)C2)ccc1N(C)C	923281780	PMUYARIXZLTDFP-CQSZACIVSA-N	247.386	1.842	10	20	BDCD	
COCCN[C@H](C)c1c(O)cccc1F	886489568	MBNWKAPWMGVZOG-MRVPVSSYSA-N	213.252	1.828	10	20	BDCD	
C[C@@H](NCCOCCO)c1c(O)cccc1F	886491423	CYZRBZBQALUJOL-SECBINFHSA-N	243.278	1.191	10	20	BDCD	
Nc1ccc(N2C[C@@H]3C[C@H](C2)C3O)cc1	409423685	AGZOPAWJIPSBRZ-USUYBEQLSA-N	204.273	1.086	10	20	BDCD	
COc1cccc(O)c1CN1C[C@H](C)[C@H](O)C1	897684684	VDMZRTZDZTXBSP-JOYOIKCWSA-N	237.299	1.213	10	20	BDCD	
Cn1cnnc1NCc1cc([N+](=O)[O-])ccc1O	162122597	KNQXYJMFFZNYKI-UHFFFAOYSA-N	249.230	1.041	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](O)C1)c1ccc(N(C)C)cc1	850581725	YJZIETOCHFVXQO-JKOKRWQUSA-N	234.343	1.927	10	20	BDCD	
CC[C@H](CCO)NCc1ccc(C)cc1O	877054945	LWMYHYBLRGJRSZ-GFCCVEGCSA-N	223.316	1.951	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CCCNCC2)cc1	370016818	CQXNPOWUGNVYBN-CYBMUJFWSA-N	247.342	1.070	10	20	BDCD	
COc1ccc(CNCc2cc(C)on2)c(O)c1	44693331	ZCVWHBVBAHHFOR-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
CCN(C)CCNCc1cc(F)ccc1O	226588209	UOGYSLNPOPUEKK-UHFFFAOYSA-N	226.295	1.573	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)NCCCO)o1	1537962334	DMLPOQDTMNBSEB-UHFFFAOYSA-N	224.220	1.202	10	20	BDCD	
C[C@H](CO)N(C)Cc1ccc(N(C)C)c(F)c1	289470444	PKNGRPWMAQGKCM-SNVBAGLBSA-N	240.322	1.704	10	20	BDCD	
CCCN[C@H](C)C(=O)NCc1ccccc1O	295197004	OSMPLVYVTDRDIA-SNVBAGLBSA-N	236.315	1.397	10	20	BDCD	
C[C@H](CN)CN[C@H](C)c1ccc(F)cc1O	817962955	PSQFSFXASMLSHY-RKDXNWHRSA-N	226.295	1.777	10	20	BDCD	
CCN(CC(=O)O)Cc1cc2c(cc1O)CCC2	737074211	CNUVXTRVDJVXGH-UHFFFAOYSA-N	249.310	1.787	10	20	BDCD	
C[C@H]1CN(Cc2cccc(F)c2O)CC[C@@H]1N	843051422	HFVBPQZNKFFJFL-CABZTGNLSA-N	238.306	1.700	10	20	BDCD	
C[C@H](N)C[C@@H](C)NCc1cccc(F)c1O	843129578	PXIDOIYLXMHSMR-DTWKUNHWSA-N	226.295	1.747	10	20	BDCD	
O=C(NCc1ccccc1O)C1=COCC1	769361822	ASRLDPHQZQYRQV-UHFFFAOYSA-N	219.240	1.313	10	20	BDCD	
O=C(NCCCCCCO)c1cc(O)cs1	776248758	NYFFKYZHBGNNNV-UHFFFAOYSA-N	243.328	1.736	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](O)C[C@H]2C)c1	788266907	CXUXWLXMQHACHS-PWSUYJOCSA-N	221.300	1.656	10	20	BDCD	
Cc1ccoc1CNC(=O)c1cccc(O)c1O	386829366	QBDCDSBLQOUANX-UHFFFAOYSA-N	247.250	1.929	10	20	BDCD	
Nc1ccc(N2C[C@H](CO)C3(CCC3)C2)cc1	409434832	QUJPRVLYODZQPN-LLVKDONJSA-N	232.327	1.868	10	20	BDCD	
CC1(C)OC[C@@H]2C[C@@]21NCc1ccc(N)cc1	1334753958	KGWMABICENWHJI-SMDDNHRTSA-N	232.327	1.926	10	20	BDCD	
C[C@@H](N)[C@@H]1CCCN(Cc2ccc(N)cc2)C1	1334774813	OXZWRQCUCPYWFC-DGCLKSJQSA-N	233.359	1.828	10	20	BDCD	
CN(Cc1nncs1)Cc1ccccc1O	929971605	PXYKUHKGNOIKSM-UHFFFAOYSA-N	235.312	1.876	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@H]1CCc2cccc(O)c21	383581201	FLIXXCWEWWFSFX-WPRPVWTQSA-N	234.299	1.233	10	20	BDCD	
C[C@H]1C[C@@H](C(=O)O)CN(Cc2ccccc2O)C1	399049890	KPTNWSISZYHDPU-CMPLNLGQSA-N	249.310	1.935	10	20	BDCD	
OCCC1CCN(Cc2ccccc2O)CC1	409422993	KMVDNMYLCYSNET-UHFFFAOYSA-N	235.327	1.987	10	20	BDCD	
CN(C)C(=O)CCNCc1ccc2c(c1)CCO2	37752111	POJLPSBLUCAGSP-UHFFFAOYSA-N	248.326	1.189	10	20	BDCD	
OC1CCN(c2ccc(CNC3CC3)cc2)CC1	34824096	LOBUQXBBRFPQHR-UHFFFAOYSA-N	246.354	1.900	10	20	BDCD	
C[C@H](O)[C@H]1CCN(Cc2cc(F)ccc2O)C1	180861554	DWKXXHQEYMKAFM-UWVGGRQHSA-N	239.290	1.734	10	20	BDCD	
COC[C@@H](O)CCN[C@@H](C)c1ccccc1O	183634008	KRTACYMXVCXYSE-QWRGUYRKSA-N	239.315	1.440	10	20	BDCD	
CC(=O)C(=O)COC(=O)Cc1cccc(F)c1	808486886	LNPORRCJBUIFQM-UHFFFAOYSA-N	238.214	1.070	10	20	BDCD	
C[C@H]1COCCN1C(=O)c1cc(O)cs1	731868541	IXSNLTTYBVIVTN-ZETCQYMHSA-N	227.285	1.315	10	20	BDCD	
NCC[C@H](NCc1cccc(F)c1O)C(F)F	841074943	SMVNTNFUERNBDU-VIFPVBQESA-N	248.248	1.603	10	20	BDCD	
CC(C)[C@@H]1C(=O)NCCN1Cc1ccc(N)cc1	1356083595	UHDDZAJKJWFEJW-CYBMUJFWSA-N	247.342	1.225	10	20	BDCD	
COCCCOC(=O)c1cccc(O)c1O	776281611	ILOIVQZCHWWVBT-UHFFFAOYSA-N	226.228	1.291	10	20	BDCD	
COC[C@@H]1CCCN(C(=O)CN=[N+]=[N-])C1	409432841	WQDSMQAPFFDZMZ-MRVPVSSYSA-N	212.253	1.182	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@H](CO)C2(CCCC2)C1	409431263	JTCOBJFCSWDCAY-SNVBAGLBSA-N	224.308	1.781	10	20	BDCD	
Cn1ncc2c(Sc3nccs3)ncnc21	791406977	AZIWQTFLGJLFJG-UHFFFAOYSA-N	249.324	1.971	10	20	BDCD	
CCn1nccc1C(=O)NCc1ccccc1O	775881332	XIIFQTNWMNOOAQ-UHFFFAOYSA-N	245.282	1.539	10	20	BDCD	
CC[C@@H](F)C(=O)NCCc1ccc(O)c(O)c1	1335855858	ONMIMGWWXKLGSR-SECBINFHSA-N	241.262	1.505	10	20	BDCD	
C[C@@H]1CCN[C@H]([C@H]2CCCC(=O)C2=O)C1	253174099	MKIWVDMMNRFFHU-BBBLOLIVSA-N	209.289	1.313	10	20	BDCD	
NC[C@@H]1CC[C@H](NC(=O)Cc2ccc(N)cc2)C1	834860627	CKRAUQBJEQKKQX-YPMHNXCESA-N	247.342	1.055	10	20	BDCD	
Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1	38055882	JHMFYABGGPNZRG-RYUDHWBXSA-N	207.273	1.951	10	20	BDCD	
Nc1ccc(CN2CCN(C3CCC3)CC2)cc1	378684755	VHZVMNJBDYVQOW-UHFFFAOYSA-N	245.370	1.939	10	20	BDCD	
C[C@@H](NC(=O)C12CC(CN1)C2)c1ccccc1O	1357991796	DQMQIRZGRHNNFQ-NAUIOFCNSA-N	246.310	1.321	10	20	BDCD	
OC[C@@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2	230677342	HQWYTPXLDYVCFX-KBPBESRZSA-N	247.338	1.872	10	20	BDCD	
CCC[C@H](N)C(=O)N(C)Cc1ccccc1O	37823774	FFZFGHGWWUQEDH-NSHDSACASA-N	236.315	1.478	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CCOC2)c1	70955252	QHRVJIXAJCZALB-LLVKDONJSA-N	221.300	1.827	10	20	BDCD	
C[C@H](NCc1ccccc1O)c1cnn(C)c1	135192505	YKXHMFXHNJGHDZ-JTQLQIEISA-N	231.299	1.977	10	20	BDCD	
O=C1OCC[C@@H]1Sc1nccs1	133222540	GYCDOFCAJNPIKX-YFKPBYRVSA-N	201.272	1.551	10	20	BDCD	
Cn1nccc1CCNCc1ccccc1O	231033186	BZKHYAOJINWWSM-UHFFFAOYSA-N	231.299	1.458	10	20	BDCD	
CNCCCN(C)Cc1cc(C)ccc1O	87472124	HGOPBOVCKMZUJB-UHFFFAOYSA-N	222.332	1.742	10	20	BDCD	
COc1cccc(CNC(=O)C2CCC2)c1O	68488653	KGHPOSRFZMRFEL-UHFFFAOYSA-N	235.283	1.817	10	20	BDCD	
O=C(NCc1ccccc1O)C1CCC1	136335007	UFWOZOWPZPUECP-UHFFFAOYSA-N	205.257	1.809	10	20	BDCD	
CN(C(=O)[C@H]1CCCO1)c1ccc(N)cc1	34939052	VFXBTQXFILNPRB-LLVKDONJSA-N	220.272	1.411	10	20	BDCD	
Cc1ccc(O)c(CN2CCO[C@H](C)C2)c1	132474127	IBXBRVKJTCOOEO-LLVKDONJSA-N	221.300	1.921	10	20	BDCD	
CCOC(=O)[C@@H](C)NCc1cccc(C)c1O	83364805	BETKFKFPVGNNSI-SNVBAGLBSA-N	237.299	1.742	10	20	BDCD	
OC[C@@H](NCc1cc(Cl)ccc1O)C1CC1	381631387	QRKKMFUSSAGLPW-LLVKDONJSA-N	241.718	1.906	10	20	BDCD	
OCCc1ccc(NCc2ccccc2O)cn1	808432529	PHFGAQKZQCKZSV-UHFFFAOYSA-N	244.294	1.934	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCn2cncc2C1	812296011	JEKOBLBLJXFOLB-UHFFFAOYSA-N	249.295	1.306	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC2CNC2)c1	817955481	BUCIRZXNTRQNPH-QMMMGPOBSA-N	222.288	1.023	10	20	BDCD	
Oc1c(Cl)cccc1CNC[C@@H]1CCCN1	841036204	PQDPKLDKRSQXNI-JTQLQIEISA-N	240.734	1.887	10	20	BDCD	
C[C@@H](C[C@@H](C)O)NCc1cc(F)cc(F)c1O	708483613	DZBYWRCILWDAHC-JGVFFNPUSA-N	245.269	1.919	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@H](CF)C1	711472637	VNVCEDOLIQMHDD-MRVPVSSYSA-N	239.246	1.529	10	20	BDCD	
Cc1cccc(CN[C@@H](CF)C(=O)O)c1O	1607852263	DMTOZNLWOJBREK-VIFPVBQESA-N	227.235	1.213	10	20	BDCD	
C[C@@H](O)CCSc1ncc(C(=O)O)s1	1609788676	XUCXBNFSWRUCRK-RXMQYKEDSA-N	233.314	1.704	10	20	BDCD	
O=C(O)C1CN(Cc2cc(F)c(F)cc2O)C1	1601848196	GCOKKUSTIXSVRT-UHFFFAOYSA-N	243.209	1.187	10	20	BDCD	
COc1ccc(O)c(CNC2(CO)CCC2)c1	165391459	GBLYHXRSAFDDMR-UHFFFAOYSA-N	237.299	1.405	10	20	BDCD	
C[C@H](C(=O)N(C)Cc1ccccc1O)[C@@H](C)N	156654775	AONQCUZCVVNYFQ-VHSXEESVSA-N	236.315	1.334	10	20	BDCD	
NCc1ccc2c(c1)CCCN2CCCC(=O)O	1601190084	APLFGRAQDODMNO-UHFFFAOYSA-N	248.326	1.763	10	20	BDCD	
c1nc(CNCc2ccc3c(c2)CCO3)c[nH]1	112344923	JSUJMTSDOIJYEZ-UHFFFAOYSA-N	229.283	1.634	10	20	BDCD	
COc1ccc(N(C)CC(=O)N(C)C)cc1F	121820665	FJQVRBZOPFECOR-UHFFFAOYSA-N	240.278	1.359	10	20	BDCD	
COC[C@@H](C)CC(=O)NCc1ccccc1O	122673144	OEHVJJNTMBNXHM-JTQLQIEISA-N	237.299	1.681	10	20	BDCD	
CC[C@@H](N[C@@H](C)CC(N)=O)c1ccccc1O	136100976	XFJLXWAYNKYDFC-GXSJLCMTSA-N	236.315	1.697	10	20	BDCD	
CN(Cc1cc(F)ccc1O)[C@H]1CCNC1	220108394	QWQIWMUGIGGBNM-NSHDSACASA-N	224.279	1.325	10	20	BDCD	
CC(=O)N[C@@H](C(=O)Nc1ccc(N)cc1)C(C)C	236728856	HIUZCPRHYRGSCC-GFCCVEGCSA-N	249.314	1.368	10	20	BDCD	
Cc1cccc(CN2CCO[C@@H](C)C2)c1O	162807681	XAMAMVMHGJJHTN-NSHDSACASA-N	221.300	1.921	10	20	BDCD	
OC[C@H]1C=C[C@@H](N[C@H]2CCc3cccc(O)c32)C1	296979814	RWZFEWREFMRIKD-UHTWSYAYSA-N	245.322	1.906	10	20	BDCD	
COC[C@H](C)CNC(=O)c1cc(O)cs1	732277620	OXOKCZCCCGNVTQ-SSDOTTSWSA-N	229.301	1.466	10	20	BDCD	
CC(C)(CC(=O)O)NCc1cc(F)ccc1O	833456535	ZNVXBCDYIDHTOJ-UHFFFAOYSA-N	241.262	1.874	10	20	BDCD	
CNC[C@H]1CCCN1Cc1cccc(F)c1O	843056157	VTQXVSXKDPPXBG-LLVKDONJSA-N	238.306	1.715	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCOCC12CC2	854384291	SEEROMCKHPOWGP-UHFFFAOYSA-N	239.296	1.459	10	20	BDCD	
COCCOC(=O)/C=C/c1ccc(O)c(O)c1	772768543	KOLGJWVWYHLLAB-HWKANZROSA-N	238.239	1.301	10	20	BDCD	
Cc1ccc(CN2CC[C@@](C)(O)C2)c(O)c1	876791020	HSMIQHLVJZYACM-CYBMUJFWSA-N	221.300	1.657	10	20	BDCD	
C[C@@H](CC(N)=O)NCc1cc(F)cc(F)c1O	708453185	FKOTWSVREGPVQM-LURJTMIESA-N	244.241	1.024	10	20	BDCD	
C[C@@H](O)[C@@H](C)NCCCSc1nccs1	1327976845	AOTJTOWCOATBFE-RKDXNWHRSA-N	246.401	1.984	10	20	BDCD	
COC(=O)c1cc(Cl)c(O)c(O)c1C	1904240074	DRIFJUQEJLRZPK-UHFFFAOYSA-N	216.620	1.846	10	20	BDCD	
CN(C(=O)CC(C)(C)CN)c1ccc(N)cc1	1344368934	OALJRKCONWPRNT-UHFFFAOYSA-N	235.331	1.607	10	20	BDCD	
O=C1CCC[C@@H](C(=O)C(F)(F)F)C1=O	122646138	CLOLCNMFFLMEGX-SCSAIBSYSA-N	208.135	1.056	10	20	BDCD	
CC(C)OCCC(=O)NCc1ccc(N)cc1	296824400	ATJGFAOKXYATKE-UHFFFAOYSA-N	236.315	1.700	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2CCOC2)cc1	20146109	XULANGVEKFNLNT-CYBMUJFWSA-N	234.343	1.879	10	20	BDCD	
O=C(NCc1ccccc1O)NCC(F)(F)F	133741954	CRWDAHIPKVGFLZ-UHFFFAOYSA-N	248.204	1.754	10	20	BDCD	
NCC1CCN(C(=O)Cc2ccc(N)cc2)CC1	238031395	WIJKUTIERZYCNE-UHFFFAOYSA-N	247.342	1.009	10	20	BDCD	
C[C@@H]1C[C@H]1CNC(=O)NCc1ccccc1O	299495912	KRHDJKHXJSSWTK-KOLCDFICSA-N	234.299	1.847	10	20	BDCD	
N[C@@H](CN[C@H]1CCc2cccc(O)c21)C1CC1	817964768	HJHGBZGWEIIBHN-RYUDHWBXSA-N	232.327	1.706	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)O	738401439	CITACLBKIUJQGW-UHFFFAOYSA-N	208.261	1.829	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@H]1CO	831264061	ZBKGIXAUWLAKRQ-ZETCQYMHSA-N	227.285	1.051	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](C)C[C@@H](C)N	843126782	ADLVKWBAOSNCEB-ZJUUUORDSA-N	238.331	1.616	10	20	BDCD	
CC1(OCC(=O)NCc2ccccc2O)CCC1	746240360	OAGVMPHBNNEFAC-UHFFFAOYSA-N	249.310	1.968	10	20	BDCD	
Cc1cc(O)c(CN2CCCNCC2)cc1C	843047754	ZSIPRUMPPZXQII-UHFFFAOYSA-N	234.343	1.804	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H](O)[C@@H](C)C1	877433985	LCLVUBDQFLSKHU-WCQYABFASA-N	235.327	1.903	10	20	BDCD	
CNC(=O)CCCC(=O)N(C)c1ccc(N)cc1	877075520	FCCSVAQWCZEETC-UHFFFAOYSA-N	249.314	1.148	10	20	BDCD	
CS[C@H](C)C(=O)NCc1cccc(O)c1O	1123890515	YYWHCEWOHQBEMB-SSDOTTSWSA-N	241.312	1.466	10	20	BDCD	
C[C@H](NCc1cc(F)cc(F)c1O)C(C)(C)O	708394067	OQDKBBPXQLANAQ-ZETCQYMHSA-N	245.269	1.919	10	20	BDCD	
O=[N+]([O-])c1cnc(S[C@H]2CCOC2)s1	799960407	UHOBDVQDHTYGBA-YFKPBYRVSA-N	232.286	1.932	10	20	BDCD	
CN(C(=O)[C@@H]1[C@H]2CCC(=O)[C@H]21)c1ccc(N)cc1	1263168848	XZLFUYRACNEVON-WCFLWFBJSA-N	244.294	1.457	10	20	BDCD	
Nc1ccc(CNC[C@H]2CCCCN2)cc1	1345159463	HANWSTLJYODUGB-CYBMUJFWSA-N	219.332	1.501	10	20	BDCD	
CN(C(=O)C1(N(C)C)CC1)c1ccc(N)cc1	1522216081	HGQGHWDVUOAPAH-UHFFFAOYSA-N	233.315	1.326	10	20	BDCD	
C/C(=C/C(=O)O)CN(C)Cc1ccccc1O	1602955221	MZMBGHVZPPAJSI-YFHOEESVSA-N	235.283	1.855	10	20	BDCD	
C[C@H](N)CCNCc1ccc(Cl)cc1O	1579480280	ZZOFJEDUYQPPDK-QMMMGPOBSA-N	228.723	1.873	10	20	BDCD	
CCNCCNCc1ccc(N(C)C)cc1	161330604	GFUQSYHKPBYXQT-UHFFFAOYSA-N	221.348	1.452	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H](C)CCO	877067472	IEBWARNXZFDFQH-SNVBAGLBSA-N	223.316	1.809	10	20	BDCD	
CNC(=O)C[C@@H](C)NCc1c(C)cccc1O	877571824	AHFKZLWNOYWQKK-SNVBAGLBSA-N	236.315	1.315	10	20	BDCD	
C[C@@H](NCc1c(O)ccc(Cl)c1F)C(=O)O	309811336	ZCORIXUKRRALCA-RXMQYKEDSA-N	247.653	1.747	10	20	BDCD	
C[C@@H](N[C@H]1CCCNC1)c1ccccc1O	817939745	BMYSOVIDKKVCGA-MNOVXSKESA-N	220.316	1.795	10	20	BDCD	
NCCC1CCN(Cc2ccccc2O)CC1	70183418	BDAYFKBEOUWHSL-UHFFFAOYSA-N	234.343	1.953	10	20	BDCD	
CCN[C@H](C)CNCc1cc(C)ccc1O	841066972	YEXCHUYJTXTTRC-LLVKDONJSA-N	222.332	1.788	10	20	BDCD	
O=C(c1cc(O)cs1)N(C1CC1)C1COC1	854680885	TVEICVLPVKTEKE-UHFFFAOYSA-N	239.296	1.457	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCCO2)c1	862758397	XMAWCOUFWHQQPL-LBPRGKRZSA-N	235.283	1.496	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1N	1120263590	SLBFGUALBDLJBX-MFKMUULPSA-N	219.332	1.438	10	20	BDCD	
Cc1cccc(CN2C[C@@H](O)[C@H](C)C2)c1O	897681626	XSTYFWGMVUACMM-ZYHUDNBSSA-N	221.300	1.513	10	20	BDCD	
COc1cccc(CN[C@@H]2CC[C@H]2O)c1O	393952353	ZKGYKZZQMAQRTQ-NXEZZACHSA-N	223.272	1.014	10	20	BDCD	
COc1cc(C)cc(CNCCCCO)c1O	894580873	XOHQFYHBAWCVMX-UHFFFAOYSA-N	239.315	1.571	10	20	BDCD	
Cc1ocnc1C(=O)NCc1ccccc1O	729529881	MAISMEDJUVXGQI-UHFFFAOYSA-N	232.239	1.619	10	20	BDCD	
CN(CCCN1CCOCC1)c1ccc(N)cc1	118758154	IYXNZSARLMNKIK-UHFFFAOYSA-N	249.358	1.427	10	20	BDCD	
C[C@@H](N)C(=O)NCc1c(O)ccc2c1CCCC2	157364345	QXSRCUCOMYOENR-SECBINFHSA-N	248.326	1.234	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@@H](C)CO)c1	35629073	RIBKYERJTKUHEX-VHSXEESVSA-N	209.289	1.732	10	20	BDCD	
c1cc(N2CCNCC2)ccc1OCC1CC1	36765344	XIHAVDSCJHTRFO-UHFFFAOYSA-N	232.327	1.885	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C2CC2)c1	78726215	CSHXNVSQVMKBKR-UHFFFAOYSA-N	221.256	1.427	10	20	BDCD	
COC[C@@H](C)CNCc1cc(OC)ccc1O	45656950	QROXKVOFYJUQFG-JTQLQIEISA-N	239.315	1.773	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H]2C[C@@H](O)C2)c(O)c1	295851586	DYLBHEQSEROZOG-GARJFASQSA-N	221.300	1.875	10	20	BDCD	
CO[C@H]1COC[C@@H]1N[C@H]1CCc2cccc(O)c21	297441337	WEQDVSWZTPHSTD-GVXVVHGQSA-N	249.310	1.383	10	20	BDCD	
C[C@H](N)CN[C@@H](C)c1ccc(F)cc1O	817972238	KLTCAIXGKILTEB-YUMQZZPRSA-N	212.268	1.529	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@@H](C)O	840928561	YSKLMEFJJHDYAH-LLVKDONJSA-N	222.332	1.531	10	20	BDCD	
C[C@@H]1CCCN(Cc2ccc(N)cc2)[C@H]1CN	1120263966	YGYDIFMYWQDIHU-RISCZKNCSA-N	233.359	1.828	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3CN(C)C[C@@H]3C2)c1O	194536080	FSXVVPGYUGRVJE-OKILXGFUSA-N	246.354	1.694	10	20	BDCD	
CCOc1ccc(N2CCN(C(C)=O)CC2)cc1	201614537	LUSGMOGXLNKHJP-UHFFFAOYSA-N	248.326	1.754	10	20	BDCD	
CC(C)OC(=O)CN[C@H](C)c1ccccc1O	308762796	HAXDGCLDSBZJMB-SNVBAGLBSA-N	237.299	1.994	10	20	BDCD	
CCc1cccc(CNC[C@@H](O)COC)c1O	709414398	CDCNVNCWQAHLNW-GFCCVEGCSA-N	239.315	1.052	10	20	BDCD	
Cc1ccc(CN2CCOC[C@@H]2C)c(O)c1	876610852	KEDJJIOIGAAZNH-NSHDSACASA-N	221.300	1.921	10	20	BDCD	
OC/C=C/CNCc1ccc(N2CCCC2)cc1	717536509	ZENMJUIHBMEKEM-DAFODLJHSA-N	246.354	1.925	10	20	BDCD	
CNCCCN(C)Cc1cc(OC)ccc1O	124753179	REPWSVLDNGVMKH-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
CO[C@@]1(CNCc2ccccc2O)CCOC1	122961471	XSBIVXDZLSJNFO-CYBMUJFWSA-N	237.299	1.287	10	20	BDCD	
O=C(O)C1(NCc2ccc3c(c2)CCO3)CCC1	284270497	PQQARTYEQQTDOD-UHFFFAOYSA-N	247.294	1.718	10	20	BDCD	
C[C@@H](N[C@H]1CCOC1)c1ccc(F)cc1O	87783776	GSDUQCYMOQLTPU-SCZZXKLOSA-N	225.263	1.971	10	20	BDCD	
COC[C@H](C)CC(=O)NCc1ccc(N)cc1	95033959	KAWRSGRVDUWFEX-SNVBAGLBSA-N	236.315	1.558	10	20	BDCD	
C[C@]1(C(=O)Nc2ccc(N)cc2)CCCNC1	237772563	CDIRJCSLFYDWDD-ZDUSSCGKSA-N	233.315	1.597	10	20	BDCD	
COc1cccc(CN[C@@H](C)CCO)c1O	96811446	BXCMUMWKWMLRFI-VIFPVBQESA-N	225.288	1.261	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCC(C)(C)N)c1	817960568	OKAGZENZMJUEBO-VIFPVBQESA-N	238.331	1.789	10	20	BDCD	
COC(=O)CN(Cc1ccc(C)cc1O)C1CC1	876801111	VCMDKBWFZSDVPR-UHFFFAOYSA-N	249.310	1.838	10	20	BDCD	
C[C@H](N[C@H](C)c1ncnn1C)c1ccccc1O	276698317	VKGVPXKGQMDEAH-VHSXEESVSA-N	246.314	1.933	10	20	BDCD	
CC1(NCc2cc(F)cc(F)c2O)COC1	895445404	ZJHLMQSICAEDHC-UHFFFAOYSA-N	229.226	1.549	10	20	BDCD	
Cc1ccc(O)c(CNCCN2CCCC2=O)c1	405398917	KXZWJLUETWUPOK-UHFFFAOYSA-N	248.326	1.413	10	20	BDCD	
C[C@@H]1NCCC[C@H]1NCc1ccc(N(C)C)cc1	396726135	YSWDGASQCPBEAK-SWLSCSKDSA-N	247.386	1.983	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](CO)C1)c1ccccc1O	927151664	YMLXWCVQSWSBQC-DCAQKATOSA-N	221.300	1.814	10	20	BDCD	
CN[C@@H](C)C(=O)N[C@H](C)c1ccccc1O	870988577	TZVQAIOUADXMDP-BDAKNGLRSA-N	222.288	1.177	10	20	BDCD	
COc1cccc(CN[C@@H]2CCO[C@H]2C)c1O	134247249	AAENLCDLRXBGHD-GXSJLCMTSA-N	237.299	1.668	10	20	BDCD	
COC(=O)[C@H](C)NCc1ccccc1O	37073849	GFYYFTHUQFUFNK-QMMMGPOBSA-N	209.245	1.043	10	20	BDCD	
C[C@@H]1NCCN(Cc2ccc(N(C)C)cc2)[C@@H]1C	379472685	SYFZBMOIWSHATP-QWHCGFSZSA-N	247.386	1.935	10	20	BDCD	
CO[C@H](C)C(=O)NCc1ccc(N(C)C)cc1	49086464	PUOUPJKVEPUAKD-SNVBAGLBSA-N	236.315	1.404	10	20	BDCD	
C[C@H](CC[S@](C)=O)NCc1ccccc1O	131297757	RIHUFTMVZIWJMN-QLJPJBMISA-N	241.356	1.639	10	20	BDCD	
C[C@@H]1CNCCN1Cc1cc(Cl)ccc1O	83368872	AESBLMFNBKDVMY-SECBINFHSA-N	240.734	1.839	10	20	BDCD	
CC[C@@H]1C[C@H]1NC(=O)NCc1ccccc1O	281666185	YJZZDSGHJAGBFG-MWLCHTKSSA-N	234.299	1.990	10	20	BDCD	
Cc1ccc([C@H](C)NCC(F)(F)CN)c(O)c1	817966259	JTDKPHLMQSGJRD-VIFPVBQESA-N	244.285	1.945	10	20	BDCD	
C[C@@H](N)CN[C@H](C)c1cc(F)ccc1O	817972759	OIOFJEYESTZWBM-HTQZYQBOSA-N	212.268	1.529	10	20	BDCD	
Nc1ccc(CCNC(=O)NCCF)cc1	841959761	QNXDHHSDLOPGHF-UHFFFAOYSA-N	225.267	1.080	10	20	BDCD	
N[C@H]1C[C@H](CN[C@@H]2CCc3cccc(O)c32)C1	873256261	NJAQSOLUJJUPBW-YUSALJHKSA-N	232.327	1.706	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)C[C@H]1O	897684466	PPMTWQJDBJEWHT-JOYOIKCWSA-N	207.273	1.205	10	20	BDCD	
Cc1ccc(O)c(CN2CC3(CCOC3)C2)c1	1140617335	NTHNYAZWUKZWIS-UHFFFAOYSA-N	233.311	1.923	10	20	BDCD	
C[C@@H](CN)CNCc1ccc2c(c1)CCO2	258798210	QZQCORAIHOJZRK-JTQLQIEISA-N	220.316	1.306	10	20	BDCD	
CNC(=O)C[C@H](C)NCc1c(C)cccc1O	877571822	AHFKZLWNOYWQKK-JTQLQIEISA-N	236.315	1.315	10	20	BDCD	
COc1cc(CN(C)c2ccc(N)cc2)on1	705608974	JWYPWUQEMSIVOS-UHFFFAOYSA-N	233.271	1.902	10	20	BDCD	
Oc1ccccc1CN1CC[C@@H]2CNC[C@@H]21	385374163	LVOVVPMSGUIMBU-PWSUYJOCSA-N	218.300	1.186	10	20	BDCD	
CC[C@H](CO)N(C)Cc1ccccc1O	295027390	CVNCIPZGPIYXGH-LLVKDONJSA-N	209.289	1.595	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H](N)C2CCC2)cc1	817859014	LTUSMIFPOJYLNS-CYBMUJFWSA-N	247.342	1.055	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCO[C@@H]1C)c1ccccc1O	827940333	AWBVTEWEMKHXSR-FOGDFJRCSA-N	249.310	1.994	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCN(C)CC1	840907338	CPEIUSYFGAYFPN-UHFFFAOYSA-N	247.386	1.808	10	20	BDCD	
Oc1ccccc1CNCC[C@H]1CCNC1	841037891	ZMRKYCKNLNWSHH-LLVKDONJSA-N	220.316	1.481	10	20	BDCD	
Cc1ccc(C(=O)N2CC[C@H]3C[C@@H]3C2)c(O)c1O	856060695	ATORDSXQUUSHIJ-VHSXEESVSA-N	247.294	1.888	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2CC2)c1	862761768	WYNGXDDMSKTQOA-UHFFFAOYSA-N	205.257	1.727	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](O)C1)c1c(O)cccc1F	886639537	FVEWUDVJLUXPCT-CIUDSAMLSA-N	225.263	1.705	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@H]2CCCC[C@@]2(CO)C1	409435216	SZBRCKWOLJYBGI-MNOVXSKESA-N	224.308	1.781	10	20	BDCD	
C[C@H](O)[C@@H]1CCN(Cc2ccc(N)cc2)C1	161633016	JNWIGMWTZLGXSS-CMPLNLGQSA-N	220.316	1.472	10	20	BDCD	
CNC(=O)CCNCc1ccc2c(c1)CCCO2	921593117	QYNFWANYPZMGQS-UHFFFAOYSA-N	248.326	1.237	10	20	BDCD	
C[C@@H]1COC[C@H]1NCc1ccc(N(C)C)cc1	688042864	JNTYCMZLUBDGFK-BXUZGUMPSA-N	234.343	1.877	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C1(CN)CCC1	385110906	CTSAHXQZDNGHER-UHFFFAOYSA-N	238.306	1.845	10	20	BDCD	
COCc1noc(CSc2nccs2)n1	171803093	BOMYUBAEHGMWPC-UHFFFAOYSA-N	243.313	1.965	10	20	BDCD	
CCOCC(=O)NCc1ccccc1O	157876771	XZEQGMJDNHBMBQ-UHFFFAOYSA-N	209.245	1.045	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](CO)C(C)C)c1	80789550	ZXNKPMFNZCLYKO-GFCCVEGCSA-N	223.316	1.807	10	20	BDCD	
CCOc1ccc(CN[C@@H](C)COC)c(O)c1	725844029	JYACYNASOVQBMK-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
CN(Cc1ccccc1O)C1(CO)CCC1	827903657	NFEJTXFSFFKSSK-UHFFFAOYSA-N	221.300	1.739	10	20	BDCD	
O=C(NCc1ccoc1)c1cc(O)cs1	732278214	XNWSCYPLCKIECJ-UHFFFAOYSA-N	223.253	1.977	10	20	BDCD	
Cc1nccc(CNC(=O)c2cc(O)cs2)n1	731870793	PCZKTZLMCACQIT-UHFFFAOYSA-N	249.295	1.482	10	20	BDCD	
O=C(NO[C@@H]1CCCCO1)c1cc(O)cs1	731872444	KOGGHAFVLCAQPB-SECBINFHSA-N	243.284	1.642	10	20	BDCD	
C[C@H](NC(=O)c1cc(O)cs1)[C@H]1CCOC1	743670885	VXHILZCFHYMAMO-YUMQZZPRSA-N	241.312	1.609	10	20	BDCD	
N[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1	843043969	RIZCZEWEHFCOKE-SNVBAGLBSA-N	240.734	1.969	10	20	BDCD	
NCC[C@@H](NCc1ccc(N)cc1)C(F)(F)F	1120269589	UVHNFVYZINEDCA-SNVBAGLBSA-N	247.264	1.638	10	20	BDCD	
O=C(O)c1scc(Br)c1O	84227793	YMLAKKSHBUZQFA-UHFFFAOYSA-N	223.047	1.914	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@@H]1CCCN1C	92621897	BBNOHNGXYFLDQN-AWEZNQCLSA-N	233.359	1.795	10	20	BDCD	
C[C@@H](CCO)Sc1ncc([N+](=O)[O-])s1	226777888	BXTLIUTZWRIFQY-YFKPBYRVSA-N	234.302	1.914	10	20	BDCD	
Cc1cccc(CN(C)C[C@@H](C)C(=O)O)c1O	1600531309	MOPYHCMIIOSMTG-SNVBAGLBSA-N	237.299	1.853	10	20	BDCD	
CCN(CC(=O)NC)Cc1c(C)cccc1O	876577845	QTEHJRJEMNGBAD-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CC1(C)[C@@H](N)C[C@H]1NC(=O)Cc1ccc(N)cc1	884348437	ZFIGXWRVXIIBTA-NWDGAFQWSA-N	247.342	1.053	10	20	BDCD	
Oc1cccc2c1[C@@H](NCc1ncccn1)CC2	702323156	HADSMENJEUUAGW-NSHDSACASA-N	241.294	1.959	10	20	BDCD	
Cc1cccc(CNCCc2cnccn2)c1O	389948744	NCLAFRJLGCZOTA-UHFFFAOYSA-N	243.310	1.823	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2[C@H]3CCCO[C@H]32)cc1	1346219179	GOPXHKSOPSFNEO-JHJVBQTASA-N	246.310	1.310	10	20	BDCD	
Cc1ccc(CN2CCC[C@@H]2CO)c(O)c1	196423292	IJZGPIBXDXORGG-GFCCVEGCSA-N	221.300	1.657	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)CN	829764641	RFRCJRICWPVFAA-LLVKDONJSA-N	249.358	1.272	10	20	BDCD	
COc1ccc(N(CC(N)=O)CC(C)C)cc1	746170867	JTDGJPGPXRVTMR-UHFFFAOYSA-N	236.315	1.643	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2CC(=O)C2)c1	862758233	TYFPIUOQYORFBR-UHFFFAOYSA-N	233.267	1.296	10	20	BDCD	
NCCCCCC(=O)Nc1ccc(N)cc1	169816779	MKODFUQULNKJQM-UHFFFAOYSA-N	221.304	1.726	10	20	BDCD	
COCC1(C)CN(C(=O)c2cc(O)cs2)C1	791040155	BNUBDVYJNAKJEG-UHFFFAOYSA-N	241.312	1.562	10	20	BDCD	
COc1ccc(O)c(CN2[C@H]3CC[C@H]2COC3)c1	695060039	LDKLAWDHZHVEAF-RYUDHWBXSA-N	249.310	1.764	10	20	BDCD	
C[C@@]1(NC(=O)NCc2ccc(N)cc2)CCOC1	1357791576	OCESUZCPKHGICL-CYBMUJFWSA-N	249.314	1.247	10	20	BDCD	
Oc1ccccc1CN1CCC2(CCNC2)CC1	843128409	XIWBZYLWGVMNDS-UHFFFAOYSA-N	246.354	1.968	10	20	BDCD	
Cc1ccc(CNC[C@H](C)CCO)c(O)c1	877068497	XSZMJNWGUHYVHD-LLVKDONJSA-N	223.316	1.809	10	20	BDCD	
Cc1ccc(CN[C@](C)(CO)C2CC2)c(O)c1	877159041	REYSKXLKNXTSGX-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
CO[C@@H](C)CCNC(=O)c1cccc(O)c1O	280764149	YFOJIEWYWZQGMR-QMMMGPOBSA-N	239.271	1.253	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCCS2)cc1	69979619	LSAVVPUSZXQQLZ-LLVKDONJSA-N	236.340	1.781	10	20	BDCD	
CCC(=O)NCc1ccc(N(C)C)cc1	61077367	FWVPFFAQHLHIHZ-UHFFFAOYSA-N	206.289	1.779	10	20	BDCD	
CCNC(=O)NC(=O)CSc1nccs1	48874675	KDWSFJXUWDVXLU-UHFFFAOYSA-N	245.329	1.081	10	20	BDCD	
CN(CCO)Cc1cccc(Cl)c1O	132474947	DEHMKZIRUBBQKC-UHFFFAOYSA-N	215.680	1.470	10	20	BDCD	
Cc1cccc(CNCc2ccno2)c1O	231881733	OOOXPKDYLYCHQW-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
N=C(N)NCc1c(O)ccc2c1CCCC2	266123834	NGZISJUPCYDRCJ-UHFFFAOYSA-N	219.288	1.254	10	20	BDCD	
C[C@@H](NC1CNC1)c1cc(F)cc(F)c1O	817956115	QXRHFSCZKXVYCS-ZCFIWIBFSA-N	228.242	1.293	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCC2(N)CC2)c1	902408160	XHPHONPOFUZVBG-JTQLQIEISA-N	220.316	1.843	10	20	BDCD	
Cc1cc(O)c(CNC[C@@H]2CCCN2)cc1C	841036047	NPIAWVOWYOORFM-ZDUSSCGKSA-N	234.343	1.851	10	20	BDCD	
OC[C@H](CCF)NCc1ccc2c(c1)CCO2	846097525	QSOVDWXRLWBXAI-LBPRGKRZSA-N	239.290	1.432	10	20	BDCD	
C[C@H](O)CCN[C@@H](C)c1c(O)cccc1F	886528369	KYTYRYSAZGNXQB-IUCAKERBSA-N	227.279	1.953	10	20	BDCD	
Cc1cc(C(=O)N(C)Cc2ccccc2O)on1	107758929	SNJRIKCFOWEWBL-UHFFFAOYSA-N	246.266	1.961	10	20	BDCD	
CCn1nncc1CNCc1c(C)cccc1O	877648789	VNWVTAPSFZWKQV-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
CC1(C)[C@@H](N)C[C@@H]1NC(=O)Cc1ccc(N)cc1	884348438	ZFIGXWRVXIIBTA-RYUDHWBXSA-N	247.342	1.053	10	20	BDCD	
C[C@H](NCc1ccc(N(C)C)cc1)[C@H]1CCCN1	400714372	FHLTUKRMAUATTN-SWLSCSKDSA-N	247.386	1.983	10	20	BDCD	
Oc1cccc2c1[C@H](NCCn1cccn1)CC2	394143686	MTMQPONQDYTTBA-GFCCVEGCSA-N	243.310	1.866	10	20	BDCD	
C[C@H](N)C1CCN(Cc2ccccc2O)CC1	104136512	YCBPLBAJGDFXCX-NSHDSACASA-N	234.343	1.951	10	20	BDCD	
COC[C@H](C)CC(=O)NCc1ccccc1O	122673336	OEHVJJNTMBNXHM-SNVBAGLBSA-N	237.299	1.681	10	20	BDCD	
CCNCc1ccc(N2CCC(O)CC2)cc1	34824099	OHXSJBIDWLLEBA-UHFFFAOYSA-N	234.343	1.757	10	20	BDCD	
CCN(Cc1cccc(C)c1O)[C@@H]1CCNC1=O	281785889	NOHVFFSXBWNYPE-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
C[C@@H]1CN(c2ccc(N)cc2)CC[C@H]1O	253203831	VLDZSYJUOOYEJH-BXKDBHETSA-N	206.289	1.476	10	20	BDCD	
COCCN(C)Cc1cc(C)ccc1O	132703700	YCVVFCBDLUXTCJ-UHFFFAOYSA-N	209.289	1.779	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCCCN1	132520398	HBLZEVQKGCKQJD-NSHDSACASA-N	234.299	1.151	10	20	BDCD	
C[C@H](N[C@H](C)CN)c1ccc(N(C)C)cc1	817966842	WXTMJRLROFBMPS-MNOVXSKESA-N	221.348	1.750	10	20	BDCD	
CN(CCC(=O)O)Cc1cccc(F)c1O	820586354	UUJKQVHURPYXRD-UHFFFAOYSA-N	227.235	1.438	10	20	BDCD	
COC(=O)[C@@H]1CCC[C@@H]1NCc1ccccc1O	824703188	XUMFJJQFVQDQKZ-NEPJUHHUSA-N	249.310	1.824	10	20	BDCD	
CC(=O)NCCCOC(=O)c1cc(O)cs1	732354890	VPCHTFOGXQPRLU-UHFFFAOYSA-N	243.284	1.137	10	20	BDCD	
NCC[C@@H](NCc1cccc(F)c1O)C(F)F	841074942	SMVNTNFUERNBDU-SECBINFHSA-N	248.248	1.603	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)[C@H](C)CN	843051901	MFZLYNZXLHRZJN-GFCCVEGCSA-N	235.375	1.840	10	20	BDCD	
OC[C@@H](CCF)NCc1cc(Cl)ccc1O	846097264	PACUQUPJQJIXLJ-SNVBAGLBSA-N	247.697	1.856	10	20	BDCD	
CCN(CCN)Cc1ccc(N(C)C)cc1C	863643956	DLOHTDFCFJYEBN-UHFFFAOYSA-N	235.375	1.842	10	20	BDCD	
Cc1cc(O)c(CN2C[C@@H]3CC[C@H](C2)N3)cc1C	873218044	XVHILYRMTVNAJT-OKILXGFUSA-N	246.354	1.945	10	20	BDCD	
Cc1nonc1CN[C@@H](C)c1ccccc1O	775129618	GZPQNUDSLYZVLJ-QMMMGPOBSA-N	233.271	1.934	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@H](CO)[C@@H](C(F)(F)F)C1	409426708	CUNXOWDRISEPJD-RQJHMYQMSA-N	238.213	1.399	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2CCC[C@@H](N)C2)cc1	1343566677	JQCWRVFKYZSPDT-DGCLKSJQSA-N	247.342	1.403	10	20	BDCD	
CNC[C@H](C)CNCc1cc(Cl)ccc1O	1345100670	USKRMWJVLVMJTR-VIFPVBQESA-N	242.750	1.991	10	20	BDCD	
COC(=O)CN(C)Cc1cccc(Cl)c1O	179710335	FYHRQNVMLRRPKN-UHFFFAOYSA-N	243.690	1.650	10	20	BDCD	
O=C(NCc1ccccc1O)c1cccnc1	82278870	CPEJASSODPHVFE-UHFFFAOYSA-N	228.251	1.717	10	20	BDCD	
COc1ccc(N(C)CC(C)=O)cc1OC	258885781	IPYIVBPJQJKDEP-UHFFFAOYSA-N	223.272	1.729	10	20	BDCD	
Cc1ccc([C@H](C)NCCN)c(O)c1C	817935488	WVBUEESJLPXQCA-JTQLQIEISA-N	208.305	1.618	10	20	BDCD	
Cc1cccc(CN(CC(=O)O)C(C)C)c1O	821111969	DIZUOGSECSWSHG-UHFFFAOYSA-N	237.299	1.996	10	20	BDCD	
CCc1cccc(CN2CC(=O)N(C)C2)c1O	848902504	OYYAPXFCDCYMMW-UHFFFAOYSA-N	234.299	1.186	10	20	BDCD	
Nc1ccc(Cc2noc([C@H]3CCOC3)n2)cc1	843159017	KRZQQHPIWAEQHQ-JTQLQIEISA-N	245.282	1.747	10	20	BDCD	
Nc1ccc(CC(=O)N2CC[C@@H]3C[C@H]3C2)cc1	699143439	CAEQMBTXMMUKPR-NEPJUHHUSA-N	230.311	1.680	10	20	BDCD	
CCc1csc(SCC(=O)C(C)=O)n1	865386704	OWCWVLORNIYIKR-UHFFFAOYSA-N	229.326	1.956	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCCO2)c1	862758396	XMAWCOUFWHQQPL-GFCCVEGCSA-N	235.283	1.496	10	20	BDCD	
Cc1cccc(O)c1CN(C)CCOCCO	877502641	OTPJQQYSTCZDJJ-UHFFFAOYSA-N	239.315	1.141	10	20	BDCD	
COCC1CN(Cc2cc(F)cc(F)c2O)C1	895976991	XDDIPURYBLQUAB-UHFFFAOYSA-N	243.253	1.749	10	20	BDCD	
CC(=O)OC[C@H](C)N[C@H](C)c1ccccc1O	895852227	RUAOOHHROVOEAM-VHSXEESVSA-N	237.299	1.994	10	20	BDCD	
[N-]=[N+]=NCC(=O)N(CCO)Cc1ccccc1	409430992	YCGWYEUZHKDAOS-UHFFFAOYSA-N	234.259	1.318	10	20	BDCD	
CO[C@H]1C[C@H](NC(=O)c2cccc(O)c2O)C1	706637573	OOWOHYBKCCVRLM-ZKCHVHJHSA-N	237.255	1.005	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)C[C@H]1CN	1205317942	QXLSHAPMSMURMJ-WCQYABFASA-N	233.359	1.686	10	20	BDCD	
Nc1ccc(CNC(=O)NC[C@@H]2CCOC2)cc1	1335420109	FJXZBUIHEHYXCF-NSHDSACASA-N	249.314	1.105	10	20	BDCD	
CC(C)[C@H](C(=O)NCc1ccc(N)cc1)[C@H](C)N	1515331481	FFDFRQPUJDECCT-GWCFXTLKSA-N	249.358	1.504	10	20	BDCD	
CC[C@@]1(C(=O)NCc2ccccc2O)CCCN1	228420580	LKUIGXQAPNQIRL-AWEZNQCLSA-N	248.326	1.541	10	20	BDCD	
CC1(NC(=O)c2cccc(O)c2O)CCC1	163279423	GIIPVEQCYREZGR-UHFFFAOYSA-N	221.256	1.770	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@@H](C)c1ccc(F)cc1O	168828041	WALTZGSTMGJHEM-YUMQZZPRSA-N	240.278	1.446	10	20	BDCD	
CON(C)CCN[C@@H](C)c1cc(F)ccc1O	850478991	JNMRUSWEKBEJLF-VIFPVBQESA-N	242.294	1.675	10	20	BDCD	
Cc1cccc(O)c1CN(C)CCC(N)=O	877520811	IONCPGMLEWQERC-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
Cc1cccc(O)c1CN1CCO[C@@H](CF)C1	877588034	VDGGKMYDDRRWPZ-NSHDSACASA-N	239.290	1.871	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC(F)C1	307504581	PSRYACGIVHRYAN-UHFFFAOYSA-N	201.222	1.248	10	20	BDCD	
COCCN(C)c1ccc2c(c1)OCO2	121247887	DMGQLFLNPRMAOC-UHFFFAOYSA-N	209.245	1.498	10	20	BDCD	
CC[C@H](O)CCNCc1cc(C)ccc1O	131722586	ZLQWZRKNXMUUNK-LBPRGKRZSA-N	223.316	1.951	10	20	BDCD	
CNC(=O)C1CCN(Cc2ccccc2O)CC1	133336605	TUIZDRRJBSGMGS-UHFFFAOYSA-N	248.326	1.350	10	20	BDCD	
C[C@@H](CN)N(C)Cc1cc(F)ccc1O	383004250	YPRMLWUEURWVTI-QMMMGPOBSA-N	212.268	1.310	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)CNC	236732041	LRIGTJVPNDLKIE-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
Cc1ccc(CNCc2csnn2)c(O)c1	1330639187	SOKOLESQKKQVGY-UHFFFAOYSA-N	235.312	1.842	10	20	BDCD	
C[C@H](CN)N[C@H](C)c1ccc(N(C)C)cc1	817966841	WXTMJRLROFBMPS-GHMZBOCLSA-N	221.348	1.750	10	20	BDCD	
CSCC[C@@H](N)C(=O)Nc1ccc(N)cc1	832244123	LEXTYFRPGPSHKZ-SNVBAGLBSA-N	239.344	1.288	10	20	BDCD	
CNC(=O)CN(CC1CC1)c1ccc(OC)cc1	831583491	ZSNDCULMFPVOJO-UHFFFAOYSA-N	248.326	1.658	10	20	BDCD	
CC(C)N(C)C(=O)NCCc1ccc(N)cc1	841956994	CYLKDCRJYGVEBM-UHFFFAOYSA-N	235.331	1.861	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCCN2C)c1	862760450	RAEANDHKCCMGKH-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
Oc1ccc(Cl)cc1CNC[C@H]1C[C@@H](O)C1	720963226	RTDUKLTTZOBGFX-DKTWLAJQSA-N	241.718	1.906	10	20	BDCD	
CCOC(=O)[C@H](CC)Oc1ccc(N)cc1	31896855	RDQLARSQWKWBRS-NSHDSACASA-N	223.272	1.989	10	20	BDCD	
O=C(O)CCNCc1cc(F)ccc1O	236429569	UBWQYMKQDOZGGD-UHFFFAOYSA-N	213.208	1.096	10	20	BDCD	
CN(C)C1(CNCc2cc(F)ccc2O)CC1	397910574	ZUBFWMVTWCVKTM-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
CN(C(=O)C1CCOCC1)c1ccc(N)cc1	61670967	JJKNRHSZUKUTMF-UHFFFAOYSA-N	234.299	1.658	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](C)N(C)C)c1	38087867	LOILEJBBTXYPPY-JTQLQIEISA-N	238.331	1.441	10	20	BDCD	
C[C@H](CNCc1ccc2c(c1)CCO2)CN(C)C	291693705	JHZAESLDFJZQTM-GFCCVEGCSA-N	248.370	1.909	10	20	BDCD	
Oc1ccccc1CNCCOCC(F)F	190902020	KAHKQKAYJWAZBW-UHFFFAOYSA-N	231.242	1.764	10	20	BDCD	
CN(C)c1ccc(CN2CCNCC2(C)C)cc1	88138197	NRYPBMDPRPGBOR-UHFFFAOYSA-N	247.386	1.936	10	20	BDCD	
COc1ccccc1NC(=O)CN=[N+]=[N-]	103749756	JIFPGGRTSVZNHG-UHFFFAOYSA-N	206.205	1.944	10	20	BDCD	
Nc1ccc(CNC[C@H]2C[C@@H]3COC[C@@H]3O2)cc1	724555648	DMJLKEBZFTZNMW-BNOWGMLFSA-N	248.326	1.162	10	20	BDCD	
C[C@H](NCCCSc1nccs1)C(=O)O	904220756	DAQJUNXIHBSKQZ-ZETCQYMHSA-N	246.357	1.688	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCC2(N)CC2)c1	902407835	VZBBZOTZZDNNTM-VIFPVBQESA-N	236.315	1.543	10	20	BDCD	
COCCCOC(=O)c1ccc(C)c(O)c1O	733475256	DALQJMIDBYQYQC-UHFFFAOYSA-N	240.255	1.600	10	20	BDCD	
CC[C@H](NC(=O)c1cc(O)cs1)[C@H](C)O	839783353	XDWINTFTYXVJGV-XPUUQOCRSA-N	229.301	1.343	10	20	BDCD	
CCNC(=O)CNCc1cc(C)c(C)cc1O	742366297	SPDPNAGMKZZABX-UHFFFAOYSA-N	236.315	1.235	10	20	BDCD	
CC(C)N(C(=O)CN1CC(N=[N+]=[N-])C1)C(C)C	409422177	BQBFYIXAFZFQQF-UHFFFAOYSA-N	239.323	1.626	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)Cc2cccnc2)C1	409424943	ZRKMBZIWKWRSSY-UHFFFAOYSA-N	217.232	1.145	10	20	BDCD	
Cc1nc(C(=O)N2CC(N=[N+]=[N-])C2)cs1	409424250	TZFKYWSAIINOQI-UHFFFAOYSA-N	223.261	1.586	10	20	BDCD	
CN(CCCN)Cc1cc(F)ccc1O	220232091	JVJLLNPFJSBTCO-UHFFFAOYSA-N	212.268	1.312	10	20	BDCD	
C[C@H](N)CC(=O)N(C)Cc1ccc(N(C)C)cc1	37801174	XDPNLXRBDXNTCW-NSHDSACASA-N	249.358	1.448	10	20	BDCD	
C[C@H](NC[C@H]1COCCN1)c1ccccc1O	530218584	CVRWBYJEPWMBMJ-QWRGUYRKSA-N	236.315	1.031	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cc(C)c(C)cc1O	193105937	CXVCPTCCMMMBHI-SNVBAGLBSA-N	237.299	1.660	10	20	BDCD	
C[C@@H](N[C@@H]1CCOC1)c1ccc(F)cc1O	87783772	GSDUQCYMOQLTPU-PSASIEDQSA-N	225.263	1.971	10	20	BDCD	
COCCNCc1c(O)cccc1Cl	83551261	YTXAHIUBPHZLJJ-UHFFFAOYSA-N	215.680	1.782	10	20	BDCD	
Nc1ccc(CCNC(=O)N2CCCC2)cc1	91962855	IYOATCVTKHKMPJ-UHFFFAOYSA-N	233.315	1.617	10	20	BDCD	
CC(=O)C(=O)COc1cccc([N+](=O)[O-])c1C	289747572	UNYSWEBKDIDBAT-UHFFFAOYSA-N	237.211	1.440	10	20	BDCD	
OCCN(Cc1ccco1)Cc1ccccc1O	748818749	YCEZIFXWBSBGPT-UHFFFAOYSA-N	247.294	1.980	10	20	BDCD	
CC[C@@H](CO)NCc1ccc(N(C)C)c(C)c1	931773206	OYNGJEAVNWDJTR-ZDUSSCGKSA-N	236.359	1.922	10	20	BDCD	
CNC(=S)N[C@H](C)c1ccccc1O	865269422	LVPLDTQJGSIYCT-SSDOTTSWSA-N	210.302	1.547	10	20	BDCD	
Cc1noc(C(=O)NCc2ccccc2O)n1	774063758	JKTHPTFJDQHORI-UHFFFAOYSA-N	233.227	1.014	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@@H](N)C1)c1ccc(F)cc1O	873253028	XVIWMGVYNDIWFG-KKZNHRDASA-N	238.306	1.919	10	20	BDCD	
CCOc1cccc(CN(C)C2CNC2)c1O	90289557	ZCODKSVWNRSJMK-UHFFFAOYSA-N	236.315	1.195	10	20	BDCD	
COC[C@@]12CCC[C@H]1CN(C(=O)CN=[N+]=[N-])C2	409431725	KCZVZWBVKXXFME-ONGXEEELSA-N	238.291	1.572	10	20	BDCD	
C[C@@H]1COC[C@@H]1NCc1ccccc1O	688046040	GWKYORWWPOBGNY-KOLCDFICSA-N	207.273	1.517	10	20	BDCD	
Nc1ccc(CNC(=O)N2CCCCO2)cc1	1335737741	TZIHUQTUNJILDJ-UHFFFAOYSA-N	235.287	1.506	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@H]2CCCN2)cc1	1346218413	AWBOYSXYKZTDPT-GFCCVEGCSA-N	233.315	1.027	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H]1CCN1	1579616697	DXNAVJGHSPXIGK-CYBMUJFWSA-N	233.359	1.513	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@@H](C)CO)c1	35629074	RIBKYERJTKUHEX-UWVGGRQHSA-N	209.289	1.732	10	20	BDCD	
C[C@@H](O)C1(NCc2cc(F)ccc2O)CC1	827585165	BDHZIOKTOLIBAN-MRVPVSSYSA-N	225.263	1.534	10	20	BDCD	
C[C@]1(O)CCCN(Cc2ccccc2O)C1	179578387	JGJLSSFIQJVNQB-ZDUSSCGKSA-N	221.300	1.739	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@H]2CCCOC2)cc1	38046091	JFIZKFAXWXVGSX-GFCCVEGCSA-N	248.326	1.354	10	20	BDCD	
COCCCCNC(=O)c1cccc(O)c1O	126354248	JIEHXJIBYUWAFW-UHFFFAOYSA-N	239.271	1.254	10	20	BDCD	
COCCN(C)CCNCc1ccccc1O	61375063	KXEDXOKLTACQLN-UHFFFAOYSA-N	238.331	1.060	10	20	BDCD	
C[C@]1(C(=O)O)CCN(Cc2ccccc2O)C1	86779471	VLLYLIIKPBRYSC-ZDUSSCGKSA-N	235.283	1.689	10	20	BDCD	
Cc1cccc(CN(C)Cc2nncn2C)c1O	290247160	VHYDYBVWSSIYRC-UHFFFAOYSA-N	246.314	1.461	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC[C@H](C)CO)c1	86629168	KKTRZHYDABDAFJ-UWVGGRQHSA-N	239.315	1.680	10	20	BDCD	
COc1ccc(O)c(CNCCCCO)c1	193280460	MIFUFUGWPOZPRZ-UHFFFAOYSA-N	225.288	1.263	10	20	BDCD	
C[C@@H]1CCN(Cc2ccccc2O)C[C@H]1CN	253189193	KFVCFYCSMTYJDP-DGCLKSJQSA-N	234.343	1.809	10	20	BDCD	
Cc1cc(CN(C)[C@H](C)CO)ccc1N(C)C	293993135	FQIDBYHWYZYOLD-GFCCVEGCSA-N	236.359	1.874	10	20	BDCD	
C[C@H](NC[C@H]1CCN1C)c1ccccc1O	712537141	AMQNDKUIEYUIMF-WDEREUQCSA-N	220.316	1.747	10	20	BDCD	
CC(F)(F)CNC(=O)c1c(F)ccc(O)c1O	832878637	ZDXUBZXTERJHDC-UHFFFAOYSA-N	249.188	1.622	10	20	BDCD	
Cc1ccc(O)c(CNCC2(N)CCC2)c1	841051413	PAQCZYMILWDBNO-UHFFFAOYSA-N	220.316	1.672	10	20	BDCD	
CN(Cc1ccccc1O)C(=S)NC1CC1	917581665	OSLSBZZAEVXTEB-UHFFFAOYSA-N	236.340	1.861	10	20	BDCD	
Cc1cccc(CN2C[C@@H](C)[C@@H](O)C2)c1O	897681625	XSTYFWGMVUACMM-PWSUYJOCSA-N	221.300	1.513	10	20	BDCD	
COc1cc(C)cc(CN2CCO[C@H]3C[C@H]32)c1O	793614909	NAJWOIVMXYCELH-NEPJUHHUSA-N	249.310	1.682	10	20	BDCD	
CC[C@@H](O)CCNCc1c(C)cccc1O	877110677	CBEWFSCBSKIHJN-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
CNC(=O)CCN(C)Cc1cc(C)ccc1O	179412366	VTCHEMMGSDNAQP-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
OC[C@@H](CC(F)F)NCc1ccccc1O	381498909	NURFMXZZGUYEBT-SECBINFHSA-N	231.242	1.498	10	20	BDCD	
CC(=O)C(=O)COc1ccc(C(C)=O)c(F)c1	289703111	QZRLVIKPFLSRNN-UHFFFAOYSA-N	238.214	1.565	10	20	BDCD	
CCN(Cc1cccc(OC)c1O)[C@@H](C)CO	293621725	KVNIHMUVAAKQAL-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
Cc1cccc(O)c1CNCCCCCO	877485896	HNGGHNRGKLIFQB-UHFFFAOYSA-N	223.316	1.953	10	20	BDCD	
CCOc1ccc(O)c(CNCCNC)c1	841036616	QLUBJQSPVGWZDQ-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H]2CCCN[C@@H]2C1	876743842	IVYLZAWGKWTVAE-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
Cc1ccc(CN2CCCN(C)CC2)c(O)c1	876510936	SCKRCXHLHAXDNM-UHFFFAOYSA-N	234.343	1.838	10	20	BDCD	
C[C@H]1C[C@@H](O)CN1Cc1ccc(N(C)C)cc1	788268492	DLEGAVLLHHKIBJ-SMDDNHRTSA-N	234.343	1.708	10	20	BDCD	
COC[C@H](C)NCc1cc(F)ccc1O	83347410	NITISNNUIRCJJV-QMMMGPOBSA-N	213.252	1.656	10	20	BDCD	
C[C@@H]1CCN[C@@H](C(=O)NCc2ccc(N)cc2)C1	1524009766	VPHOAAYPBXYNAP-ZWNOBZJWSA-N	247.342	1.273	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2C[C@@H]3CC[C@@H]2O3)cc1	160422198	SIMNAKHLOLOVMA-SRVKXCTJSA-N	232.283	1.775	10	20	BDCD	
COC[C@@](C)(O)CNCc1cc(C)ccc1O	382544047	FILAZPZEULETSS-ZDUSSCGKSA-N	239.315	1.188	10	20	BDCD	
C[C@@H]1CC[C@H](O)CN1C(=O)Cc1ccc(N)cc1	399227287	AFEKNFIAOFASES-MFKMUULPSA-N	248.326	1.183	10	20	BDCD	
CC[C@H](OC)C(=O)N[C@H](C)c1ccccc1O	827930897	UDTIBDRRXQPHFU-SKDRFNHKSA-N	237.299	1.994	10	20	BDCD	
CCOCCC(=O)N[C@H](C)c1ccccc1O	827930326	GTEGDLXPKKBHNO-SNVBAGLBSA-N	237.299	1.996	10	20	BDCD	
CN(Cc1ccccc1O)Cc1nncn1C	111235005	QNZKWFPUDDWLDX-UHFFFAOYSA-N	232.287	1.153	10	20	BDCD	
OCC1(CNCc2c(O)cccc2Cl)CC1	118907028	NNPKTUJVDOFIBT-UHFFFAOYSA-N	241.718	1.908	10	20	BDCD	
CC[C@@H](NCCCO)c1ccccc1O	20188185	UXMDTNUBKYZNRL-LLVKDONJSA-N	209.289	1.815	10	20	BDCD	
C[C@H](CO)CN[C@@H](C)c1cc(F)ccc1O	87111423	IJJORDKEBAVHLH-IUCAKERBSA-N	227.279	1.810	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@@H]1CCCN1	42170060	MALLYQMNNUCPJT-LBPRGKRZSA-N	248.326	1.493	10	20	BDCD	
Cc1cc(CN2CC[C@@H](CO)C2)ccc1N(C)C	292711681	BFOPJAYGVQXBON-CQSZACIVSA-N	248.370	1.875	10	20	BDCD	
CCCN[C@H](C)C(=O)Nc1ccc(N)cc1	294882800	XPTICJHWPMVMCR-SECBINFHSA-N	221.304	1.595	10	20	BDCD	
CCNCCN[C@@H](C)c1cc(C)ccc1O	817951611	HIDRLLHWRJWMBD-NSHDSACASA-N	222.332	1.961	10	20	BDCD	
CC[C@@H](CO)N[C@@H](C)c1cccc(OC)c1O	846135204	CBSCDJISGIIBOI-UWVGGRQHSA-N	239.315	1.822	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)[C@H](C)O	840949034	OPSMMOOGILMMSE-RYUDHWBXSA-N	236.359	1.920	10	20	BDCD	
Cn1nnc(CSc2ncc(Cl)s2)n1	850000342	QYXCWBODHLFCOH-UHFFFAOYSA-N	247.736	1.612	10	20	BDCD	
C[C@H]1CCCN(Cc2ccc(N)cc2)[C@@H]1CN	1120263967	YGYDIFMYWQDIHU-SMDDNHRTSA-N	233.359	1.828	10	20	BDCD	
CN(CCc1ccnn1C)Cc1ccccc1O	276316748	NOEXNQHCCIJVOK-UHFFFAOYSA-N	245.326	1.800	10	20	BDCD	
c1cc2c(cc1CN[C@H]1[C@@H]3CNC[C@@H]31)CCCO2	1262488020	NGBROINBFUOEDU-NHAGDIPZSA-N	244.338	1.319	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2C[C@H](CO)C2)c1	897357048	FGFMMKMJCVQKKO-HOMQSWHASA-N	237.299	1.261	10	20	BDCD	
CC(C)[C@@H]1C(=O)NCCN1Cc1ccccc1O	179569818	LVEWURSJBJWBFU-CYBMUJFWSA-N	248.326	1.349	10	20	BDCD	
COCCCN1CCCc2cc(CN)ccc21	62801550	QVUZEKJVJFYQMS-UHFFFAOYSA-N	234.343	1.934	10	20	BDCD	
CCC[C@@H](N)C(=O)NCc1ccccc1O	83351979	JOIHVJVWIDTTDG-SNVBAGLBSA-N	222.288	1.136	10	20	BDCD	
CC(=O)C(=O)CN(C#N)c1ccc(F)cc1	808035628	YWWMUYOHERYXDE-UHFFFAOYSA-N	220.203	1.271	10	20	BDCD	
Cc1ccc(O)c(CN2CC(C(C)(C)O)C2)c1	297439250	PHFRWVABEYNFCG-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
CCO/C=C/C(=O)NCc1ccccc1O	816912188	NUPKJQUHQUZBSO-BQYQJAHWSA-N	221.256	1.559	10	20	BDCD	
CC(C)C(=O)NCc1ccc(O)cc1O	827617583	ALAQCUGYDUUFCM-UHFFFAOYSA-N	209.245	1.370	10	20	BDCD	
CC[C@@H](CO)N[C@H](C)c1cccc(OC)c1O	846135210	CBSCDJISGIIBOI-ZJUUUORDSA-N	239.315	1.822	10	20	BDCD	
Nc1ccc(CCNC[C@]23CNC[C@H]2C3)cc1	853245991	FSZUGBMKQXACRR-TZMCWYRMSA-N	231.343	1.010	10	20	BDCD	
CNC[C@@H](C)NCc1c(O)ccc(Cl)c1F	853249155	NWZCTDXPJFERKT-SSDOTTSWSA-N	246.713	1.882	10	20	BDCD	
COC(=O)[C@H]1C[C@@H](NCc2c(C)cccc2O)C1	877634756	VPOOJKYHODNENB-PHIMTYICSA-N	249.310	1.742	10	20	BDCD	
COC(=O)CN(C)Cc1c(C)cccc1O	876586135	AEQKGGGVTKAAHA-UHFFFAOYSA-N	223.272	1.305	10	20	BDCD	
CC(C)OCC(=O)N(C)Cc1ccccc1O	63767163	WPAQKTLLTWDMOB-UHFFFAOYSA-N	237.299	1.776	10	20	BDCD	
[N-]=[N+]=NCCN1CCC[C@@]2(C[C@H](O)CCO2)C1	409428589	GSWDXHIUAAGPCR-GHMZBOCLSA-N	240.307	1.303	10	20	BDCD	
Cc1cc(O)c(CNC2(C(N)=O)CC2)cc1C	792173361	CJBUFDASANEHAU-UHFFFAOYSA-N	234.299	1.117	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1CCCC1	1350300493	RWZYBKQCNAOFKP-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CNC[C@H](C)NCc1ccc(N(C)C)cc1	162187602	HSMYDNAVSBTCDV-NSHDSACASA-N	221.348	1.450	10	20	BDCD	
Cc1ccc(CNC[C@H]2COCCO2)c(O)c1	876951893	QRNSJVHRUIEJGY-LBPRGKRZSA-N	237.299	1.206	10	20	BDCD	
COc1ccc(CN[C@H]2CO[C@@H](C)C2)c(O)c1	402008143	AHVRCDDEPMPJDJ-GXSJLCMTSA-N	237.299	1.668	10	20	BDCD	
CCc1cccc(CN[C@H](CO)COC)c1O	691512841	NZSZOUKJPXCMOL-GFCCVEGCSA-N	239.315	1.052	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCCCO2)cc1	50958554	PSFSXJVUMAOZBQ-LLVKDONJSA-N	220.272	1.776	10	20	BDCD	
CN(C(=O)[C@@H]1CCCOC1)c1ccc(N)cc1	62192641	LJAQDGIEMFZSQM-SNVBAGLBSA-N	234.299	1.658	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H]2CCOC2)cc1	20146107	XULANGVEKFNLNT-ZDUSSCGKSA-N	234.343	1.879	10	20	BDCD	
CN1CCN(Cc2ccc(N)cc2)CC1(C)C	110921122	CSDQUJLPAQSTML-UHFFFAOYSA-N	233.359	1.795	10	20	BDCD	
COc1ccc(O)c(CNCc2cc(C)no2)c1	44986028	PWMFSBRDWMHMKF-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
COC[C@H](CO)N[C@@H](C)c1ccccc1O	234827678	VDEGACKVQUGGBT-UWVGGRQHSA-N	225.288	1.050	10	20	BDCD	
CC[C@H](N[C@@H]1COC[C@H]1O)c1ccccc1O	295842218	DJZFXHSQTYEGAY-DMDPSCGWSA-N	237.299	1.193	10	20	BDCD	
COc1ccc(O)c(CN(C)C2(CO)CC2)c1	827904154	VIZJYXISCNMWRQ-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NC1CC=CC1	779531953	MGXLZDZYTSWZGW-SOFGYWHQSA-N	245.278	1.946	10	20	BDCD	
CN1CC[C@H](NCc2ccccc2O)C1	42544015	ORSJPWUATGTDEW-NSHDSACASA-N	206.289	1.186	10	20	BDCD	
CO[C@@H]1CCO[C@@]2(CCN(CCN=[N+]=[N-])C2)C1	409434950	RLAKTJYPLLQEDG-MNOVXSKESA-N	240.307	1.567	10	20	BDCD	
CCCNCCNCc1cc(F)cc(F)c1O	1577559769	QKIBNILUWXALBO-UHFFFAOYSA-N	244.285	1.760	10	20	BDCD	
C[C@@H](N[C@H]1CCOC1=O)c1ccccc1O	19876316	UVVJSESFQIDRSH-SCZZXKLOSA-N	221.256	1.358	10	20	BDCD	
C[C@@H]1CCN(Cc2ccccc2O)C[C@@H]1CN	163405740	KFVCFYCSMTYJDP-YPMHNXCESA-N	234.343	1.809	10	20	BDCD	
Cc1ccc(CNC[C@@H]2COCCO2)c(O)c1	876951892	QRNSJVHRUIEJGY-GFCCVEGCSA-N	237.299	1.206	10	20	BDCD	
COc1cccc(O)c1CNCCc1cn[nH]c1	1323968690	YYVSVFWUVBUKCO-UHFFFAOYSA-N	247.298	1.456	10	20	BDCD	
CC[C@H](NCCN(C)C)c1ccccc1O	21962851	IRKQVCLJRCIFPI-LBPRGKRZSA-N	222.332	1.995	10	20	BDCD	
CCOC(=O)CN(C)Cc1cc(F)ccc1O	179919504	HIGABGXLAHIJAS-UHFFFAOYSA-N	241.262	1.526	10	20	BDCD	
CN[C@@H]1CCCN(Cc2cc(C)ccc2O)C1	71409483	LTHUUAPYABAPAB-CYBMUJFWSA-N	234.343	1.884	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCCCNC2=O)c1O	124696607	BKMNULVYKJKWOA-GFCCVEGCSA-N	248.326	1.459	10	20	BDCD	
COc1cccc(CNC[C@@H](C)N(C)C)c1O	38088871	XBVMRTKZODUYEA-SNVBAGLBSA-N	238.331	1.441	10	20	BDCD	
CN1CCN(Cc2ccccc2O)CC1(C)C	211527881	JYEVMCDYVBVYTB-UHFFFAOYSA-N	234.343	1.918	10	20	BDCD	
CN(CCC(=O)O)Cc1ccc(N(C)C)cc1	33465779	GKQFVLVDOPGUCQ-UHFFFAOYSA-N	236.315	1.659	10	20	BDCD	
O=C(NCc1ccco1)c1cccc(O)c1O	72111415	WRMAZDODOLZIPL-UHFFFAOYSA-N	233.223	1.621	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)C[C@H]1N	300048201	IEUNBKBFLVZPCK-MWLCHTKSSA-N	206.289	1.171	10	20	BDCD	
Oc1ccccc1CN(C1CC1)C1COC1	296201958	ZFBQKGDUBUOTQP-UHFFFAOYSA-N	219.284	1.755	10	20	BDCD	
N[C@H](CN[C@H]1CCc2cccc(O)c21)C1CC1	817964765	HJHGBZGWEIIBHN-NEPJUHHUSA-N	232.327	1.706	10	20	BDCD	
O=C1NC(=S)S/C1=C\c1ccc(F)nc1	588523497	UXXJFFCEYIPMHF-UTCJRWHESA-N	240.284	1.710	10	20	BDCD	
COc1ccc(N2CCCN(CCN)CC2)cc1	844222015	QHZVNRNIFZMDAG-UHFFFAOYSA-N	249.358	1.166	10	20	BDCD	
C[C@H]1CCN[C@H](C(=O)Nc2ccc(N)cc2)C1	841846294	OYXOIHZAAPBHGV-CABZTGNLSA-N	233.315	1.595	10	20	BDCD	
Cc1ccc(C(=O)N2C[C@H]3C[C@@H]3C2)c(O)c1O	862557782	ZOOZKIOYHCCYPQ-RKDXNWHRSA-N	233.267	1.498	10	20	BDCD	
CNCCCN(C)Cc1ccc(N)cc1	1120268516	HCROMOSGMHFNRH-UHFFFAOYSA-N	207.321	1.310	10	20	BDCD	
CO[C@H]1CN(Cc2c(C)cccc2O)CCO1	895963540	PDOSRWMQXFEURB-CYBMUJFWSA-N	237.299	1.505	10	20	BDCD	
CN[C@H](C)CCNCc1c(O)cccc1OC	1345100992	YFZODANSUVBAFD-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
COc1cccc(CN[C@@H](C)CN(C)C)c1O	168753986	AZGLCSQGVNTZLZ-JTQLQIEISA-N	238.331	1.441	10	20	BDCD	
CC[C@@H](C(=O)O)N1CCc2cc(OC)ccc21	1776681961	CIPLTXYUYYZBCG-NSHDSACASA-N	235.283	1.921	10	20	BDCD	
CC(C)NC(=O)NCc1ccc(N(C)C)cc1	31726371	SLGMJJZNWQFHRA-UHFFFAOYSA-N	235.331	1.960	10	20	BDCD	
CCN(CC)C(=O)/C=C\c1ccc(O)c(O)c1	199698905	IVRFYKXAGRJRNP-VURMDHGXSA-N	235.283	1.979	10	20	BDCD	
O=C(CC1(O)CCC1)NCc1ccccc1O	825658991	RQTBOZUEOTWNCB-UHFFFAOYSA-N	235.283	1.314	10	20	BDCD	
CN1C[C@@H]2CCCN(Cc3ccccc3O)[C@@H]2C1	822521110	WKRMAZKERGKXMF-GXTWGEPZSA-N	246.354	1.918	10	20	BDCD	
Cc1cccc(CNC[C@@H](N)C2CC2)c1O	841050779	UDEPHFAEERMYHW-GFCCVEGCSA-N	220.316	1.528	10	20	BDCD	
COC(=O)[C@@H](CC1CC1)NCc1ccccc1O	840957717	MPGJWBDCEAHKKJ-GFCCVEGCSA-N	249.310	1.824	10	20	BDCD	
C[C@@H]1[C@@H](CO)CCCN1Cc1ccccc1O	840979161	RXQNGRDCNFIACW-DGCLKSJQSA-N	235.327	1.985	10	20	BDCD	
COC[C@H](C)CNCc1cccc(OC)c1O	45656415	GDDQTNNJJKFEHD-SNVBAGLBSA-N	239.315	1.773	10	20	BDCD	
CCC[C@H](O)CNC(=O)c1cc(O)cs1	771064716	KRUVWDDFZIDAPN-ZETCQYMHSA-N	229.301	1.345	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@H](CO)C2(CCC2)C1	409434000	NWCCHWXIGTWZOQ-SECBINFHSA-N	210.281	1.391	10	20	BDCD	
COC(=O)CN1CCCc2cc(OC)ccc21	797723947	GZILJHJHHCSAEB-UHFFFAOYSA-N	235.283	1.621	10	20	BDCD	
O=C(O)CCCNCc1cc(F)cc(F)c1O	708075189	KCUXVFUPDQXYKV-UHFFFAOYSA-N	245.225	1.625	10	20	BDCD	
C[C@H]1CCN(C(=O)c2cccc(O)c2O)[C@@H]1C	193127110	XUBKEMNLZXOFHM-DTWKUNHWSA-N	235.283	1.968	10	20	BDCD	
N[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1	1236170293	UUJXPSPKVHJRJU-AWEZNQCLSA-N	245.370	1.820	10	20	BDCD	
CC[C@@H](F)C(=O)NCc1ccc(OC)cc1O	1335941514	RJJRFGHWKKWRHZ-SNVBAGLBSA-N	241.262	1.765	10	20	BDCD	
CCOC(=O)[C@H](NCc1ccccc1O)C1CC1	1343507424	GUXRNPXOTXWGGN-CYBMUJFWSA-N	249.310	1.824	10	20	BDCD	
COc1cccc(CN[C@@H]2COC[C@H]2C)c1O	699792033	VBQQRQYFFYCYBY-MWLCHTKSSA-N	237.299	1.525	10	20	BDCD	
CC1(C)C[C@@H]1CNC(=O)c1cccc(O)c1O	229315608	MUGUPMMFVDZYDY-MRVPVSSYSA-N	235.283	1.874	10	20	BDCD	
N#Cc1cc(=NCc2ccccc2O)[nH]cn1	383776557	ISEBPZROMJYAFP-UHFFFAOYSA-N	226.239	1.088	10	20	BDCD	
CC(C)N(C)C(=O)c1c(F)ccc(O)c1O	279256452	UKJSFBGSTXXXLX-UHFFFAOYSA-N	227.235	1.717	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)c1ccn(C)n1	817957991	RUWXARZIQYCORF-LLVKDONJSA-N	244.342	1.896	10	20	BDCD	
CC(C)ONC(=O)/C=C\c1ccc(O)c(O)c1	836798047	GUJDVWWAPPZXGL-XQRVVYSFSA-N	237.255	1.567	10	20	BDCD	
COc1ccc(O)c(CNCC2(N)CCC2)c1	841047622	ADLCLGSTIDRGQI-UHFFFAOYSA-N	236.315	1.372	10	20	BDCD	
CO[C@@H](C)COC(=O)c1cccc(O)c1O	758559919	GZRZMEQIMSXAQQ-ZETCQYMHSA-N	226.228	1.290	10	20	BDCD	
CN(C)c1ccc2c(c1)OCCN2C(N)=O	153830105	PZPNMZGBPHXPNA-UHFFFAOYSA-N	221.260	1.030	10	20	BDCD	
Cc1ccc(CNCCCC(=O)O)c(O)c1	1605278066	YUCRDBGAGRZJFA-UHFFFAOYSA-N	223.272	1.655	10	20	BDCD	
Cc1cc(O)c(CNc2ncnn2C)cc1C	162194228	OMQUXPNHNYTVEN-UHFFFAOYSA-N	232.287	1.750	10	20	BDCD	
Cc1nc(CCN[C@@H](C)c2ccccc2O)n[nH]1	272872767	PDAYLXFRXONCDA-VIFPVBQESA-N	246.314	1.712	10	20	BDCD	
C[C@H]1OCCN(C(=O)Nc2ccc(N)cc2)[C@@H]1C	380584698	ZHTRAVQSTHUXEM-NXEZZACHSA-N	249.314	1.910	10	20	BDCD	
CO[C@@H](C)CC(=O)N[C@H](C)c1ccccc1O	827930147	CUBFWMXOGNKDNW-VHSXEESVSA-N	237.299	1.994	10	20	BDCD	
Cc1cccc(CNCc2cn(C)cn2)c1O	898045635	QHZNQSSYFSHKOP-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
CCNC(=O)CCN(C)Cc1ccccc1O	111236061	PSKAMICMTXNMHK-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
C/C=C(\C)C(=O)NCc1ccc(O)c(O)c1	182531559	BQSKAGXIXKWPFR-FPYGCLRLSA-N	221.256	1.680	10	20	BDCD	
Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCN	37712539	UNBOJUXYLHSOOU-ZJUUUORDSA-N	220.316	1.797	10	20	BDCD	
CC1(C)C[C@@H]1NC(=O)c1c(F)ccc(O)c1O	294886035	QLDKYUILGSNPHD-QMMMGPOBSA-N	239.246	1.765	10	20	BDCD	
Oc1ccccc1CN1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1	824838810	SGDFLIUMFZQNBW-QHSBEEBCSA-N	243.306	1.777	10	20	BDCD	
CNC[C@@H](C)N[C@@H](C)c1ccccc1O	854230949	CDAHMAHFXOIJMU-ZJUUUORDSA-N	208.305	1.651	10	20	BDCD	
CN(C(=O)[C@H](N)C1CCC1)c1ccc(N)cc1	877076977	ZJDVKZCFAGQLMN-GFCCVEGCSA-N	233.315	1.359	10	20	BDCD	
Cc1nonc1CN[C@@H]1CCc2cccc(O)c21	872135298	DYSWCPKLFRMTQJ-SNVBAGLBSA-N	245.282	1.861	10	20	BDCD	
Cc1ccc(O)c(CNCCCN(C)C)c1	70954889	KQGONYKPOVJWTR-UHFFFAOYSA-N	222.332	1.742	10	20	BDCD	
O=C(N[C@H]1CC[C@H](O)CC1)c1cc(O)cs1	781960740	NUQVVAOYZJTCJK-ZKCHVHJHSA-N	241.312	1.487	10	20	BDCD	
CCc1cccc(CN[C@H]2CCN(C)C2)c1O	709435743	NUXFLEKBYQXHJY-ZDUSSCGKSA-N	234.343	1.748	10	20	BDCD	
CCn1ncnc1CN(C)Cc1ccccc1O	193426178	IILMGEWWTLIWBD-UHFFFAOYSA-N	246.314	1.636	10	20	BDCD	
CN[C@@H]1CCN(Cc2ccc(F)c(F)c2O)C1	1578609827	ZOEGBLOAXUOYRI-SECBINFHSA-N	242.269	1.464	10	20	BDCD	
CC1(C(=O)NCc2ccc(N)cc2)CC1	308820813	QOHFPKZWYKIJIR-UHFFFAOYSA-N	204.273	1.685	10	20	BDCD	
Cc1cccc(CN(CC(N)=O)C(C)C)c1O	124514537	UFQBAIJPYXIBAI-UHFFFAOYSA-N	236.315	1.396	10	20	BDCD	
C[C@]1(NCc2ccccc2O)CCOC1	120127191	RJFVTHSSYYIZLO-LBPRGKRZSA-N	207.273	1.661	10	20	BDCD	
Cc1noc(C)c1/C=C1\SC(=S)NC1=O	192764496	RCXHHWZJJMCNCD-CLTKARDFSA-N	240.309	1.780	10	20	BDCD	
C[C@H](CCCN)NCc1ccccc1O	380006974	LGRGVGAUFMJYMR-SNVBAGLBSA-N	208.305	1.609	10	20	BDCD	
Oc1ccccc1CNCc1csnn1	162533278	ZLDSPZQYPWDDKN-UHFFFAOYSA-N	221.285	1.534	10	20	BDCD	
CS[C@@H](C)C(=O)NCc1ccc(N)cc1	297309785	WBLVTAZMJCASSM-QMMMGPOBSA-N	224.329	1.637	10	20	BDCD	
CC[C@@H](N)CN[C@H](C)c1cc(F)ccc1O	817979278	JMLJGCGPIZNPGV-PSASIEDQSA-N	226.295	1.919	10	20	BDCD	
O=C(NCC(=O)C1CC1)c1cc(O)cs1	831591922	CLPOWQDXGPFTAC-UHFFFAOYSA-N	225.269	1.163	10	20	BDCD	
CN[C@H]1CCN(Cc2cccc(Cl)c2O)C1	843044842	KXGIAXLZGLOPDX-JTQLQIEISA-N	240.734	1.839	10	20	BDCD	
CCOc1ccc(CNC[C@@H](C)OC)c(O)c1	785560255	QBEGPQFHXFJUIE-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
O=C(OCCC1OCCO1)c1cc(O)cs1	781179107	SIBLHUKLUUZGKQ-UHFFFAOYSA-N	244.268	1.374	10	20	BDCD	
CCN(CC)c1ccc(CNC(=O)CCN)cc1	83381516	KEJZUHFHLILVBL-UHFFFAOYSA-N	249.358	1.498	10	20	BDCD	
O=C(O)[C@H]1CCCN1Cc1ccccc1O	83403825	CJTGZOXTMMDJIV-SNVBAGLBSA-N	221.256	1.441	10	20	BDCD	
CN1CCC[C@@H]1CNCc1ccc2c(c1)CCO2	221142968	AJIXNIZMJZTVEJ-CQSZACIVSA-N	246.354	1.805	10	20	BDCD	
OC[C@H]1C[C@@H](NCc2ccc3c(c2)CCO3)C1	707617097	HASTWMPDKWMTNL-BJHJDKERSA-N	233.311	1.482	10	20	BDCD	
O=C(NC[C@H]1CCSC1)c1cc(O)cs1	791059547	BYTRYXBUXKASBQ-SSDOTTSWSA-N	243.353	1.937	10	20	BDCD	
CN1CC[C@@H](N(C)Cc2ccccc2O)C1=O	116279495	MMVAICGUUJDYGE-LLVKDONJSA-N	234.299	1.055	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@H]2C[C@H](O)C2)c1	850579087	SMCBTWJNNKXQTI-DCAQKATOSA-N	221.300	1.875	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCOC2=O)cc1	19876072	UPZXSVHVSIKHOC-LBPRGKRZSA-N	234.299	1.158	10	20	BDCD	
CC(C)(CNCc1cccc(F)c1O)C(=O)O	1590763796	YJSMWFFEXAADTF-UHFFFAOYSA-N	241.262	1.732	10	20	BDCD	
COCC(C)(C)NCc1cc(OC)ccc1O	164599345	WWSQRIOMCSZPIF-UHFFFAOYSA-N	239.315	1.915	10	20	BDCD	
CN(CC(=O)NCC1CC1)c1ccc(N)cc1	20374394	MZWUBENOJANXRW-UHFFFAOYSA-N	233.315	1.231	10	20	BDCD	
NC[C@@H]1CC[C@H](NCc2ccc3c(c2)CCO3)C1	841084149	HKDNGDCPOISSTM-RISCZKNCSA-N	246.354	1.839	10	20	BDCD	
CCCN(CC(N)=O)Cc1cc(C)ccc1O	383607658	RVXSEBMAAJUORA-UHFFFAOYSA-N	236.315	1.398	10	20	BDCD	
COC[C@H](CCO)NCc1cccc(C)c1O	224843366	JTOVYEGNYYDGCL-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
COc1cccc(CNC(=O)c2ccco2)c1O	68488698	OYTHKWGFDQNQIE-UHFFFAOYSA-N	247.250	1.924	10	20	BDCD	
C[C@@H](NCc1cn[nH]c1)c1ccccc1O	38005877	UJTFVCYXRNMADA-SECBINFHSA-N	217.272	1.966	10	20	BDCD	
C[C@H](N[C@H]1CCN(C)C1)c1ccccc1O	42544121	APWITNXQFKBVDN-QWRGUYRKSA-N	220.316	1.747	10	20	BDCD	
O=C(NCc1ccccc1O)c1cc[nH]n1	136334259	JBRJMDFHNQTRQU-UHFFFAOYSA-N	217.228	1.045	10	20	BDCD	
COC[C@@H](C)CNCc1ccc2c(c1)CCO2	44477937	UEBMIUFERKQLFF-NSHDSACASA-N	235.327	1.994	10	20	BDCD	
COC[C@@H](CN[C@@H](C)c1ccccc1O)OC	228808795	ZYXUZJVKMBQSIH-WDEREUQCSA-N	239.315	1.704	10	20	BDCD	
O=C1NCCN1CCSc1nccs1	289557843	GUPGCNSYPDSEFN-UHFFFAOYSA-N	229.330	1.260	10	20	BDCD	
Cc1cc(O)c(CNc2ncn(C)n2)cc1C	292473180	QEOINLJLTASNCK-UHFFFAOYSA-N	232.287	1.750	10	20	BDCD	
CCOc1ccc(CNCC2(N)CC2)c(O)c1	904448591	AEDZTYFSQFYDCG-UHFFFAOYSA-N	236.315	1.372	10	20	BDCD	
C[C@@H](CN)NCc1c(O)ccc(Cl)c1F	841067425	YIIGYDIVIJJGJH-LURJTMIESA-N	232.686	1.622	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1=COCCC1	910956581	YKHXIUGNJFICSL-UHFFFAOYSA-N	249.266	1.408	10	20	BDCD	
Cc1cccc(O)c1CN1CCC[C@@H](C(N)=O)C1	876511359	GJFVXAIJRKAFJK-LLVKDONJSA-N	248.326	1.398	10	20	BDCD	
CN(C(=O)CC[C@@H]1CCNC1)c1ccc(N)cc1	877077940	WVFYBMDLYARNKZ-LLVKDONJSA-N	247.342	1.621	10	20	BDCD	
C[C@@H](CCO)N[C@H](C)c1c(O)cccc1F	886530089	CUFFGJFBAVBWRI-DTWKUNHWSA-N	227.279	1.953	10	20	BDCD	
Cc1nonc1CN(C)c1ccc(N)cc1	702075918	GZZLMXNHAMWWHZ-UHFFFAOYSA-N	218.260	1.597	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](CO)C1)c1ccccc1O	707641943	YMLXWCVQSWSBQC-MXWKQRLJSA-N	221.300	1.814	10	20	BDCD	
O=C(O)C(=O)CSc1ncc(Cl)s1	1605880603	GNLAIASUPLVPMY-UHFFFAOYSA-N	237.689	1.542	10	20	BDCD	
CCc1cccc(CNC[C@H](O)C2CC2)c1O	691480011	AUDQILQDCCFHRK-ZDUSSCGKSA-N	235.327	1.815	10	20	BDCD	
Nc1ccc(CNC(=O)c2ccccc2O)cc1	37666201	KELKBUNNZAEGAW-UHFFFAOYSA-N	242.278	1.904	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CC[C@H](O)C2)c1	188839871	SEALPYKZKNKIRV-AAEUAGOBSA-N	235.327	1.951	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)[C@@H](C)OC)c1	290941387	PXTOBBFHUTZBGK-NXEZZACHSA-N	239.315	1.914	10	20	BDCD	
CC[C@@H](CO)N[C@@H](C)c1cc(F)ccc1O	87111339	COJWEHCPVQVWFR-WPRPVWTQSA-N	227.279	1.953	10	20	BDCD	
Cc1ccc(O)c(CNCCc2cnn(C)c2)c1	83552052	YXWMNABKYDUXDM-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
CCC[C@](C)(O)C(=O)NCc1ccccc1O	269575258	JDRYJJZSXRFIOH-ZDUSSCGKSA-N	237.299	1.560	10	20	BDCD	
Cc1ccc(O)c(CNCC2(N)CC2)c1	904451406	YMVFMUDFSOVKKP-UHFFFAOYSA-N	206.289	1.282	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)COC(C)C)c1	862758720	IPHNLSRNDOBYTI-UHFFFAOYSA-N	237.299	1.742	10	20	BDCD	
CC(=O)N(C)Cc1ccc(N(C)C)cc1	60678539	NCERSNLFYZCUNU-UHFFFAOYSA-N	206.289	1.731	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCCOCC2)cc1	1336117946	RJWUWPNDIHWMTQ-CYBMUJFWSA-N	220.316	1.928	10	20	BDCD	
CC[C@@H](OC)C(=O)NCc1cccc(O)c1O	1349079216	MGCZHCYAUCIOJE-SNVBAGLBSA-N	239.271	1.139	10	20	BDCD	
CCNCc1ccc(N2CCOCC2)c(F)c1	34823056	UVXUVEMRTBVFDL-UHFFFAOYSA-N	238.306	1.772	10	20	BDCD	
CCN(CC(F)F)C(=O)Cc1ccc(N)cc1	386003876	FHCLIQMFOAEJJZ-UHFFFAOYSA-N	242.269	1.925	10	20	BDCD	
O=C(NC1CCCC1)c1c(F)ccc(O)c1O	170610186	GMFXXZQYHXEUHU-UHFFFAOYSA-N	239.246	1.909	10	20	BDCD	
CCN(CC1CC1)C(=O)c1cccc(O)c1O	126425342	QWPAEQTXSNCIEJ-UHFFFAOYSA-N	235.283	1.970	10	20	BDCD	
CC[C@@H](CO)NCc1cc(F)ccc1O	83347398	LOVBIAIPAWFUHV-JTQLQIEISA-N	213.252	1.392	10	20	BDCD	
NC[C@H](N[C@H]1CCc2cccc(O)c21)C1CC1	817960266	LHBYWTJRECOYTK-RYUDHWBXSA-N	232.327	1.706	10	20	BDCD	
COc1cccc(CNC(=O)C(C)(C)F)c1O	155731282	WFDWLGXVJPEEMQ-UHFFFAOYSA-N	241.262	1.765	10	20	BDCD	
O=C(Cc1ccncc1)NCc1ccccc1O	166390964	IATYYPXOAMCPDZ-UHFFFAOYSA-N	242.278	1.646	10	20	BDCD	
Cc1cc(O)c(CN2C[C@@H]3CNC[C@@H]3C2)cc1C	770395094	OOPJACQIPRKUSF-OKILXGFUSA-N	246.354	1.660	10	20	BDCD	
CN(C(=O)[C@H](N)CC1CC1)c1ccc(N)cc1	884441711	NTQJKQHYQLGFTL-GFCCVEGCSA-N	233.315	1.359	10	20	BDCD	
OC[C@]12C[C@H]1CN(Cc1ccccc1O)C2	783745335	VTEDGKPWYDRFPN-WCQYABFASA-N	219.284	1.206	10	20	BDCD	
Nc1ccc(CNCC2(O)CCCC2)cc1	716282809	GXFPLAKMYMXXEB-UHFFFAOYSA-N	220.316	1.664	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@H]2C[C@@H](N)C2)cc1	693633551	KHCNLKQVVCQZPS-TXEJJXNPSA-N	247.342	1.106	10	20	BDCD	
Oc1ccc(F)cc1CN[C@@H]1CCOC1	226617176	TYVYAMIOPLAGBC-SNVBAGLBSA-N	211.236	1.410	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)C(=O)O)c(Cl)c1	1600286573	PZRUQOXEMLDUBZ-SSDOTTSWSA-N	243.690	1.917	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)C1=CCCC1	157823283	XQCJRPXKCOKSOK-UHFFFAOYSA-N	247.294	1.867	10	20	BDCD	
Cc1ccc(CN(C)Cc2nncn2C)c(O)c1	877530772	XGBIGSZCOOQKEB-UHFFFAOYSA-N	246.314	1.461	10	20	BDCD	
Oc1c(F)cc(F)cc1CNCCN1CCC1	708498090	XKGQUOPMGPFQHN-UHFFFAOYSA-N	242.269	1.466	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)[C@H]1CCCN1	817902856	ZNNRTBVTYNACIH-SMDDNHRTSA-N	246.354	1.852	10	20	BDCD	
CC(C)Oc1ccc(N(C)CCO)cc1	49814631	AAYIXUGPZXPHKL-UHFFFAOYSA-N	209.289	1.902	10	20	BDCD	
C[C@@H](O)CN[C@H](C)c1cc(F)ccc1O	87111362	CECSZDLHXUAKEF-HTQZYQBOSA-N	213.252	1.563	10	20	BDCD	
C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O	49357080	PSWUROCAAJEDNB-UWVGGRQHSA-N	236.315	1.876	10	20	BDCD	
C[C@H](CO)NCc1c(O)cccc1Cl	90739540	DGFFMEFEACGOCV-SSDOTTSWSA-N	215.680	1.516	10	20	BDCD	
CC(=O)C(=O)COC(=O)Cc1ccccc1F	808487824	ILRFSKAYWBKTRT-UHFFFAOYSA-N	238.214	1.070	10	20	BDCD	
CNC[C@@H]1CCCN1Cc1cccc(F)c1O	843056158	VTQXVSXKDPPXBG-NSHDSACASA-N	238.306	1.715	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@H](C)CCO)c1	846110143	HUPXQCVMBYXLTM-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
CCOC(=O)COC(=O)c1cc(O)cs1	745002912	RBHXMSITSHSROY-UHFFFAOYSA-N	230.241	1.174	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC[C@@H]2C[C@H]2C1	856060743	BJCJCBKPTNPUJY-SFYZADRCSA-N	223.297	1.936	10	20	BDCD	
COC/C=C/C(=O)NCc1ccc(N(C)C)cc1	864573082	FMKKEDGUKIGRHR-SNAWJCMRSA-N	248.326	1.571	10	20	BDCD	
O=C(NOCC(F)(F)F)c1cc(O)cs1	768292041	JLNSLMYTYAJBNO-UHFFFAOYSA-N	241.190	1.677	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCO[C@H]2C)c1	862757866	GXVFXQLDVFRQQG-JQWIXIFHSA-N	249.310	1.742	10	20	BDCD	
C/C=C/C[C@H](CO)NC(=O)c1cc(O)cs1	771742218	BJQNXRDKYYSTNT-UFUPEUMYSA-N	241.312	1.511	10	20	BDCD	
C[C@@H]1NC(=O)[C@H](C)N(Cc2ccccc2O)[C@@H]1C	895117518	VQQCMSYZAWLOIH-AXFHLTTASA-N	248.326	1.490	10	20	BDCD	
CCc1cccc(CN2C[C@@H](O)[C@H](C)C2)c1O	897680532	SGAMOMRIGLTCBV-ZWNOBZJWSA-N	235.327	1.767	10	20	BDCD	
C[C@H](CO)NCc1c(O)ccc(Cl)c1F	190854945	MDFZEDNZDMQQOY-ZCFIWIBFSA-N	233.670	1.655	10	20	BDCD	
CCc1cccc(CN[C@H]2CCOC2)c1O	691467824	RPONXRZMCMNORY-LBPRGKRZSA-N	221.300	1.833	10	20	BDCD	
COCC(C)(C)NC(=O)Nc1ccc(N)cc1	167556599	JYOYXFRWNHASJI-UHFFFAOYSA-N	237.303	1.815	10	20	BDCD	
CC[C@@H](N[C@@H](CO)COC)c1ccccc1O	233897958	KESVOTAXZBYOJP-CMPLNLGQSA-N	239.315	1.440	10	20	BDCD	
CC(C)[C@@H]1CCN1C(=O)c1cccc(O)c1O	839782014	DUBSCKIAKPZVLL-JTQLQIEISA-N	235.283	1.968	10	20	BDCD	
CO[C@@H]1COC[C@@H]1N[C@@H](C)c1ccccc1O	840824849	QFSQDXWWDBEWHG-XHVZSJERSA-N	237.299	1.457	10	20	BDCD	
CO[C@H](C)CNCc1ccc(N(C)C)cc1	191207243	KOZUFMRWIXURQN-LLVKDONJSA-N	222.332	1.877	10	20	BDCD	
CCCNCc1ccc([N+](=O)[O-])c(OC)c1O	278947450	YUWGXXUFNBBLBA-UHFFFAOYSA-N	240.259	1.809	10	20	BDCD	
CC(=O)C(=O)COC(=O)Cc1ccc(F)cc1	808488683	YJSJYTWUPBUJNR-UHFFFAOYSA-N	238.214	1.070	10	20	BDCD	
CS[C@H](C)C(=O)NCc1ccccc1O	299581548	RDHLFKXRGFOWBV-MRVPVSSYSA-N	225.313	1.760	10	20	BDCD	
Oc1ccc(F)cc1CN1CCC[C@H](O)CC1	293913890	GDWUSTCFANAFFI-LBPRGKRZSA-N	239.290	1.878	10	20	BDCD	
C[C@@H](CN)N[C@H](C)c1ccc(N(C)C)cc1	817970476	WXTMJRLROFBMPS-WDEREUQCSA-N	221.348	1.750	10	20	BDCD	
C[C@@H](CNCc1cc(Cl)ccc1O)C(=O)O	848637663	JRNYUKGMAXOIKH-ZETCQYMHSA-N	243.690	1.856	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2C[C@@H]2C)c1	862757345	PXVHBTIXFMGEFZ-ONGXEEELSA-N	219.284	1.973	10	20	BDCD	
CC[C@@H](N[C@@H]1COC[C@@H]1O)c1ccccc1O	866419463	DJZFXHSQTYEGAY-WZRBSPASSA-N	237.299	1.193	10	20	BDCD	
CC(C)C[C@@H](O)CNCc1ccccc1O	163761142	BWECKNDQZSWSDA-GFCCVEGCSA-N	223.316	1.889	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C[S@](C)=O)c1O	164410043	XZLIAZLAGMVDIL-MGPLVRAMSA-N	241.356	1.557	10	20	BDCD	
C[C@@H](NC(=O)Cc1ccc(N)cc1)[C@@H]1CCCO1	35734285	DUMWFFAUTPHGDB-MFKMUULPSA-N	248.326	1.495	10	20	BDCD	
Cc1ccc(O)c(CN(C)CCOCCN)c1	699524614	QSNCJIWEKCXLOT-UHFFFAOYSA-N	238.331	1.108	10	20	BDCD	
CN(CCCS(C)(=O)=O)c1ccc(N)cc1	63015352	ZMFCPYWKJIDNKT-UHFFFAOYSA-N	242.344	1.140	10	20	BDCD	
COc1ccc(CN[C@H](C)CCO)c(O)c1	96811509	SIADBJTUWVECCJ-SECBINFHSA-N	225.288	1.261	10	20	BDCD	
CCOC1CN(Cc2cc(C)ccc2O)C1	297497635	URASAJIILLIMTH-UHFFFAOYSA-N	221.300	1.921	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H](O)C1CC1	840947872	ASYLQSQNCRXXFX-HNNXBMFYSA-N	248.370	1.922	10	20	BDCD	
CCC[C@H](O)C(=O)Nc1ccc(N)cc1	911661541	WPIDONZAOZQLKR-JTQLQIEISA-N	208.261	1.368	10	20	BDCD	
Cc1cccc(CN2CCCNCC2)c1O	843047607	PVYJYOUQNXCOMB-UHFFFAOYSA-N	220.316	1.496	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2C[C@H](F)CN2)c1	841077402	AQWDMKUHLIUVEU-RYUDHWBXSA-N	238.306	1.490	10	20	BDCD	
CCOc1ccc(CN[C@H](C)CNC)c(O)c1	853248658	IEIWEMUKPUPGHA-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
CCS(=O)(=O)N[C@H](C)c1ccccc1O	867834942	WDGZBOPSAZVRNN-MRVPVSSYSA-N	229.301	1.393	10	20	BDCD	
C[C@H](O)COC(=O)/C=C/c1ccc(O)c(O)c1	792039751	GEIBBGKKKXKFEQ-WGAJWPLOSA-N	238.239	1.035	10	20	BDCD	
N[C@@H]1CCN(Cc2cc(F)ccc2O)C1	219836431	IEILJIJOVPAZBY-SNVBAGLBSA-N	210.252	1.064	10	20	BDCD	
COC(=O)c1cnc(S[C@@H](C)C(=O)O)s1	1593893622	WUHGDWQXFTUEFZ-BYPYZUCNSA-N	247.297	1.495	10	20	BDCD	
CSCCNCc1cc([N+](=O)[O-])ccc1O	237505408	DMUPKNQDSHOTFJ-UHFFFAOYSA-N	242.300	1.753	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]1C(=O)O	37835650	OTWNDXTWODGLKE-NXEZZACHSA-N	249.266	1.071	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCCO)c1	20597020	PHBPHYBFHIKZNL-MRVPVSSYSA-N	211.261	1.044	10	20	BDCD	
CNCCN[C@H](C)c1cc(C)ccc1O	817951219	BRYAWAJVQSXNMS-SNVBAGLBSA-N	208.305	1.571	10	20	BDCD	
C[C@@H](NC(=O)CC1(O)CCC1)c1ccccc1O	827952562	XQAKTBFFXPHBRK-SNVBAGLBSA-N	249.310	1.875	10	20	BDCD	
Nc1ccc(CCNC(=O)NCCC2CC2)cc1	841840885	ICKPDEPWHWMHPX-UHFFFAOYSA-N	247.342	1.911	10	20	BDCD	
N[C@@H](CNCc1ccc2c(c1)CCO2)C1CC1	841049296	JKOONPMIUQLAJC-ZDUSSCGKSA-N	232.327	1.448	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1CCCN1	841036732	WSJXDDVLCGUSGD-LLVKDONJSA-N	224.279	1.373	10	20	BDCD	
Cc1ccc(CN2CC[C@@](F)(CO)C2)c(O)c1	877503770	AGPQUKPNUAIFTA-ZDUSSCGKSA-N	239.290	1.607	10	20	BDCD	
Cc1ccc(CN2CC[C@H](O)[C@@H](C)C2)c(O)c1	877434745	TZKCBRDXGPDEQK-AAEUAGOBSA-N	235.327	1.903	10	20	BDCD	
C[C@H](NCCOCCO)c1c(O)cccc1F	886491424	CYZRBZBQALUJOL-VIFPVBQESA-N	243.278	1.191	10	20	BDCD	
Cc1noc(CN(C)c2ccc(N)cc2)n1	706641266	MPUGIVQHTYQYIZ-UHFFFAOYSA-N	218.260	1.597	10	20	BDCD	
CN(C)C(=O)OCCSc1nccs1	1320176306	WZDLPZZBUBLCKD-UHFFFAOYSA-N	232.330	1.933	10	20	BDCD	
CO[C@H](C)CC(=O)NCc1ccc(N)cc1	1263303778	IUEQZZHPZOOYDY-SECBINFHSA-N	222.288	1.310	10	20	BDCD	
C[C@H](CNCc1cc(F)cc(F)c1O)N(C)C	708481104	OGZGCFVJOUUTII-MRVPVSSYSA-N	244.285	1.710	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2[C@H]3CCCO[C@H]32)cc1	911659589	DEQNZNINEFBQAX-IJLUTSLNSA-N	232.283	1.632	10	20	BDCD	
COc1ccc(CNC(C)(C)CO)cc1C	37239080	UIMWQCHYDVAQET-UHFFFAOYSA-N	223.316	1.864	10	20	BDCD	
Cc1ccc([C@H](C)N[C@@H]2CC[C@H]2O)c(O)c1	378756479	YIHBNVSUWHXEJN-MVWJERBFSA-N	221.300	1.875	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C[C@H]2C[C@H]2C1	380361221	ARFHIPHEXOEVEX-OCAPTIKFSA-N	219.240	1.190	10	20	BDCD	
COCCCC(=O)NCCc1ccc(N)cc1	95033985	VDAUMQBFAIOFCB-UHFFFAOYSA-N	236.315	1.354	10	20	BDCD	
C[C@H](CCO)N[C@H]1CCc2cccc(O)c21	297575980	GVUVOWXNRPCUOL-KOLCDFICSA-N	221.300	1.740	10	20	BDCD	
C[C@H](NC[C@@H]1CCCN1)c1cc(F)ccc1O	817951622	HOSVXMSNMAKAKG-ONGXEEELSA-N	238.306	1.934	10	20	BDCD	
C[C@H](NCC(F)(F)CN)c1ccc(F)cc1O	817966684	SYJXODUVVMSLOQ-ZETCQYMHSA-N	248.248	1.776	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC[C@@H](C)N)c1	817973265	RXESBEBXFNSXGY-RKDXNWHRSA-N	224.304	1.399	10	20	BDCD	
COCCCC(=O)NCc1ccc(O)cc1O	910951348	FYNGTTZWEHKHDS-UHFFFAOYSA-N	239.271	1.141	10	20	BDCD	
CN(C)c1ccc(CNC[C@H](N)C2CC2)cc1	841049571	LIJNFGOMCYIUEA-AWEZNQCLSA-N	233.359	1.580	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H]3C[C@@H]3C2)c1	862444048	WXGREWVCIAYBIF-NXEZZACHSA-N	219.284	1.853	10	20	BDCD	
Cc1cccc(O)c1CN1CCn2cncc2C1	877538751	DDUWEIRFVXCKGZ-UHFFFAOYSA-N	243.310	1.913	10	20	BDCD	
CN(CC(=O)NC1CC1)Cc1ccccc1O	109771043	BZZORYJVJIBNQZ-UHFFFAOYSA-N	234.299	1.103	10	20	BDCD	
COC(=O)N(C)Cc1ccc(N(C)C)cc1	790449219	HCCAZMWWTCSBRL-UHFFFAOYSA-N	222.288	1.951	10	20	BDCD	
CN1CCCc2cc(CNC(=N)N)ccc21	161526092	QRDUBLGVUIEIBA-UHFFFAOYSA-N	218.304	1.052	10	20	BDCD	
Cc1cccc(O)c1CN1CCO[C@H](CF)C1	877588033	VDGGKMYDDRRWPZ-LLVKDONJSA-N	239.290	1.871	10	20	BDCD	
CN1CC[C@H]1CN[C@H]1CCc2cccc(O)c21	712581808	PSYZIFWNDNLLNS-RYUDHWBXSA-N	232.327	1.673	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCCO1)c1ccccc1O	827923619	WDXQBMZDLDRECN-BXKDBHETSA-N	235.283	1.748	10	20	BDCD	
C[C@@H](NS(=O)(=O)C1CC1)c1ccccc1O	867834962	XFRNCSODWRGZLQ-MRVPVSSYSA-N	241.312	1.535	10	20	BDCD	
COc1ccc(O)c(CN(C)CC(C)(C)O)c1	271878200	UKDQHGYYNBXZOY-UHFFFAOYSA-N	239.315	1.604	10	20	BDCD	
CN(C)C(=O)COc1ccc(N(C)C)cc1	289405321	OOZYOWZEHWIZKG-UHFFFAOYSA-N	222.288	1.220	10	20	BDCD	
Cc1ccc([C@H](C)NC[C@H](C)N)c(O)c1	817972747	OHQSCDVPTLQXCD-UWVGGRQHSA-N	208.305	1.698	10	20	BDCD	
Cn1cncc1CNC(=O)c1cc(O)cs1	811589138	MQSFTKRVOORLLW-UHFFFAOYSA-N	237.284	1.117	10	20	BDCD	
C[C@H]1COCC[C@@H]1NCCc1ccc(N)cc1	817957636	NHBJGIHSTBYUOL-FZMZJTMJSA-N	234.343	1.826	10	20	BDCD	
COCC(COC)OC(=O)c1cc(O)cs1	909003828	PALYXRWTIBYLPV-UHFFFAOYSA-N	246.284	1.272	10	20	BDCD	
Nc1ccc(NC(=O)[C@H](N)CC(F)F)cc1	832244012	FDZCZZCBFUYEEF-MRVPVSSYSA-N	229.230	1.190	10	20	BDCD	
CN(C)c1ccc(CNC(=O)c2ccon2)cc1	920253524	ZLIPZCMMRJHHAN-UHFFFAOYSA-N	245.282	1.671	10	20	BDCD	
CCN(CC)c1ccc(CN[C@@H](C)CN)cc1	841063507	KYLUMQASRUJLPW-LBPRGKRZSA-N	235.375	1.970	10	20	BDCD	
CN(C(=O)/C=C\c1cncc(F)c1)c1cn[nH]c1	754348770	FSYYRAFRIYASNF-IHWYPQMZSA-N	246.245	1.620	10	20	BDCD	
C[C@@H](NC1CCN(C=O)CC1)c1ccccc1O	895852353	SSRCNWDAUAIOLE-LLVKDONJSA-N	248.326	1.664	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@@H](CO)C2)cc1	707674244	ROPONDRHRBJZHK-BETUJISGSA-N	234.343	1.613	10	20	BDCD	
O=C(O)c1cnc(SC[C@H](O)C2CC2)s1	1608978584	HIMVAKLBTUCCKW-LURJTMIESA-N	245.325	1.704	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)c1ccco1	6528142	MOWZTKBNHJSATP-UHFFFAOYSA-N	247.250	1.663	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C[C@@H](C)O)c1O	164591284	AQYRANUDWXQLOD-WDEREUQCSA-N	223.316	1.950	10	20	BDCD	
CC(C)CC(=O)NCCc1ccc(O)c(O)c1	11638547	VBFMYENEZWXFTJ-UHFFFAOYSA-N	237.299	1.803	10	20	BDCD	
CC(C)[C@@](C)(CN)NC(=O)Cc1ccc(N)cc1	262608799	CQLLWHMDDUOCPI-CQSZACIVSA-N	249.358	1.301	10	20	BDCD	
Oc1ccccc1CNCc1cocn1	308947773	SZSPYWDQVQXVQG-UHFFFAOYSA-N	204.229	1.670	10	20	BDCD	
C[C@H](CCNCc1cc(F)ccc1O)N(C)C	700470951	HNDRDJJAFKGSIM-SNVBAGLBSA-N	240.322	1.961	10	20	BDCD	
CC(C)CNCC(=O)NCc1ccccc1O	692169346	BMVQCBLVQUIDCL-UHFFFAOYSA-N	236.315	1.254	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](CO)CC2CC2)c1	754835956	YGJLBEFMQQXVEP-ZDUSSCGKSA-N	235.327	1.951	10	20	BDCD	
CCN(C[C@@H](C)N)c1ccc(OC)c(OC)c1	20239637	MECWGCBKYYFRTL-SNVBAGLBSA-N	238.331	1.877	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCCN(C)C)c1	22141536	OKQWPOYVZWLUOK-SNVBAGLBSA-N	238.331	1.613	10	20	BDCD	
CNCCCN(C)c1ccc(OC)cc1OC	125006932	IGHCMDHDSGMWSR-UHFFFAOYSA-N	238.331	1.750	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCCOCCO)c1	35628943	QKBYOPMNURIXRA-LLVKDONJSA-N	239.315	1.360	10	20	BDCD	
NC[C@H]1CCCN(Cc2cc(F)ccc2O)C1	219733672	VAYMPJVOXRVFIO-SNVBAGLBSA-N	238.306	1.702	10	20	BDCD	
COCCCNCc1cc(C)ccc1O	70955009	PBUVSMAMDLNBIL-UHFFFAOYSA-N	209.289	1.827	10	20	BDCD	
C[C@@H](O)CN(C)c1ccc2c(c1)OCO2	49814486	HDTSDEOZTUYTJN-MRVPVSSYSA-N	209.245	1.232	10	20	BDCD	
Cn1nncc1CSc1nccs1	289298360	CFHIICDFRSYKCN-UHFFFAOYSA-N	212.303	1.564	10	20	BDCD	
O=C(N[C@H]1CCSC1)c1cccc(O)c1O	231355718	JLULPOGAJATHLI-ZETCQYMHSA-N	239.296	1.333	10	20	BDCD	
COC(=O)[C@@H](NCc1ccccc1O)C1CC1	234563628	VWPZWJVPDMOVQL-LBPRGKRZSA-N	235.283	1.433	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H]2C[C@@H](O)C2)c(O)c1	295851587	DYLBHEQSEROZOG-MXWKQRLJSA-N	221.300	1.875	10	20	BDCD	
CC[C@@H](N[C@@H](C)CN)c1ccccc1O	817970115	LUGZHJJYHNTOLY-GXSJLCMTSA-N	208.305	1.780	10	20	BDCD	
CCOc1ccc(O)c(CN[C@@H]2CCNC2)c1	841044814	IWTQEEZARWYBKW-LLVKDONJSA-N	236.315	1.242	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCNC[C@H]1C	843047157	HOPFCHZKCIBGBN-CYBMUJFWSA-N	247.386	1.855	10	20	BDCD	
COC(C)(C)CNC(=O)c1cc(O)cs1	743719943	BNVUPMYAZSVDNZ-UHFFFAOYSA-N	229.301	1.609	10	20	BDCD	
O=C(N=c1cc[nH]cc1)c1c(F)ccc(O)c1O	789946651	ITAUDUBDLITSQI-UHFFFAOYSA-N	248.213	1.306	10	20	BDCD	
CC[C@@H]1C[C@H]1C(=O)NCc1ccc(N)cc1	387692459	XDJCUCYUZAXYJH-ZYHUDNBSSA-N	218.300	1.931	10	20	BDCD	
COc1ccc(O)c(CNCC2=CCCOC2)c1	127310492	LTHUMPMHHNXDSC-UHFFFAOYSA-N	249.310	1.837	10	20	BDCD	
OCC(F)(F)CN[C@H]1CCc2cccc(O)c21	296387347	JOOPAZHXBPZLBI-VIFPVBQESA-N	243.253	1.597	10	20	BDCD	
COC(=O)[C@H](C)N1CCCc2cc(CN)ccc21	700925746	WBVAGOPCEICEFH-JTQLQIEISA-N	248.326	1.459	10	20	BDCD	
COc1ccc(CNCC2(N)CC2)cc1C	259135513	RBBYNZRPRDLBDY-UHFFFAOYSA-N	220.316	1.585	10	20	BDCD	
CC(=O)C(=O)COC(=O)CC1CCCCC1	808486847	LBKHUURHASKQCD-UHFFFAOYSA-N	226.272	1.658	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]1N	818103321	RVKDJUDJELAVRD-NEPJUHHUSA-N	248.326	1.478	10	20	BDCD	
CC[C@@H](CO)N(C)C(=O)c1cc(O)cs1	833337024	MBHTXRYJTCTLCE-ZETCQYMHSA-N	229.301	1.297	10	20	BDCD	
C[C@@H](NCCCSc1nccs1)C(=O)O	904220755	DAQJUNXIHBSKQZ-SSDOTTSWSA-N	246.357	1.688	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC2(CC2)C1	833322884	RGMFYPMMUVZSNK-UHFFFAOYSA-N	209.270	1.690	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC(CO)CC1	765232513	HJPYAIBUORWAGS-UHFFFAOYSA-N	241.312	1.298	10	20	BDCD	
C[C@H]1C[C@H](O)CN1Cc1cc(F)cc(F)c1O	894539844	XKDLVCKCFOPKHH-XVKPBYJWSA-N	243.253	1.626	10	20	BDCD	
C[C@@H](NCc1ccc(N)cc1)c1csnn1	398395735	YVMANLRDYIWTGU-MRVPVSSYSA-N	234.328	1.971	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1NCC1(C)C	710086341	YQTUDJSYXSJVCW-GFCCVEGCSA-N	248.326	1.349	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)CC(=O)O)c1	1604821280	VSYWMSFXMHPGDH-QMMMGPOBSA-N	239.271	1.354	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)c2ncn(C)n2)c1	275772815	HELOPBFLSSXAQD-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
Oc1ccccc1CN[C@@H]1C[C@H]2CC[C@H]1NC2	530245697	CDCFCGLVSUQDDH-RAIGVLPGSA-N	232.327	1.622	10	20	BDCD	
Cc1ccc(O)c(CNCCNC(=O)C2CC2)c1	113313582	NHEAEVIFYZFEEX-UHFFFAOYSA-N	248.326	1.316	10	20	BDCD	
CC1(C(=O)NCCc2ccc(O)c(O)c2)CCC1	122776662	HTTAILUROGFMFK-UHFFFAOYSA-N	249.310	1.947	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCC(F)(F)CO)c1	184686674	RUPJKDOVZVQWHP-SECBINFHSA-N	245.269	1.979	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCCNC1	37823732	FGTZOGJZUUJLHT-NSHDSACASA-N	248.326	1.350	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CC(C)(C)N	84182536	LJSSPKZSAQKXAX-UHFFFAOYSA-N	236.315	1.478	10	20	BDCD	
O=C(CCO)NCc1c(O)ccc2c1CCCC2	902879057	DNEZQRIEAGBWLW-UHFFFAOYSA-N	249.310	1.270	10	20	BDCD	
C[C@@H](CCCCN)NC(=O)Cc1ccc(N)cc1	834786803	SUKGTHHAWPAQGT-NSHDSACASA-N	249.358	1.445	10	20	BDCD	
COc1cccc(CN[C@@H](C)C[C@H](C)N)c1O	843129820	RPBWINLHBNCPQD-UWVGGRQHSA-N	238.331	1.616	10	20	BDCD	
C[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1	768443969	KEISHHWBFQAHRR-NOZJJQNGSA-N	249.310	1.660	10	20	BDCD	
C[C@@H](NCc1ccnn1C)c1ccccc1O	71333131	CFYNLBOCSUFDAV-SNVBAGLBSA-N	231.299	1.977	10	20	BDCD	
CCOC1CCN(C(=O)CN=[N+]=[N-])CC1	409426390	HXUKHBWCRMBUGR-UHFFFAOYSA-N	212.253	1.324	10	20	BDCD	
O=C(NCc1ccccc1O)NOCC(F)F	793171170	OEMBCBMVYKXRHW-UHFFFAOYSA-N	246.213	1.388	10	20	BDCD	
COc1ccc(CNC(=O)c2ccon2)c(O)c1	794378959	KXNGTMKEANXZIQ-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
CC1(C)CN(C(=O)c2cc(O)cs2)C1	791039151	NTHAVPLUPJSBOY-UHFFFAOYSA-N	211.286	1.936	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1C[C@H]1F)c1ccccc1O	1347190430	PXIDPBKMOMPXDH-FKTZTGRPSA-N	223.247	1.927	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCCNCC1	846676872	JWQULDXWRSFHNC-LLVKDONJSA-N	248.326	1.398	10	20	BDCD	
Cc1cccc(CN[C@H]2CCCN[C@H]2C)c1O	841065609	RFYJJCUYYAFGGG-AAEUAGOBSA-N	234.343	1.931	10	20	BDCD	
CC(C)OCCNC(=O)c1cccc(O)c1O	126541220	PEZYRVTUQXBAPP-UHFFFAOYSA-N	239.271	1.253	10	20	BDCD	
CC[C@@H](NC[C@@H](C)O)c1ccccc1O	35601760	GLPQHFJETHNBNS-MWLCHTKSSA-N	209.289	1.814	10	20	BDCD	
CN(C(=O)[C@H]1CCOC1)c1ccc(N)cc1	40941372	FNPCDHJLDXUNLI-VIFPVBQESA-N	220.272	1.268	10	20	BDCD	
NC[C@@H]1CCCC[C@@H]1NCc1ccccc1O	228406629	RPWJMAPCRFJOJS-AAEUAGOBSA-N	234.343	1.999	10	20	BDCD	
C[C@H](O)CCCNCc1cc(F)ccc1O	228091015	QBXCGFUFXXHHNO-VIFPVBQESA-N	227.279	1.782	10	20	BDCD	
CCC1(C(=O)NCc2ccc(N)cc2)COC1	837303198	YHOUUDCRCVEUSR-UHFFFAOYSA-N	234.299	1.312	10	20	BDCD	
CNC(=N)NCc1cc(Cl)cc(Cl)c1O	849077405	GONCTEYQUABIMA-UHFFFAOYSA-N	248.113	1.943	10	20	BDCD	
CCNCCNCc1cc(Cl)ccc1O	841037723	UHRKSNZKXNNEHQ-UHFFFAOYSA-N	228.723	1.745	10	20	BDCD	
Cc1cccc(CN(C)C2CCNCC2)c1O	843046123	NWPNKJURAURGPM-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
COCC1(N(C)C(=O)c2cc(O)cs2)CC1	855339388	JBUGNRCLYVAQEU-UHFFFAOYSA-N	241.312	1.705	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)N1C[C@H]2C[C@H]2C1	862557486	XGCCGEZMUSAFOK-XVBRFGGHSA-N	245.278	1.589	10	20	BDCD	
Cc1ccc(CN[C@H]2C[C@H](O)C2)c(O)c1	877641454	UNTZDYDLEIHMLN-XYPYZODXSA-N	207.273	1.314	10	20	BDCD	
COC[C@@H](O)CN[C@@H](C)c1ccc(F)cc1O	71269112	YHVRXFCUVHGRRE-WPRPVWTQSA-N	243.278	1.189	10	20	BDCD	
C[C@@H](NCC(F)(F)CO)c1c(O)cccc1F	886592071	KBYSDWCWUUISAJ-SSDOTTSWSA-N	249.232	1.810	10	20	BDCD	
CCOC[C@@H]1CCCN1C(=O)CN=[N+]=[N-]	409424680	CQOKHLHIWUEJSX-QMMMGPOBSA-N	212.253	1.324	10	20	BDCD	
CN(C)C[C@H]1CCN(Cc2ccc(N)cc2)C1	708476694	LMDZYFVWWIKZRY-CYBMUJFWSA-N	233.359	1.652	10	20	BDCD	
COC(C)(C)C(=O)NCc1cccc(O)c1O	1348048037	SADIYYMKNPIERP-UHFFFAOYSA-N	239.271	1.139	10	20	BDCD	
CC1(C)CCN[C@@H]1C(=O)NCc1ccc(N)cc1	1515331020	CTKGKQKEYBJHQA-GFCCVEGCSA-N	247.342	1.273	10	20	BDCD	
CCN(C)c1ccc(CNCC(=O)O)c(C)c1	1776856780	KVVUMKLXXDBTEL-UHFFFAOYSA-N	236.315	1.625	10	20	BDCD	
C[C@H](CO)CNCc1cccc(Cl)c1O	162830033	ACCIFPRLKQTICL-QMMMGPOBSA-N	229.707	1.764	10	20	BDCD	
C[C@H](C(=O)O)[C@@H](C)NCc1ccccc1O	162956141	ORLUZOBJTMFWEP-DTWKUNHWSA-N	223.272	1.591	10	20	BDCD	
CN(C)CC(C)(C)NCc1cc(F)ccc1O	308610824	ZJCFFTWOEMLKIG-UHFFFAOYSA-N	240.322	1.961	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCCCO2)cc1	50958861	ROSCTOJBVBRPDM-GFCCVEGCSA-N	234.299	1.454	10	20	BDCD	
Cc1ccc(O)c(CN2CCC(O)CC2)c1	128064924	WELJOVWISRVLOJ-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
Cc1cccc(CN[C@H]2C(=O)NCC[C@@H]2C)c1O	195006936	CNFIXMGENJSMPG-JOYOIKCWSA-N	248.326	1.315	10	20	BDCD	
C[C@H](N[C@@H]1CCN(C)C1)c1cc(F)ccc1O	94617857	QZUUWIWSDVNAGL-GXSJLCMTSA-N	238.306	1.886	10	20	BDCD	
O=C(NC(CF)CF)c1c(F)ccc(O)c1O	833426928	SXXMVLBSRSJPBK-UHFFFAOYSA-N	249.188	1.274	10	20	BDCD	
CNCCN(C)Cc1ccc(N(C)C)c(F)c1	843057719	RZMBTWLAYHZDTD-UHFFFAOYSA-N	239.338	1.543	10	20	BDCD	
N[C@@H](CNCc1c(O)cccc1Cl)C1CC1	841048938	HHAGRDNMHTXYPV-NSHDSACASA-N	240.734	1.873	10	20	BDCD	
COc1ccc(CNC2=NCCCN2C)c(O)c1	849025190	SIWQLUPJLRVUKL-UHFFFAOYSA-N	249.314	1.182	10	20	BDCD	
C[C@@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O	768465785	LHKXTFYXLQIWMY-NOZJJQNGSA-N	249.310	1.802	10	20	BDCD	
Nc1ccc(N2C[C@@H]3COC[C@H]3C2)cc1	409425185	FJTXFYGNLHCKNJ-NXEZZACHSA-N	204.273	1.351	10	20	BDCD	
Nc1ccc(CN2CC[C@@H](n3cncn3)C2)cc1	1120268174	BDDUVSMCFJYLSM-CYBMUJFWSA-N	243.314	1.307	10	20	BDCD	
C[C@H](O)[C@@H]1CCN(C(=O)c2cc(O)cs2)C1	780803148	IPTYAFWLGCEAAZ-JGVFFNPUSA-N	241.312	1.297	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H]3COC[C@H]3C2)c1	718251287	QXWMVZGSDGIMSX-BETUJISGSA-N	233.311	1.779	10	20	BDCD	
C[C@H]1CCN[C@@H](C(=O)NCc2ccc(N)cc2)C1	1524009764	VPHOAAYPBXYNAP-GXFFZTMASA-N	247.342	1.273	10	20	BDCD	
C[C@]1(NC(=O)Nc2ccc(N)cc2)CCOC1=O	1576542264	VJFUSCWCPNYDDR-LBPRGKRZSA-N	249.270	1.096	10	20	BDCD	
CC(=O)C1(C(=O)NCc2ccc(N)cc2)CC1	1574981949	WVKMZMOWFZUSDB-UHFFFAOYSA-N	232.283	1.254	10	20	BDCD	
C[C@@H]1CC[C@@H](CNC(=O)Nc2ccc(N)cc2)O1	397943349	IMWHEBRMZNPMBS-SKDRFNHKSA-N	249.314	1.958	10	20	BDCD	
Cc1ccc(CN2CC[C@]3(CCNC3)C2)c(O)c1	1579692030	PDQOTMDBYGKNKN-HNNXBMFYSA-N	246.354	1.886	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)C[C@]1(C)C(=O)O	1599929437	SNANPRXLNZZNRV-HZMBPMFUSA-N	248.326	1.811	10	20	BDCD	
CCONC(=O)c1ccc(C)c(O)c1O	177664684	PMUVTGQBIPJCPX-UHFFFAOYSA-N	211.217	1.088	10	20	BDCD	
Oc1ccccc1CNCC1(O)CCC1	123175328	FYGYETFWFTZPMV-UHFFFAOYSA-N	207.273	1.397	10	20	BDCD	
COC[C@@H](C)NCc1ccc2c(c1)CCO2	37362461	QXOXYNKOGWRUQL-SNVBAGLBSA-N	221.300	1.746	10	20	BDCD	
CC(C)CNC(=O)CNCc1ccccc1O	134522736	ZZJVIPUUPJOJBE-UHFFFAOYSA-N	236.315	1.254	10	20	BDCD	
C[C@@H](CCO)CNCc1ccccc1O	85126585	GSUKVNRPUJPEKI-JTQLQIEISA-N	209.289	1.500	10	20	BDCD	
CCCN(CCO)Cc1cc(OC)ccc1O	271823052	PONQKHNJLWIEJH-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
OC[C@@]1(F)CCN(Cc2cc(F)ccc2O)C1	802660580	PPUVQTZCFVJHLU-GFCCVEGCSA-N	243.253	1.438	10	20	BDCD	
CNCCCN[C@@H](C)c1cc(OC)ccc1O	817940894	OWNRVRBFVIRVQB-JTQLQIEISA-N	238.331	1.661	10	20	BDCD	
C[C@H]1C[C@@H](NCCc2ccc(N)cc2)CCO1	817956436	YYPPZWLLNXKDNF-FZMZJTMJSA-N	234.343	1.968	10	20	BDCD	
CCC[C@](C)(CO)NC(=O)c1cc(O)cs1	831816934	LYWHQEHQPFDVTA-LLVKDONJSA-N	243.328	1.735	10	20	BDCD	
C[C@H](NC1CC1)C(=O)N(C)c1ccc(N)cc1	877078013	ZDDHTJKVTDLCTI-VIFPVBQESA-N	233.315	1.372	10	20	BDCD	
CCN(CCO)Cc1ccc(C)cc1O	876527299	YZZHFNNFXMKANG-UHFFFAOYSA-N	209.289	1.515	10	20	BDCD	
COc1ccc(CNC[C@H]2C[C@H](O)C2)cc1C	720938684	DLBMJNPUUCTAPF-JOCQHMNTSA-N	235.327	1.864	10	20	BDCD	
CCN(C)S(=O)(=O)Nc1ccc(O)cc1F	758168942	HXQAQBLXEFDBAK-UHFFFAOYSA-N	248.279	1.140	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1CC=CC1	159003885	LWHXOQTYHKFFTR-UHFFFAOYSA-N	233.267	1.680	10	20	BDCD	
CCc1cccc(CN(C)[C@H]2CCNC2=O)c1O	848890004	ONULVZXVBWYJPD-LBPRGKRZSA-N	248.326	1.275	10	20	BDCD	
CCO[C@H](C)C(=O)N(C)Cc1ccccc1O	66484912	YIQDIJHZEFAWIP-SNVBAGLBSA-N	237.299	1.776	10	20	BDCD	
CN(C)c1ccc(CN2CCCNCC2)cc1	38086923	VTOYOIAORUPNRT-UHFFFAOYSA-N	233.359	1.548	10	20	BDCD	
Cc1ccc([C@H](C)NCC(F)(F)CO)c(O)c1	184705210	XJRIBXJGNHLPCH-VIFPVBQESA-N	245.269	1.979	10	20	BDCD	
C[C@H](N)CC(=O)NCc1ccc(N(C)C)cc1	40825889	BLWIQSJHXUQOLU-JTQLQIEISA-N	235.331	1.106	10	20	BDCD	
OCCCNCc1c(O)cccc1Cl	83551238	VOCCKAFWHIUOCT-UHFFFAOYSA-N	215.680	1.518	10	20	BDCD	
CCN(CCOCCO)c1ccc(OC)cc1	265829005	TZLQGBNJQVFXFL-UHFFFAOYSA-N	239.315	1.530	10	20	BDCD	
C[C@@H](NC(=O)C1(N(C)C)CC1)c1ccccc1O	827952071	FPTBXJUEEIIBIZ-SNVBAGLBSA-N	248.326	1.664	10	20	BDCD	
COCCCN(C)C(=O)c1cc(O)cs1	731871623	OPFCYHWTUTWPMN-UHFFFAOYSA-N	229.301	1.562	10	20	BDCD	
Cc1cccc(CN2CCNCC2(C)C)c1O	843054469	MWZIYWALSHKTLV-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
O=C(O)[C@H]1C[C@@H](NCc2cc(F)ccc2O)C1	874046487	ZQWMGHIWUHJQCN-WKFQBHICSA-N	239.246	1.484	10	20	BDCD	
CC1(NC(=O)NCc2ccc(N)cc2)CC1	1120677138	LAABOCWMCMELHK-UHFFFAOYSA-N	219.288	1.621	10	20	BDCD	
CN(C(=O)c1cc(O)cs1)[C@@H]1CCC[C@H]1O	899344362	ILHZNJUHPTZHDY-RKDXNWHRSA-N	241.312	1.439	10	20	BDCD	
Nc1ccc(CN2CC[C@H]3NCC[C@H]3C2)cc1	1336286500	QZZQPUFJFLKQLD-GXTWGEPZSA-N	231.343	1.453	10	20	BDCD	
NC(=O)C[C@H]1CCCN(Cc2ccc(N)cc2)C1	1336116552	GDEZHSMCMZSBJP-GFCCVEGCSA-N	247.342	1.356	10	20	BDCD	
C[C@H](NCc1c(O)ccc(Cl)c1F)C(=O)O	309811337	ZCORIXUKRRALCA-YFKPBYRVSA-N	247.653	1.747	10	20	BDCD	
C[C@@H]1CC[C@@H](O)CN1C(=O)Cc1ccc(N)cc1	399227289	AFEKNFIAOFASES-ZWNOBZJWSA-N	248.326	1.183	10	20	BDCD	
Nc1ccc(NC(=O)c2cnccn2)cc1	60286031	URXQOIYLZSBJBB-UHFFFAOYSA-N	214.228	1.311	10	20	BDCD	
NC[C@@H]1CCN(Cc2cc(F)ccc2O)C1	67805779	BHYBWOKWLYQADC-VIFPVBQESA-N	224.279	1.312	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2CC[C@@H](O)C2)c1	188839894	SEALPYKZKNKIRV-DGCLKSJQSA-N	235.327	1.951	10	20	BDCD	
O=C(NCc1ccccc1O)NC1CCC1	122932452	BTXYQOYMSZVKTC-UHFFFAOYSA-N	220.272	1.744	10	20	BDCD	
Cc1cc(O)c(CN[C@@]2(C)CCOC2=O)cc1C	289724948	GGSRHVYKDSQHRN-AWEZNQCLSA-N	249.310	1.804	10	20	BDCD	
CCC[C@H](O)CCNC(=O)c1cc(O)cs1	832673558	JIOCQHREJNNURV-QMMMGPOBSA-N	243.328	1.735	10	20	BDCD	
N[C@@H]1CCC[C@@H](NCc2cc(F)ccc2O)C1	841058203	QKQSOEKQXVBMKY-VXGBXAGGSA-N	238.306	1.891	10	20	BDCD	
COc1cccc([C@@H](C)NCc2cc[nH]n2)c1O	846148161	XUFGKJLBMGEZGO-SECBINFHSA-N	247.298	1.975	10	20	BDCD	
Cc1ccc(C(=O)OCc2ccon2)c(O)c1O	744910160	OIFJAKDGZLGNHP-UHFFFAOYSA-N	249.222	1.751	10	20	BDCD	
Cc1cc(CN2C[C@@H](N)C[C@H]2C)ccc1N(C)C	923412917	KYJIUBWCPIEFQH-OCCSQVGLSA-N	247.386	1.983	10	20	BDCD	
COC[C@H](O)CN[C@@H](C)c1ccc(C)cc1O	71264965	YVMWENYSVJPPTL-WDEREUQCSA-N	239.315	1.359	10	20	BDCD	
C[C@@H](O)[C@@H](N)c1cccc(Br)c1O	95664609	AAFUDAAVJMVDRI-SVGQVSJJSA-N	246.104	1.535	10	20	BDCD	
CNC[C@@H](C)CN[C@H](C)c1ccccc1O	1326036699	UDWHVIOLMQNYLF-GHMZBOCLSA-N	222.332	1.898	10	20	BDCD	
CC1CCN(CC(=O)Nc2ccc(N)cc2)CC1	22155797	XFGRMRWCXZFCLF-UHFFFAOYSA-N	247.342	1.939	10	20	BDCD	
COc1ccc(CN[C@@H]2CCNC2)cc1C	259155733	VEPXOIYFAXVNAV-GFCCVEGCSA-N	220.316	1.455	10	20	BDCD	
CN(CCN1CCCC1=O)Cc1ccc(N)cc1	692232888	GXZMUKUZNRRAPH-UHFFFAOYSA-N	247.342	1.323	10	20	BDCD	
C[C@H](NCCCn1cncn1)c1ccccc1O	381847181	ZHZFBEQBKCRFOO-NSHDSACASA-N	246.314	1.725	10	20	BDCD	
CC[C@H](COC)NCc1cccc(OC)c1O	79735379	CVQYPTGWSQBTSH-LLVKDONJSA-N	239.315	1.915	10	20	BDCD	
CN(C)[C@H]1CCCN(Cc2ccc(N)cc2)C1	91392483	IXSJYUINRIPMSU-AWEZNQCLSA-N	233.359	1.795	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)OCCF	803400956	MAHAWIJYZJVCMQ-RQOWECAXSA-N	226.203	1.624	10	20	BDCD	
CC(=O)NC(C)(C)C(=O)Nc1ccc(N)cc1	818556156	ZLIBOOLPNCZZIJ-UHFFFAOYSA-N	235.287	1.122	10	20	BDCD	
C[C@H](NCCCON)c1ccc(N(C)C)cc1	902421099	NOLCRXQNWGMZBN-NSHDSACASA-N	237.347	1.684	10	20	BDCD	
CCOCCOC(=O)c1cc(O)cs1	731910001	MMDKGCLOLZVUQK-UHFFFAOYSA-N	216.258	1.647	10	20	BDCD	
CN(C(=O)[C@@H]1C[C@@]12CCNC2)c1ccc(N)cc1	877077682	QVYSMSKSXUFYON-GXTWGEPZSA-N	245.326	1.231	10	20	BDCD	
Nc1ccc(N2C[C@H]3COC[C@H]3C2)cc1	409425184	FJTXFYGNLHCKNJ-AOOOYVTPSA-N	204.273	1.351	10	20	BDCD	
C[C@@H]1NC(=O)N(Cc2ccc(N(C)C)cc2)C1=O	272119994	QCEOPJICZFPTCA-VIFPVBQESA-N	247.298	1.193	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](C(=O)O)C2)c1	86790161	ICSHEPYACGRASV-JTQLQIEISA-N	235.283	1.607	10	20	BDCD	
COc1cc(C)cc(CNC2CSC2)c1O	895316028	GOGFIOKERUNRIQ-UHFFFAOYSA-N	239.340	1.914	10	20	BDCD	
C[C@@H](NCc1cc(F)cc(F)c1O)C(=O)O	708393323	CVNBZXFILLYSAQ-RXMQYKEDSA-N	231.198	1.233	10	20	BDCD	
CCO[C@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)C1	841297286	DMSUDIPXBVVOLE-TXEJJXNPSA-N	249.314	1.958	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@@H]1CCC[C@H]1O)CC2	296631349	CGOGVPDACVZEKX-IJLUTSLNSA-N	233.311	1.883	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@@]1(O)CCOC1)CC2	297092004	XHHOBYKQPULUJF-RISCZKNCSA-N	249.310	1.121	10	20	BDCD	
OC[C@H](NCc1cc(F)cc(F)c1O)C1CC1	883001578	HUXCUWDCTLNLJC-NSHDSACASA-N	243.253	1.531	10	20	BDCD	
C[C@@H](Cn1cccn1)NCc1ccc(N)cc1	1345160753	YGSAIHARQUDGFC-NSHDSACASA-N	230.315	1.644	10	20	BDCD	
COC[C@@H](C)NC(=S)NCc1cccn1C	231647851	MVNGCUUZFPXLSZ-SECBINFHSA-N	241.360	1.024	10	20	BDCD	
C[C@H](NCc1ccc(N(C)C)cc1)C(=O)N(C)C	35140754	XOAJIJXDCRMNOB-NSHDSACASA-N	249.358	1.319	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CC[C@H](O)C2)c1O	187987313	BVFAMUXVBMKLCW-YPMHNXCESA-N	235.327	1.951	10	20	BDCD	
C[C@@H](CO)N[C@H](C)c1cc(F)cc(F)c1O	134926206	IXANYTFAWCRUIM-NKWVEPMBSA-N	231.242	1.702	10	20	BDCD	
CCOCCNC(=O)NCc1ccccc1O	299521872	QJTOMYDAOOKGTG-UHFFFAOYSA-N	238.287	1.228	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c(O)c1C	817977074	AHVIDJZNZGOVHZ-ZZVYKPCYSA-N	246.354	1.877	10	20	BDCD	
Cc1cc(CNC2(C(N)=O)CC2)ccc1N(C)C	815087158	CQOLWYWKOYGNCU-UHFFFAOYSA-N	247.342	1.169	10	20	BDCD	
CC(C)[C@H](N)CN[C@H]1CCc2cccc(O)c21	817959134	PODWISYSHDBUES-NEPJUHHUSA-N	234.343	1.952	10	20	BDCD	
CO[C@@H](C)CC(=O)N(C)c1ccc(N)cc1	877078527	SPMRSPNJAIKZKO-VIFPVBQESA-N	222.288	1.657	10	20	BDCD	
N[C@H]1CCC[C@@H](NCc2cccc(F)c2O)C1	841058273	RJWQTQKSDMQWMA-WDEREUQCSA-N	238.306	1.891	10	20	BDCD	
COC[C@H](NC(=O)c1cc(O)cs1)C1CC1	750539779	VDOVGGQDEQECND-VIFPVBQESA-N	241.312	1.609	10	20	BDCD	
C[C@H]1COC[C@H]1NC(=O)c1cc(O)cs1	928909403	DWTDRCJRHHMDAL-POYBYMJQSA-N	227.285	1.218	10	20	BDCD	
CNC[C@H](C)NCc1ccc(N(C)C)c(F)c1	853249774	VVJIPAYHGWCBNX-JTQLQIEISA-N	239.338	1.589	10	20	BDCD	
C[C@H](N[C@H](C)c1ccccc1O)c1nnnn1C	879649482	UMHUCJBMZLQTHT-BDAKNGLRSA-N	247.302	1.328	10	20	BDCD	
Cc1ccc(O)c(CN2CC(=O)N(C)C[C@H]2C)c1	783733183	KLBPXCHXPPUHGY-LLVKDONJSA-N	248.326	1.363	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H]2CC(=O)N(C)C2)c(O)c1	273612486	WLQPPFWFXAPTTN-QWRGUYRKSA-N	248.326	1.582	10	20	BDCD	
C[C@H](O)[C@@H](C)NCc1ccc(N2CC=CC2)cc1	1327979781	XMCSHSNTDMJVAT-OLZOCXBDSA-N	246.354	1.922	10	20	BDCD	
Cc1ccc(CN[C@H]2CC=C(C(=O)O)C2)c(O)c1	1600418895	PXLORKPSRRJKBP-LBPRGKRZSA-N	247.294	1.964	10	20	BDCD	
O=C(O)Cn1cc(NCc2ccccc2O)cn1	1595147675	IPYAAGJRGHVDKS-UHFFFAOYSA-N	247.254	1.285	10	20	BDCD	
CC[C@H](CC(=O)O)NCc1ccc2c(c1)CCO2	1776955352	WFMOQUJHTJJZDY-GFCCVEGCSA-N	249.310	1.964	10	20	BDCD	
COc1cccc(CN[C@@H](CO)C2CC2)c1O	734164119	KIMCAFZNXIZKCJ-NSHDSACASA-N	237.299	1.261	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1[C@@H]2CCC[C@@H]12	182519386	BQAVFRWWJSOAKM-NXEZZACHSA-N	247.294	1.760	10	20	BDCD	
C[C@H]1COCCN1Cc1cc(F)ccc1O	226562493	ALVKSOUAGJDYKZ-VIFPVBQESA-N	225.263	1.752	10	20	BDCD	
C[C@H](CF)NCc1cc2c(cc1O)OCO2	288371561	FCTRJWHGTYOXRS-SSDOTTSWSA-N	227.235	1.569	10	20	BDCD	
Cc1ccc(O)c(CN(C)C2CNC2)c1	85257393	MCDSGGNBHJFALR-UHFFFAOYSA-N	206.289	1.104	10	20	BDCD	
Oc1c(F)cc(F)cc1CN1CCNCC1	82652701	LZJZGSREARANAJ-UHFFFAOYSA-N	228.242	1.076	10	20	BDCD	
CCCOc1ccc(CN(C)CCO)c(O)c1	270992230	IMURXSSDIUEHHM-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
CCOc1ccc(CN[C@H](C)COC)c(O)c1	725844033	JYACYNASOVQBMK-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
CN(C)c1ccc(/C=C\CN[C@@H]2CNOC2)cc1	904423841	JJSFFMXYNNPPFQ-DHCBQETCSA-N	247.342	1.259	10	20	BDCD	
C[C@@H]1C[C@H]1CNC[C@@H](N)c1ccc(N(C)C)cc1	841040916	COBYQWHBZIHSHT-OSAQELSMSA-N	247.386	1.998	10	20	BDCD	
CC(C)[C@@H](CNCc1ccccc1O)C(=O)O	848638665	BJAGOYYPUOHAMJ-LLVKDONJSA-N	237.299	1.839	10	20	BDCD	
Cc1ccc(CN2CC[C@H](C)[C@@H]2CO)c(O)c1	877463999	IETOMNYOXFVPCQ-AAEUAGOBSA-N	235.327	1.903	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@H](F)C2)c1	689856381	AEYFNEPMXMHSET-JTQLQIEISA-N	225.263	1.945	10	20	BDCD	
CCc1cccc(CN[C@H](C)CCO)c1O	691471927	BKURADCYTIZALB-SNVBAGLBSA-N	223.316	1.815	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2C[C@H](O)C2)cc1	720939690	JZQBQFWSQSDCTH-MQMHXKEQSA-N	234.343	1.613	10	20	BDCD	
Cn1cccc1CNC(=S)NCC1CCC1	1323237516	GPCBLIUZPWPWKW-UHFFFAOYSA-N	237.372	1.789	10	20	BDCD	
COCC(=O)Nc1c(Cl)ccc2nonc12	1344042050	AQUHEABAVKWRNE-UHFFFAOYSA-N	241.634	1.461	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@H](N)C2CC2)cc1	1342023220	UBAQYNIYEXCHTP-LBPRGKRZSA-N	233.315	1.012	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1C[C@H]1F	1123769326	IQRYPLKOAVMFQE-DTWKUNHWSA-N	209.220	1.366	10	20	BDCD	
CNC(=O)[C@]1(C)CCN(Cc2ccc(N)cc2)C1	230893549	NWDLXUVMSAMZKD-CQSZACIVSA-N	247.342	1.227	10	20	BDCD	
CN(C(=O)[C@H]1CCCCN1C)c1ccc(N)cc1	877077803	UYPHPKZAUVDJCY-CYBMUJFWSA-N	247.342	1.716	10	20	BDCD	
CN1CCCC[C@H]1C(=O)Nc1ccc(N)cc1	832244125	LFXGPATUEFHMLQ-LBPRGKRZSA-N	233.315	1.692	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C(=O)N(C)C)c1O	127873721	UZZSSOUEFOARTO-JTQLQIEISA-N	236.315	1.267	10	20	BDCD	
CC(C)(CCO)NCc1ccc2c(c1)CCO2	135225137	QLYSUBPJCBWUTM-UHFFFAOYSA-N	235.327	1.872	10	20	BDCD	
CC[C@H](NCc1cc(C)ccc1O)C(=O)O	84853877	HXZJEEUEBQTPGW-JTQLQIEISA-N	223.272	1.653	10	20	BDCD	
C[C@H](NC[C@@H](C)O)c1cc([N+](=O)[O-])ccc1O	273427511	UPVQRPWTOYJBDI-SFYZADRCSA-N	240.259	1.332	10	20	BDCD	
CC(=O)C(=O)CN(C#N)c1cccc(Cl)c1	808035131	QDLFYEBPHWUHKX-UHFFFAOYSA-N	236.658	1.786	10	20	BDCD	
C[C@@H](O)CNCc1ccc(N2CC=CC2)cc1	819097071	WUZOAJWZDSCTBO-GFCCVEGCSA-N	232.327	1.533	10	20	BDCD	
COc1cccc(O)c1CN(C)Cc1cnc[nH]1	826769658	QMLVYICCWAIGLN-UHFFFAOYSA-N	247.298	1.756	10	20	BDCD	
C[C@@H](O)C[C@@H](C)CNC(=O)c1cc(O)cs1	748375759	NDEAFWMGCPLENE-HTQZYQBOSA-N	243.328	1.591	10	20	BDCD	
CC1(O)CN(Cc2c(O)cccc2Cl)C1	877581212	QXANQYSDPMPFQP-UHFFFAOYSA-N	227.691	1.612	10	20	BDCD	
COC(=O)[C@H]1CCCCN1Cc1ccc(N)cc1	1120262729	BZJIVXUBCDGOCK-CYBMUJFWSA-N	248.326	1.796	10	20	BDCD	
CC(=O)c1cn(Cc2ccc(N(C)C)cc2)nn1	881271057	FXSXSEPLJUEKHM-UHFFFAOYSA-N	244.298	1.595	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOc2ccccc2C1	409433711	YZUPLOGWZMCGLU-UHFFFAOYSA-N	232.243	1.718	10	20	BDCD	
[N-]=[N+]=NCCN1CCc2cc(CO)ccc21	409426387	CFBVKQKLTQLRNO-UHFFFAOYSA-N	218.260	1.852	10	20	BDCD	
CCN[C@@H](C)C(=O)NCc1ccccc1O	707923361	XUXRTKLJTVARJP-VIFPVBQESA-N	222.288	1.006	10	20	BDCD	
CCc1nc(CNCc2cc(C)ccc2O)n[nH]1	296156982	WHNIHVBFBHVFHN-UHFFFAOYSA-N	246.314	1.671	10	20	BDCD	
C[C@@H]1C[C@@H](NC(=O)c2cccc(O)c2O)CO1	401487453	XZWHEORVCJOKKG-HTQZYQBOSA-N	237.255	1.005	10	20	BDCD	
Cn1ccc(CN[C@H]2CCc3cccc(O)c32)n1	386205795	MAQMUVNSAVDRFD-LBPRGKRZSA-N	243.310	1.903	10	20	BDCD	
C[C@H](C(=O)Nc1ccc(N)cc1)N(C)C	22220136	TWRGTZBGTDEYEI-MRVPVSSYSA-N	207.277	1.157	10	20	BDCD	
COC(=O)[C@H](C)NCc1ccc(OC)c(C)c1	37303235	HLUVMJCAXNHOBY-JTQLQIEISA-N	237.299	1.655	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@H]1CCOC1	87784409	NTBIMHREWYAGHS-JTQLQIEISA-N	227.691	1.924	10	20	BDCD	
CSC[C@@H](C)C(=O)NCc1ccc(N)cc1	297243544	PYZQERZYTUTDDZ-SECBINFHSA-N	238.356	1.884	10	20	BDCD	
C[C@@H]1C[C@@H](CO)CN(Cc2ccccc2O)C1	817412732	ONBBIHFUUTWYID-VXGBXAGGSA-N	235.327	1.843	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1C[C@@]12CCNC2	828015573	JCKLQKFNEFOWKB-BXUZGUMPSA-N	246.310	1.008	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@@H]2[C@H](C1)C2(F)F	846665106	RNWSWKPBGJLIFT-KNVOCYPGSA-N	245.250	1.791	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1=COCC1	769282715	PPJYRXNBYKKTMO-UHFFFAOYSA-N	233.267	1.655	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](O)C2)c(O)c1	876561253	PEGNFHSLERUCNX-LLVKDONJSA-N	207.273	1.267	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](C)N[C@H](C)C2)c1	70075568	CUGTXCUNGVNVJU-TXEJJXNPSA-N	234.343	1.883	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](O)C2CC2)c1	71300243	JJYLVQHACNFNEI-ZDUSSCGKSA-N	237.299	1.261	10	20	BDCD	
C[C@H](O)CN[C@H](C)c1c(O)cccc1F	886487783	VDUUPKHKFHSWFY-JGVFFNPUSA-N	213.252	1.563	10	20	BDCD	
COc1ccc(CNC2CCNCC2)cc1C	84529857	QRUIGOGKIRKQOJ-UHFFFAOYSA-N	234.343	1.845	10	20	BDCD	
C[C@H]1CN(C(=O)NCc2ccc(N)cc2)CCO1	1262603692	RUDQMFGRERLHTD-JTQLQIEISA-N	249.314	1.199	10	20	BDCD	
Nc1ccc(CNC[C@H](N)C2CC2)cc1	1262487993	MOBCVKWFKYKPCY-LBPRGKRZSA-N	205.305	1.096	10	20	BDCD	
O=C(O)C1CN(Cc2cccc(F)c2O)C1	1601848159	VNQMJMMTIYNPQA-UHFFFAOYSA-N	225.219	1.048	10	20	BDCD	
Nc1cccc(C(=O)O)c1NC1CCC1	164086058	OTAHVCNKSKUXPT-UHFFFAOYSA-N	206.245	1.931	10	20	BDCD	
CN1CC[C@@H](C(=O)Nc2ccc(N)cc2)CC1=O	160413889	KIJNXDZDWABEKY-SECBINFHSA-N	247.298	1.076	10	20	BDCD	
Cc1cccc(CN[C@H]2CCNC2(C)C)c1O	841087256	SJGHCBFQEVFPGO-LBPRGKRZSA-N	234.343	1.931	10	20	BDCD	
Oc1cccc(Cl)c1CN1CC[C@@H](O)C1	128086932	GZXNRAUIGUCETK-MRVPVSSYSA-N	227.691	1.612	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)Cn1cccn1	193945364	AEKZLKOCAFRJMR-UHFFFAOYSA-N	245.282	1.247	10	20	BDCD	
CCCC[C@@H](CN)NCc1ccc(N)cc1	1352790089	OJPUTUXKBCYLOT-ZDUSSCGKSA-N	221.348	1.876	10	20	BDCD	
CC[C@H](N[C@H](C)CC(N)=O)c1ccccc1O	136101011	XFJLXWAYNKYDFC-KOLCDFICSA-N	236.315	1.697	10	20	BDCD	
C[C@@H](NC[C@@H](N)C1CC1)c1cc(F)ccc1O	817965965	XSUNLGJHIFGGPC-PRHODGIISA-N	238.306	1.919	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@H]1CCCNC1)CC2	817941955	USIHIAPPXGQHCV-RYUDHWBXSA-N	232.327	1.721	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)N1CCCC1	749022256	OSGASKINEZDXRR-UHFFFAOYSA-N	236.271	1.403	10	20	BDCD	
CCC[C@](C)(O)CNC(=O)c1cc(O)cs1	748323029	UOYPRDZTACGMML-NSHDSACASA-N	243.328	1.735	10	20	BDCD	
N[C@H]1C[C@H](CN[C@H]2CCc3cccc(O)c32)C1	873256260	NJAQSOLUJJUPBW-DLOVCJGASA-N	232.327	1.706	10	20	BDCD	
Oc1c(Cl)cccc1CNC[C@H](O)C1CC1	165163956	FNWQPGVTVMBCCT-NSHDSACASA-N	241.718	1.906	10	20	BDCD	
COc1ccc(CNC(=O)CC2CC2)c(O)c1	794376888	LBVWDZQFIWMYGG-UHFFFAOYSA-N	235.283	1.817	10	20	BDCD	
CC[C@](C)(O)CNCc1ccc(C)cc1O	876915368	QIZBPBHQUBRDSE-ZDUSSCGKSA-N	223.316	1.951	10	20	BDCD	
C[C@@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)CO1	402046785	NPQYFUKFVYJNDL-LDYMZIIASA-N	235.287	1.568	10	20	BDCD	
C[C@@H](O)C1(NCc2ccccc2O)CC1	827580544	UMBCZLKRPCNWKJ-SECBINFHSA-N	207.273	1.395	10	20	BDCD	
C[C@@H](NC(=O)CC(C)(C)N)c1ccccc1O	870988042	DWZMCIIEZVDCSF-SECBINFHSA-N	236.315	1.697	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)CCO1	179897348	WCYFXCKNUQWBBP-SECBINFHSA-N	225.263	1.752	10	20	BDCD	
COc1ccccc1NC[C@@H](O)Cn1cccn1	37874598	BGBIVOROSIMLKS-LLVKDONJSA-N	247.298	1.365	10	20	BDCD	
C[C@H](NCC(=O)O)c1ccc(N(C)C)cc1	37250881	DWHOFBRLIWORNE-VIFPVBQESA-N	222.288	1.488	10	20	BDCD	
CN(CCCCCO)Cc1ccccc1O	173359144	NQTGYNYMZFBXSB-UHFFFAOYSA-N	223.316	1.987	10	20	BDCD	
CNC(=O)NC(=O)CCSc1nccs1	48876225	BXMMRLSJFURXMX-UHFFFAOYSA-N	245.329	1.081	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)CF)c1	290279746	YYWRAWUWYAAKBK-QMMMGPOBSA-N	213.252	1.848	10	20	BDCD	
CNC(=O)CNCc1cc(Cl)c(F)cc1O	294214456	LMGZCXRXMNBAKL-UHFFFAOYSA-N	246.669	1.020	10	20	BDCD	
COc1ccc(N(C)C[C@@H]2CCC(=O)O2)cc1	852209830	TXGPJMWKWVOLHB-LBPRGKRZSA-N	235.283	1.837	10	20	BDCD	
N[C@@H](CNCc1cc(Cl)ccc1O)C1CC1	841048158	CGZUBNBRFSCLSK-NSHDSACASA-N	240.734	1.873	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@@H]1CCOC[C@H]1O)CC2	872139329	BSQITMFZXUSZIA-NTZNESFSSA-N	249.310	1.119	10	20	BDCD	
CN(C(=O)C(C)(C)CN)c1ccc(N)cc1	877079166	SYVDDGUOQMTSKM-UHFFFAOYSA-N	221.304	1.217	10	20	BDCD	
CN(C(=O)[C@@H]1CCC[C@@H]1N)c1ccc(N)cc1	877074955	WCZICOJIJJJSLH-NEPJUHHUSA-N	233.315	1.359	10	20	BDCD	
C[C@H]1C[C@H](N)CCN1Cc1ccc(N)cc1	1120268396	DHIPQJVDIYXVOU-GXFFZTMASA-N	219.332	1.580	10	20	BDCD	
CO[C@H](C)COC(=O)c1cc(O)cs1	782333831	AYIYBTJEAHRWNC-ZCFIWIBFSA-N	216.258	1.645	10	20	BDCD	
Oc1ccccc1CNCCOCCF	702633919	XCYYPPPZJORFTN-UHFFFAOYSA-N	213.252	1.468	10	20	BDCD	
C[C@H]1[C@H](C)CCN1C(=O)c1cccc(O)c1O	193127124	XUBKEMNLZXOFHM-BDAKNGLRSA-N	235.283	1.968	10	20	BDCD	
CN(CC1CCNCC1)c1ccc2c(c1)OCO2	214061553	KQAPWTVEFQGLBM-UHFFFAOYSA-N	248.326	1.851	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCCCO1	155440634	FNSYKGKTPRAZKL-CYBMUJFWSA-N	249.310	1.920	10	20	BDCD	
CCC(N)(CC)CNC(=O)Cc1ccc(N)cc1	262614251	FIOBAFSILPNZBJ-UHFFFAOYSA-N	249.358	1.445	10	20	BDCD	
CCNC(=O)COc1ccc(N2CCCC2)cc1	178193941	OGAIVBNZDHWHQS-UHFFFAOYSA-N	248.326	1.802	10	20	BDCD	
O=C(O)c1cc(Sc2nccs2)ncn1	306465606	JWGNFURBENODED-UHFFFAOYSA-N	239.281	1.783	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCCOC2)c1	71012513	DBHNPCUBFZHHNG-LBPRGKRZSA-N	221.300	1.969	10	20	BDCD	
C[C@@H](NCCC(N)=O)c1ccc(N(C)C)cc1	37262017	SBFSPDWCYNKDPB-SNVBAGLBSA-N	235.331	1.279	10	20	BDCD	
CC[C@H](NC[C@@H](C)O)c1ccc(F)cc1O	285842140	XKYSEVOQHSJKLN-KCJUWKMLSA-N	227.279	1.953	10	20	BDCD	
COc1cccc(CN(C)CCC(=O)O)c1O	86774872	YSEURTYYFFZADG-UHFFFAOYSA-N	239.271	1.307	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)N2CCC(=O)C2)o1	1537962894	IATZBKNBWDNXMT-UHFFFAOYSA-N	234.215	1.505	10	20	BDCD	
CCOc1ccc(O)c(CN[C@H](C)COC)c1	236869164	NKGVZHOBQFZQLF-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
Oc1ccccc1CN1CC([C@H]2CCOC2)C1	368443630	UWLFLPNGCKLHQO-LBPRGKRZSA-N	233.311	1.861	10	20	BDCD	
Cc1cccc(CN2CC(C)(O)C2)c1O	877581230	RPRKGJZYPCTSCX-UHFFFAOYSA-N	207.273	1.267	10	20	BDCD	
CC1(O)CN(Cc2cccc(Cl)c2O)C1	877580832	IOKAEPXJJOUXGG-UHFFFAOYSA-N	227.691	1.612	10	20	BDCD	
C/C(=C\C(=O)O)CN(C)Cc1ccccc1O	1602955220	MZMBGHVZPPAJSI-JXMROGBWSA-N	235.283	1.855	10	20	BDCD	
C[C@H](NCCNC(=O)C1CC1)c1ccccc1O	167431496	NVBZARJTRSCYCU-JTQLQIEISA-N	248.326	1.569	10	20	BDCD	
Cc1ccc(CNC[C@H]2C[C@H](O)C2)c(O)c1	877810911	APYJSDMRSMILNK-UMSPYCQHSA-N	221.300	1.561	10	20	BDCD	
O=C(Nc1ccc(F)cn1)c1cccc(O)c1O	126456723	GWPSUNJFWXDOAF-UHFFFAOYSA-N	248.213	1.884	10	20	BDCD	
CC(C)[C@@H](O)CNCc1ccc2c(c1)CCO2	134696785	HNGBQJZUXFBWFI-ZDUSSCGKSA-N	235.327	1.728	10	20	BDCD	
Cc1cccc(CNC2CC(N)C2)c1O	906509558	JFPYPOSWKUFDIP-UHFFFAOYSA-N	206.289	1.280	10	20	BDCD	
CO[C@@H](C)CCNC(=O)c1cc(O)cs1	732282019	HHWMZLNBMQCHGF-ZETCQYMHSA-N	229.301	1.609	10	20	BDCD	
C[C@@H](CCCN)NC(=O)Cc1ccc(N)cc1	834812998	BEOONRPPKKSLIP-JTQLQIEISA-N	235.331	1.055	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)CC(N)=O	749128611	JPOBPUJIKUPGNV-LLVKDONJSA-N	249.358	1.415	10	20	BDCD	
Cc1cccc(CN2CC[C@@H]([C@H](C)N)C2)c1O	843056954	DEEFFOSCOIUEPO-NWDGAFQWSA-N	234.343	1.870	10	20	BDCD	
C[C@H](O)C[C@H](C)NC(=O)c1cc(O)cs1	753469069	YQBULPKECJMYHW-BQBZGAKWSA-N	229.301	1.343	10	20	BDCD	
COc1ccc(O)c(CN(C)C2CC(O)C2)c1	761222195	IUSDZLWIHYGCAO-UHFFFAOYSA-N	237.299	1.356	10	20	BDCD	
OC1CC(CCNCc2ccc3c(c2)CCO3)C1	702436891	MFRBWZOBOFPEMC-UHFFFAOYSA-N	247.338	1.872	10	20	BDCD	
CC(C)c1ccc(O)c(CN[C@H]2[C@@H]3CNC[C@@H]32)c1	1575858175	AXMCJQXCHMNKTN-NHAGDIPZSA-N	246.354	1.823	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCN1	384828333	YZMSMCNIHXIMKU-CYBMUJFWSA-N	247.342	1.073	10	20	BDCD	
O=Cc1c(Br)ccc(O)c1O	332557	PCSTWUHSLBALGP-UHFFFAOYSA-N	217.018	1.673	10	20	BDCD	
Nc1ccc(N2CCN(C3CCC3)CC2)cc1	115107379	KBFWMFUNFCMWND-UHFFFAOYSA-N	231.343	1.943	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H](O)C2)c1	127995182	UOJFEJXYMIPTGK-LBPRGKRZSA-N	221.300	1.657	10	20	BDCD	
CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CN	76635882	XIHKEHKJTOBQPH-UHFFFAOYSA-N	249.358	1.448	10	20	BDCD	
CCOc1cccc(CN[C@@H](C)C(=O)O)c1O	49353446	IIEIBOBKOVBFON-QMMMGPOBSA-N	239.271	1.354	10	20	BDCD	
C[C@H]1CCNCC[C@@H]1NCCc1ccc(N)cc1	817958214	SZESUKHNLPPXMO-WFASDCNBSA-N	247.386	1.789	10	20	BDCD	
NC1(CNCc2cc(F)ccc2O)CCC1	841049243	PNINAMWAINBNMM-UHFFFAOYSA-N	224.279	1.502	10	20	BDCD	
CC(C)(CO)C(=O)NCc1ccccc1O	847588594	AMMYFBYYSHHTBM-UHFFFAOYSA-N	223.272	1.027	10	20	BDCD	
NC[C@H](NCc1ccccc1O)C1CCCC1	841088256	UHMMPZIRZCSWMY-ZDUSSCGKSA-N	234.343	1.999	10	20	BDCD	
COC[C@H]1CN(CCN=[N+]=[N-])CC1(C)C	409436069	XXCSVIBSQGJWLX-SECBINFHSA-N	212.297	1.901	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H](CO)[C@@H](C(F)(F)F)C1	409426696	CUNXOWDRISEPJD-BQBZGAKWSA-N	238.213	1.399	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1CCOC1=O	895808659	LUPQKRPPVJOPDA-JTQLQIEISA-N	221.256	1.106	10	20	BDCD	
COc1ccc(N(C)CC(=O)N(C)C)cc1	844355117	LGBGBVMKLKPXLY-UHFFFAOYSA-N	222.288	1.220	10	20	BDCD	
CCOc1cccc(CNC2(C)COC2)c1O	877691221	LHPIQRVDRNKNBW-UHFFFAOYSA-N	237.299	1.669	10	20	BDCD	
O=C1NCCC[C@H]1CNCc1ccccc1O	839196652	WRUOOWZWTLRZAW-NSHDSACASA-N	234.299	1.008	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1CCOC1	877112699	TXIZFJGHWFZKQK-JTQLQIEISA-N	207.273	1.579	10	20	BDCD	
CN(C)c1ccc(CN(C)[C@H]2[C@@H]3CNC[C@@H]32)cc1	1578425589	HAMGXSMPIYAUFH-FICVDOATSA-N	245.370	1.402	10	20	BDCD	
CCOc1cccc(CN(C)C[C@H](C)N)c1O	310327574	ZGYUFLQMXBNJLQ-JTQLQIEISA-N	238.331	1.570	10	20	BDCD	
O=C(O)c1cnc(Sc2cnccn2)s1	307320020	OGLMMQSGMVGSAG-UHFFFAOYSA-N	239.281	1.783	10	20	BDCD	
CNC[C@@H]1CCN(Cc2cc(F)ccc2O)C1	219964081	VKKMXWZKILFJTH-JTQLQIEISA-N	238.306	1.573	10	20	BDCD	
c1cc2c(cc1CN[C@H]1CCOC1)CCO2	87416065	GSXJJJVEYWLXIA-LBPRGKRZSA-N	219.284	1.500	10	20	BDCD	
C[C@@H]1CCN(Cc2cc(F)ccc2O)[C@H]1CO	249039819	CYVDFJJFHIDGLN-SKDRFNHKSA-N	239.290	1.734	10	20	BDCD	
OC[C@H]1C=C[C@@H](N[C@@H]2CCc3cccc(O)c32)C1	296979810	RWZFEWREFMRIKD-CYZMBNFOSA-N	245.322	1.906	10	20	BDCD	
OC/C=C\CNCc1cc(Cl)ccc1O	717533689	NCCHUPFQBWXBDT-UPHRSURJSA-N	227.691	1.684	10	20	BDCD	
CNC[C@@H](C)N[C@@H](C)c1ccc(F)cc1O	854231097	DTCFXQOFXRBPGM-BDAKNGLRSA-N	226.295	1.790	10	20	BDCD	
COCOCCCNC(=O)c1cc(O)cs1	854762982	RGITTZHPOLCIDR-UHFFFAOYSA-N	245.300	1.194	10	20	BDCD	
Cc1ccc(C(=O)NCc2ccon2)c(O)c1O	770503419	QWBXISPKTGRPDX-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
CC(C)C[C@H](N)C(=O)Nc1ccc(N)cc1	167056967	UTEQTJKBUJFORV-NSHDSACASA-N	221.304	1.581	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)Cc2ccsc2)C1	409422387	DKLQBEAGUGKURV-UHFFFAOYSA-N	222.273	1.812	10	20	BDCD	
Nc1ccc(CNC(=O)c2n[nH]cc2F)cc1	1580445390	BFOBHNAGCARYRM-UHFFFAOYSA-N	234.234	1.061	10	20	BDCD	
COc1cccc(CNC(=O)c2ccc[nH]2)c1O	155514760	ZBTIHXMKUFIIOT-UHFFFAOYSA-N	246.266	1.659	10	20	BDCD	
CCOc1ccc(N(C)CC(=O)OC)cc1	157313690	SIPZQMDOZLZSRU-UHFFFAOYSA-N	223.272	1.695	10	20	BDCD	
C[C@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCN1	400714373	FHLTUKRMAUATTN-WFASDCNBSA-N	247.386	1.983	10	20	BDCD	
COC(=O)N1CCN(Cc2ccc(N)cc2)CC1	387156754	BWPQKCRHVQKJKS-UHFFFAOYSA-N	249.314	1.153	10	20	BDCD	
N[C@@H](CO)c1cc(Br)ccc1O	72198711	PVTGUMYIFWPGRK-ZETCQYMHSA-N	232.077	1.147	10	20	BDCD	
C[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@@H]1O	230209996	ZISBYCKXKBSNHG-MFKMUULPSA-N	248.326	1.041	10	20	BDCD	
Cc1cc(O)c(CN2CCC(O)CC2)cc1C	302961122	LWFOPKOGLKFJNO-UHFFFAOYSA-N	235.327	1.966	10	20	BDCD	
C[C@H](CO)CN[C@@H]1CCc2cccc(O)c21	295782689	AZVWVETYNIOKNZ-GXSJLCMTSA-N	221.300	1.598	10	20	BDCD	
C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1CC1	274942546	PUXLNCCIDUTKBK-SECBINFHSA-N	249.310	1.945	10	20	BDCD	
CN(C)c1ccc(Cn2cnc([N+](=O)[O-])c2)cc1	299243843	YDRJDIRNDFOJEW-UHFFFAOYSA-N	246.270	1.906	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC/C=C/CO)c1	717532694	OPYSXNVWTCHTFU-UFFNRZRYSA-N	221.300	1.900	10	20	BDCD	
CCc1cccc(CNC/C=C\CO)c1O	717438265	PAONYJUYNCXZHB-ARJAWSKDSA-N	221.300	1.593	10	20	BDCD	
C[C@@H](NC(=O)C(F)F)c1ccccc1O	827917975	RWOFLWRFCMAOQQ-ZCFIWIBFSA-N	215.199	1.835	10	20	BDCD	
CCOc1ccc(O)c(CN[C@H]2C[C@H](N)C2)c1	906508598	RJXTZKXJTUOEGJ-XYPYZODXSA-N	236.315	1.370	10	20	BDCD	
C[C@@H](C[C@@H](C)O)NC(=O)c1cc(O)cs1	753469070	YQBULPKECJMYHW-NKWVEPMBSA-N	229.301	1.343	10	20	BDCD	
CN(Cc1cc2c(cc1O)OC[C@@H]2O)C1CC1	768439915	ACURHDAIXZJSGT-LBPRGKRZSA-N	235.283	1.412	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H]1CC[C@H](O)C1	187985546	OAXBFHIXOVXFMX-SKDRFNHKSA-N	239.290	1.782	10	20	BDCD	
CN1C[C@H]2CN(Cc3ccccc3O)C[C@H]2C1	194538508	YARKCWYBJDVRHV-BETUJISGSA-N	232.327	1.386	10	20	BDCD	
COc1cccc(O)c1CNCC[C@H](C)OC	726607383	OGAIDQAXGXSQCI-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
COc1cc(C)c(CNC/C=C/CN)c(O)c1	1579144347	APLLDYVUOQJJGQ-ONEGZZNKSA-N	236.315	1.314	10	20	BDCD	
Nc1ccc(NC(=O)c2ccc(O)cn2)cc1	1580449897	XEHZSQFVZRAAEN-UHFFFAOYSA-N	229.239	1.622	10	20	BDCD	
C[C@@H](NC[C@@H]1CCCNC1=O)c1ccccc1O	838916121	DVFBHNBAXFUJPT-MNOVXSKESA-N	248.326	1.569	10	20	BDCD	
C[C@@H]1C[C@@H](C(=O)N(C)Cc2ccccc2O)CO1	383727406	LKIAHTADMCSODS-ZYHUDNBSSA-N	249.310	1.776	10	20	BDCD	
Cc1nnc(CN[C@@H](C)c2ccccc2O)n1C	393251252	BYLPPBDDWDLKOW-VIFPVBQESA-N	246.314	1.680	10	20	BDCD	
OC[C@H]1CCN(Cc2cc(F)ccc2O)C1	180026194	HKOQCUSWJFARRP-VIFPVBQESA-N	225.263	1.346	10	20	BDCD	
COc1cc(Cl)cc(CNCCO)c1O	76274284	RUVWXHNTJBTLGS-UHFFFAOYSA-N	231.679	1.136	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCCCCO)c1	193283069	SZQMSUMCFHQXHY-SNVBAGLBSA-N	239.315	1.824	10	20	BDCD	
COC(=O)C(=O)CCCSc1nccs1	285109995	JTVSYUILYRYETP-UHFFFAOYSA-N	245.325	1.758	10	20	BDCD	
CC[C@H](NC1CNC1)c1ccc(N(C)C)cc1	817955007	OFRQFHMXEYEABT-AWEZNQCLSA-N	233.359	1.765	10	20	BDCD	
C[C@H](NC[C@H](N)C1CC1)c1ccccc1O	817964727	GJAJFKWPQPJNHI-CABZTGNLSA-N	220.316	1.780	10	20	BDCD	
CC(C)(N)CCNCc1cc(F)ccc1O	903938941	QRHKIFKIWPZMRC-UHFFFAOYSA-N	226.295	1.748	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CCOC1	588408559	BYHKQNLRRVMKAS-GQPNGRKGSA-N	249.266	1.016	10	20	BDCD	
CC(C)(C)[C@@H](N)CC(=O)Nc1ccc(N)cc1	911659547	BTMYXQINZYNVBV-NSHDSACASA-N	235.331	1.971	10	20	BDCD	
CCNCCNCc1cc(OCC)ccc1O	841035707	JOLMIHLBDGYBLJ-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](C)C(=O)O)c1	848638412	SHJXELDRBJBTHJ-SECBINFHSA-N	223.272	1.511	10	20	BDCD	
CN[C@@H]1CCN(Cc2cccc(C)c2O)C1	843045467	SHSZDWHBORMNLE-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
Nc1ccc(CC(=O)N2CC[C@H]3C[C@@H]3C2)cc1	699143442	CAEQMBTXMMUKPR-NWDGAFQWSA-N	230.311	1.680	10	20	BDCD	
CC(=O)C1=NN(c2ccccc2C)C(=O)C1	871940448	JHVGMRRFXHDACX-UHFFFAOYSA-N	216.240	1.677	10	20	BDCD	
COC[C@@H](C)OC(=O)c1cccc(O)c1O	784787882	NKHIADXOGDOXDH-SSDOTTSWSA-N	226.228	1.290	10	20	BDCD	
CC(C)N(CCO)Cc1cc(F)cc(F)c1O	893892676	BGQGOAWBTMPABK-UHFFFAOYSA-N	245.269	1.873	10	20	BDCD	
COC[C@H](C)N(C)Cc1ccccc1O	72629625	IBVFMJLFYQFRMG-JTQLQIEISA-N	209.289	1.859	10	20	BDCD	
Cc1ccc(O)c(CN2CCC(C(N)=O)CC2)c1	158631836	CJXHIWZHAIJNLV-UHFFFAOYSA-N	248.326	1.398	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1ccoc1	158871073	GXXLUHXNQKZMME-UHFFFAOYSA-N	233.223	1.621	10	20	BDCD	
CCO[C@H](C)C(=O)NCCc1ccc(N)cc1	152570518	ICYOVDXCPSHWIK-SNVBAGLBSA-N	236.315	1.353	10	20	BDCD	
OCCCNCc1cccc(Cl)c1O	157754787	IIGDEHYRAZBXSB-UHFFFAOYSA-N	215.680	1.518	10	20	BDCD	
CC(C)C[C@H](CN)NCc1ccccc1O	841037602	BBKKJXNLUBQRAL-GFCCVEGCSA-N	222.332	1.855	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](CO)C1CC1	883002226	AAMVEKBAUOWGQG-NSHDSACASA-N	237.299	1.261	10	20	BDCD	
COc1ccc(CNCc2ocnc2C)c(O)c1	894639956	WTIPZXMJWTYVHY-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2COC[C@H]2C)c1	710878283	XIEARKWQNSFWOL-BXKDBHETSA-N	237.299	1.525	10	20	BDCD	
C[C@@H]1NCCN(Cc2ccccc2O)[C@H]1C	379445588	WWYVHIASCSBOMC-QWRGUYRKSA-N	220.316	1.574	10	20	BDCD	
OC[C@@H]1CCCN1Cc1cc(F)ccc1O	179981287	XBIMAHYLASNODZ-NSHDSACASA-N	225.263	1.488	10	20	BDCD	
COC(=O)[C@@H]1CCCN1Cc1cccc(C)c1O	179661008	HFYCYAGMWGRWNV-LBPRGKRZSA-N	249.310	1.838	10	20	BDCD	
CCNC(=O)[C@@H](C)N[C@@H](C)c1ccccc1O	36795283	XTLQJXHIAIUBPV-VHSXEESVSA-N	236.315	1.567	10	20	BDCD	
Cc1cccc(CNCC(F)(F)CO)c1O	185661192	PIUWNMGSVITDBI-UHFFFAOYSA-N	231.242	1.418	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@@H]1CCNC1	89745338	UORUVHUZOOQPMK-NSHDSACASA-N	248.326	1.350	10	20	BDCD	
C[C@@H](CF)NCc1cccc(F)c1O	290254440	VZSROHQUXYXCQN-ZETCQYMHSA-N	201.216	1.979	10	20	BDCD	
C[C@H](NC[C@@H](C)CO)c1ccc(F)cc1O	83218836	KEVIVFIWRQBOCL-BDAKNGLRSA-N	227.279	1.810	10	20	BDCD	
Cc1cc(O)c(CN2CCC[C@@H]2CO)cc1C	92470831	FXJMCFLFQDTULY-CYBMUJFWSA-N	235.327	1.966	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H](C)CN)c(O)c1	817966297	KXZSUOZHJSOMTJ-ZJUUUORDSA-N	208.305	1.698	10	20	BDCD	
CCCNCCNCc1cc(OC)ccc1O	841046335	AEYCMLZWPHBXSM-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
CCCN(CC[N+](=O)[O-])Cc1ccccc1O	929753905	YELFPEVBKZHRIZ-UHFFFAOYSA-N	238.287	1.881	10	20	BDCD	
Cc1cccc(O)c1CN(C)CC1CC(O)C1	877463419	CRIMERIXIXAFMD-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
C[C@@H](O)C[C@@H](C)NCc1ccccc1O	164460816	HSAHIEWZJYYFIA-NXEZZACHSA-N	209.289	1.641	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1COCO1	894880141	AMLUXJWMAPNOMV-JTQLQIEISA-N	223.272	1.163	10	20	BDCD	
COc1ccc(O)c(CNCc2ccn(C)n2)c1	96585158	YADSRTZPZKFZBE-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)CSc2ccncc2)C1	409422403	DQMFYVCWACXXCY-UHFFFAOYSA-N	249.299	1.695	10	20	BDCD	
Cn1ncnc1CNCc1ccc2c(c1)CCO2	80531303	QELOMLAUNDGFAH-UHFFFAOYSA-N	244.298	1.040	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H]2C[C@H](O)C2)c1	850579201	SSBAMZHCRLBOTD-OPRDCNLKSA-N	237.299	1.575	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](CO)CC(F)F	894567508	RFCIFACKUACEMM-VIFPVBQESA-N	245.269	1.806	10	20	BDCD	
C[C@H](N[C@@H]1CCOC[C@H]1O)c1ccccc1O	706758076	UCYPRVWXPPAQMV-UFGOTCBOSA-N	237.299	1.193	10	20	BDCD	
CC(C)[C@H](C)NC(=O)Cc1ccc(N)cc1	20522396	FRIRJXKMBLBXFL-JTQLQIEISA-N	220.316	1.972	10	20	BDCD	
c1cc2c(cc1CNCCN1CCCC1)CCO2	37362795	NEJHEBRDCQBRRF-UHFFFAOYSA-N	246.354	1.807	10	20	BDCD	
COc1ccc(N(C)CC2OCCO2)cc1F	182455474	PGUQPAAPDSLYDC-UHFFFAOYSA-N	241.262	1.643	10	20	BDCD	
O=C(NCc1ccncc1)c1cccc(O)c1O	126238609	JXZDGXMJEGDCHD-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
CC[C@@H](N[C@@H](C)CO)c1ccccc1O	35602845	YWQZBLCLTGPWSI-GXSJLCMTSA-N	209.289	1.814	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCNC2)cc1	86725482	AOPUOEKIWQHKGX-LBPRGKRZSA-N	219.332	1.204	10	20	BDCD	
COc1ccc(CN[C@H](C)C(=O)O)cc1C	49357715	SHHRDAGTJAEWNC-SECBINFHSA-N	223.272	1.566	10	20	BDCD	
Cc1cc(O)c(CN2CCC[C@H](O)C2)cc1C	298575202	BIZGSSQISWBELX-ZDUSSCGKSA-N	235.327	1.966	10	20	BDCD	
CN(C)c1ccc(CNC/C=C\CO)cc1	717529656	AAMXLDYUOLOXET-ARJAWSKDSA-N	220.316	1.391	10	20	BDCD	
CCc1cccc(CN(C)C[C@@H](C)O)c1O	848902969	VWKULVCQGJIOBM-SNVBAGLBSA-N	223.316	1.767	10	20	BDCD	
CC(C)[C@H](O)Cc1cn(-c2ccc(N)cc2)nn1	849134964	YTFYCVTTWDYMQK-CYBMUJFWSA-N	246.314	1.409	10	20	BDCD	
CCC[C@H]1CNCCN1Cc1ccccc1O	843058423	SIKIRZROYMCOJK-ZDUSSCGKSA-N	234.343	1.966	10	20	BDCD	
C[C@@H](NC(=O)C1=COCCO1)c1ccccc1O	827918546	XSNZMFGGKLFHOA-SECBINFHSA-N	249.266	1.458	10	20	BDCD	
COc1ccc(N2N=C(C(C)=O)CC2=O)cc1	871947323	XHHRJBVPJFYZQR-UHFFFAOYSA-N	232.239	1.377	10	20	BDCD	
Cc1ccc(O)c(CNCc2cc[nH]n2)c1	70955290	YEXNBFYRFHEURT-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
C[C@@H](N[C@H]1CCOC1=O)c1ccc(N(C)C)cc1	774481030	HBPYPHCFSVIIGM-MFKMUULPSA-N	248.326	1.719	10	20	BDCD	
COCCOCCN(C)Cc1ccccc1O	79433199	BHZNDRYRPGITEH-UHFFFAOYSA-N	239.315	1.487	10	20	BDCD	
CC[S@](C)(=O)=NC(=O)c1cccc(O)c1O	395788107	ROXMUZKKBMHONQ-INIZCTEOSA-N	243.284	1.356	10	20	BDCD	
C[C@@H](OC(=O)c1cc(O)cs1)C(=O)C1CC1	798615825	MTDVGZFMPMDGKE-ZCFIWIBFSA-N	240.280	1.978	10	20	BDCD	
O=C(NCCCCCO)c1cc(O)cs1	791061896	LJFIVOTXTKJJFE-UHFFFAOYSA-N	229.301	1.346	10	20	BDCD	
Nc1ccc(CN2CCOC[C@]23CCOC3)cc1	1334774201	GKARWKBIRCUCFC-CQSZACIVSA-N	248.326	1.260	10	20	BDCD	
CCC(F)(F)C(=O)NCc1cccc(O)c1O	1347234986	SMZRHFUSXUKXTB-UHFFFAOYSA-N	245.225	1.759	10	20	BDCD	
Cc1cc(NC(=O)c2cc(O)cs2)n[nH]1	1518661632	PMIMYQMTVLRWGO-UHFFFAOYSA-N	223.257	1.738	10	20	BDCD	
C[C@@H](CC(=O)O)NC(=O)c1cc(O)cs1	1599833815	DFJZXCAHVWPAFQ-YFKPBYRVSA-N	229.257	1.047	10	20	BDCD	
CCOCCN(C)Cc1cc(F)ccc1O	181484428	FNCALKWGUUXUGF-UHFFFAOYSA-N	227.279	2.000	10	20	BDCD	
Cc1cccc(CN(C)CC(=O)N(C)C)c1O	124517413	HZENKSQVNCXNFF-UHFFFAOYSA-N	236.315	1.221	10	20	BDCD	
CN[C@@H]1CCN(Cc2cc(OC)ccc2O)C1	128864165	LMCWZHNCFKZXKL-LLVKDONJSA-N	236.315	1.195	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H]2CCNC2)c1	817944714	KCWUSYLFTCGDRP-ZJUUUORDSA-N	236.315	1.413	10	20	BDCD	
CC[C@@H](NCC1(N)CC1)c1ccccc1O	902408624	ZRSDXVQBWMIQRV-LLVKDONJSA-N	220.316	1.924	10	20	BDCD	
Oc1ccc(Cl)cc1CNC1CCNCC1	841026489	DVRUHKHDVGPCEW-UHFFFAOYSA-N	240.734	1.887	10	20	BDCD	
Nc1ccc(-n2cc(C3CCNCC3)nn2)cc1	849134779	OSMWTCWGEAPABR-UHFFFAOYSA-N	243.314	1.317	10	20	BDCD	
CCc1cccc(CN2CCC[C@@H](O)C2)c1O	848877097	PUKSHDAYTSSLCN-CYBMUJFWSA-N	235.327	1.911	10	20	BDCD	
Nc1ccc(CCNCC[C@H]2CCOC2)cc1	841038775	QCEWSSIJIFFJJW-ZDUSSCGKSA-N	234.343	1.828	10	20	BDCD	
CNC[C@H](C)NCc1c(O)cccc1Cl	853249546	RCLPBMGNDACWKH-QMMMGPOBSA-N	228.723	1.743	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC1(C)COC1	877691910	XIHUOBMYRRXZNB-UHFFFAOYSA-N	234.343	1.940	10	20	BDCD	
CC[C@H](CO)N(C)Cc1cc(F)cc(F)c1O	894870105	JCRPUDSHTKUBJY-SNVBAGLBSA-N	245.269	1.873	10	20	BDCD	
C[C@H](N[C@H](C)CO)c1ccc(F)c(F)c1O	187737974	IMSDUUJUUBYCHQ-RQJHMYQMSA-N	231.242	1.702	10	20	BDCD	
CC1(C(=O)NCc2cccc(O)c2O)CCC1	1520508629	HWGWQBDUTRGVBQ-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CC[C@@H](COC)NCc1c(O)cccc1OC	850151004	QECKFCAABPUUKO-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC1CCOCC1	708440419	ANRKKECCPAYOKS-UHFFFAOYSA-N	243.253	1.939	10	20	BDCD	
C[C@H](N[C@@H]1COCC[C@H]1O)c1ccccc1O	710863119	UAGPAMFQYRYTEK-UFGOTCBOSA-N	237.299	1.193	10	20	BDCD	
C[C@H](NCCCO)c1ccc(F)cc1O	62745300	GEUUHYINOYKGMH-QMMMGPOBSA-N	213.252	1.564	10	20	BDCD	
C[C@H]1C[C@H](C)N(C(=O)c2cccc(O)c2O)C1	126568016	FSAXBSXBFGIVAZ-IUCAKERBSA-N	235.283	1.968	10	20	BDCD	
OC[C@H]1CCN(Cc2c(O)cccc2Cl)C1	127231461	MKLXNWCWQYGZLM-VIFPVBQESA-N	241.718	1.860	10	20	BDCD	
CC(C)(C)[C@H](N)C(=O)NCc1ccccc1O	228420788	QMHGMWNZFBYIOX-LLVKDONJSA-N	236.315	1.382	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@@H](N)C1	91545527	AKGMIZGFTKWHHO-CMPLNLGQSA-N	248.326	1.478	10	20	BDCD	
CC(C)(C)c1cnc(SC[C@H](O)CO)s1	268369849	YNCVUFXXBWGHIF-SSDOTTSWSA-N	247.385	1.886	10	20	BDCD	
Cc1noc([C@@H](C)NCc2ccccc2O)n1	729684954	YTFPXCIDFURLQN-MRVPVSSYSA-N	233.271	1.934	10	20	BDCD	
Cc1ccc(O)c(CNC2CC(N)C2)c1	906510054	LWCRQDCHOVNAAK-UHFFFAOYSA-N	206.289	1.280	10	20	BDCD	
COc1cccc([C@@H](C)NCCN(C)C)c1O	846174788	YXYYVWRGRHSSDE-SNVBAGLBSA-N	238.331	1.613	10	20	BDCD	
COc1ccc(CNC(=O)CCCF)c(O)c1	846949363	HAPKYTYTOFYANM-UHFFFAOYSA-N	241.262	1.767	10	20	BDCD	
Cc1cccc(CN2C[C@@H](C)N[C@H](C)C2)c1O	843049755	VPZGBYUJKJGTEB-VXGBXAGGSA-N	234.343	1.883	10	20	BDCD	
C[C@@H](N)CN(C)Cc1cc(Cl)cc(F)c1O	863652949	ZXWVZMVVQYWXCI-SSDOTTSWSA-N	246.713	1.964	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1CSC1	866770581	ZGAZZNCPKIAAAD-UHFFFAOYSA-N	239.296	1.077	10	20	BDCD	
Cc1ccc(CN[C@@H]2C(=O)NCC[C@H]2C)c(O)c1	877499636	RNAYJPSLONIVJV-MFKMUULPSA-N	248.326	1.315	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)C(=O)O	1334766458	BXAVBKMIZIMXHU-SNVBAGLBSA-N	236.315	1.624	10	20	BDCD	
O=C(O)C(=O)CCCSc1nccs1	1601638045	OVJSMPWLVGGAPN-UHFFFAOYSA-N	231.298	1.669	10	20	BDCD	
CCC[C@@](C)(N)C(=O)NCc1ccccc1O	166202243	OASVFSFRYKMVLU-CYBMUJFWSA-N	236.315	1.526	10	20	BDCD	
Cc1nccn1CC(=O)NCc1ccccc1O	857472381	RZGGEVZBDZPTRE-UHFFFAOYSA-N	245.282	1.214	10	20	BDCD	
COC[C@H](CNCc1ccc(C)cc1O)OC	877188636	DBRNTNRTBHYXBO-LBPRGKRZSA-N	239.315	1.452	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2CC23CCC3)cc1	721180100	OCXIMXSLUHZQIU-LBPRGKRZSA-N	230.311	1.870	10	20	BDCD	
Oc1ccccc1CN1C[C@@H]2CCNC[C@@H]2C1	904421186	RSCAMUNXNWFTQM-WCQYABFASA-N	232.327	1.434	10	20	BDCD	
C[C@@H](NCCc1cnn[nH]1)c1ccccc1O	879649442	TZEUHTGUHZWYNL-SECBINFHSA-N	232.287	1.404	10	20	BDCD	
COc1ccc(N(C)C[C@H](C)N)c(OC)c1	74012010	NDLIIIHXAXVGKR-VIFPVBQESA-N	224.304	1.487	10	20	BDCD	
CC1CCN(C(=O)c2cccc(O)c2O)CC1	126189067	UWDFQTOVCSRNLP-UHFFFAOYSA-N	235.283	1.970	10	20	BDCD	
COC[C@H](O)CCN[C@@H](C)c1ccccc1O	183634036	KRTACYMXVCXYSE-WDEREUQCSA-N	239.315	1.440	10	20	BDCD	
COCC[C@H](C)NC(=O)Nc1ccc(N)cc1	81717723	JIDMIOKJBWLBBL-VIFPVBQESA-N	237.303	1.815	10	20	BDCD	
C[C@H](NC[C@@H](C)N)c1ccc(F)cc1O	817972237	KLTCAIXGKILTEB-SFYZADRCSA-N	212.268	1.529	10	20	BDCD	
Oc1cc(F)c(Cl)cc1CN[C@H]1C[C@H](O)C1	827832560	OTDPEJSTMNIOSP-ZKCHVHJHSA-N	245.681	1.798	10	20	BDCD	
O=C(NOCCC1CC1)c1cc(O)cs1	832845957	WQGUSEJWEJHLSY-UHFFFAOYSA-N	227.285	1.915	10	20	BDCD	
CC[C@H](COC(=O)c1cccc(O)c1O)OC	842090661	FDHFNWQTSFGINI-MRVPVSSYSA-N	240.255	1.680	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1C[C@@H]2C[C@H]2C1	862557482	XGCCGEZMUSAFOK-LOMYTOQZSA-N	245.278	1.589	10	20	BDCD	
Cc1ccc(CN2CCC3(C2)OCCO3)c(O)c1	876685044	WQBSAANLKAWQBT-UHFFFAOYSA-N	249.310	1.649	10	20	BDCD	
CN[C@H](C)CCNCc1ccc(N(C)C)cc1	1118019109	NMZUMGUHSIECGQ-GFCCVEGCSA-N	235.375	1.840	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@H]2CCC[C@]2(CO)C1	409426023	BUNABGWWLQANAR-NXEZZACHSA-N	210.281	1.391	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CC(C)(C)O	280430136	QAKNSVXLFOSVEQ-UHFFFAOYSA-N	237.299	1.512	10	20	BDCD	
CC1(C)[C@@H](O)C[C@H]1NCc1ccccc1O	163421273	KOGUUWCKIQKSKL-NEPJUHHUSA-N	221.300	1.641	10	20	BDCD	
C[C@@H](NCCN1CCNC1=O)c1ccccc1O	808744285	XTFNMHOKNMPYDE-SNVBAGLBSA-N	249.314	1.068	10	20	BDCD	
O=C(CCNCC1CC1)NCc1ccccc1O	717185301	ILIZQKRQQIXJDN-UHFFFAOYSA-N	248.326	1.398	10	20	BDCD	
CC[C@@H](O)CCNCc1cc(C)ccc1O	131722807	ZLQWZRKNXMUUNK-GFCCVEGCSA-N	223.316	1.951	10	20	BDCD	
CC(C)(CO)CNCc1ccc2c(c1)CCO2	124302149	ZHZHSZDOURGPLH-UHFFFAOYSA-N	235.327	1.730	10	20	BDCD	
C[C@@H](CCO)CNCc1ccc(N(C)C)cc1	97439050	FWEZDGHJGMEWJX-LBPRGKRZSA-N	236.359	1.861	10	20	BDCD	
C[C@@H](CO)N[C@@H]1CCc2cccc(O)c21	297126841	YTMGUYXZDVLFDU-WCBMZHEXSA-N	207.273	1.350	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H]([C@H](C)O)C2)c1	272531834	NDLUTXPRJBSOLX-RYUDHWBXSA-N	235.327	1.903	10	20	BDCD	
CCC(=O)N[C@@H](C)C(=O)Nc1ccc(N)cc1	818556358	OBDZTTNHYKRAMP-QMMMGPOBSA-N	235.287	1.122	10	20	BDCD	
NCC[C@H]1CCN(Cc2cccc(F)c2O)C1	904405449	JANPNSPCACDTTR-JTQLQIEISA-N	238.306	1.702	10	20	BDCD	
COc1cccc([C@H](C)N[C@@H](C)CO)c1O	846148193	OZECMJFTQYRFQV-IUCAKERBSA-N	225.288	1.432	10	20	BDCD	
C[C@@H]1C[C@@H](C(=O)N[C@H](C)c2ccccc2O)CO1	827946511	KONAMBMXTCCMEZ-GMTAPVOTSA-N	249.310	1.994	10	20	BDCD	
CC(C)[C@H](CCO)NC(=O)c1cc(O)cs1	756785228	BLTVZDRGSSAHPE-VIFPVBQESA-N	243.328	1.591	10	20	BDCD	
Cc1cccc(O)c1CN1CC(C(C)(C)O)C1	877580490	DQFKUXSQAFAZTB-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@@H](O)C1)c1ccccc1O	720934540	DDHSKTPLTPNWFL-MXWKQRLJSA-N	221.300	1.814	10	20	BDCD	
Nc1ccc(CC(=O)N2CC[C@H]3C[C@H]3C2)cc1	699143446	CAEQMBTXMMUKPR-RYUDHWBXSA-N	230.311	1.680	10	20	BDCD	
O=S1CCC(NCc2ccccc2O)CC1	164778945	BSBYZJLAVHQJQZ-UHFFFAOYSA-N	239.340	1.393	10	20	BDCD	
CCN(Cc1ccc(C)cc1O)[C@@H]1CCNC1=O	877499167	LZWBQOKAHWYDSC-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CC1(F)F	295355447	VTCZWDPWJPCASI-MRVPVSSYSA-N	227.210	1.664	10	20	BDCD	
CN(C(=O)Nc1ccc(N)cc1)[C@@H]1CCC[C@H]1O	709476476	MNVNKNZGKASCHJ-VXGBXAGGSA-N	249.314	1.646	10	20	BDCD	
CN1CC[C@H](N[C@H]2CCc3cccc(O)c32)C1	380211690	HYELYVPSKVIFFA-RYUDHWBXSA-N	232.327	1.673	10	20	BDCD	
COCCNC(=O)N(C)Cc1ccccc1O	42842946	PNLUSBYVHGZEDY-UHFFFAOYSA-N	238.287	1.180	10	20	BDCD	
Cc1ncsc1/C=C1\SC(=S)NC1=O	172814019	HIAOKXNWKUPVHU-KXFIGUGUSA-N	242.350	1.940	10	20	BDCD	
NC(=O)NCc1cccc(Br)c1O	306567676	IENUGNWCJFPDKY-UHFFFAOYSA-N	245.076	1.323	10	20	BDCD	
Cc1cccc(CN2CCC(C(N)=O)CC2)c1O	183467854	SRZJGMJYESXUGC-UHFFFAOYSA-N	248.326	1.398	10	20	BDCD	
COC[C@@H](O)CCN[C@H](C)c1ccccc1O	183634025	KRTACYMXVCXYSE-MNOVXSKESA-N	239.315	1.440	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@H](C)C(=O)O)c1	83406943	NGGHMMSWQDMYGA-SECBINFHSA-N	223.272	1.606	10	20	BDCD	
NC[C@H]1CCC[C@H]1C(=O)Nc1ccc(N)cc1	294813718	QPQHHBQQOZZOHM-BXKDBHETSA-N	233.315	1.582	10	20	BDCD	
CCN(CC(N)=O)Cc1ccc(C)cc1O	877469785	ZAMYBVQXGWVBDY-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCn2cccc2C1	928959762	WRSGQFHBOXQAOX-UHFFFAOYSA-N	248.307	1.911	10	20	BDCD	
Cc1cc(O)c(CN(C)C2CC(O)C2)cc1C	761220800	YKAURYZNFMYPAJ-UHFFFAOYSA-N	235.327	1.964	10	20	BDCD	
OCC[C@H]1CCCN(Cc2ccccc2O)C1	770511029	VXWAHOVNIZPNBU-GFCCVEGCSA-N	235.327	1.987	10	20	BDCD	
[N-]=[N+]=NCCN1CCN(C2CCOCC2)CC1	409429691	PFRBQGYPQIOVLU-UHFFFAOYSA-N	239.323	1.093	10	20	BDCD	
CCc1nnc(Sc2nccs2)n1N	1355252431	MCTIQWGLIJNMEO-UHFFFAOYSA-N	227.318	1.162	10	20	BDCD	
O=C(NCCC1CC1)c1cccc(O)c1O	163275399	DYCPOHCDKHXJSY-UHFFFAOYSA-N	221.256	1.628	10	20	BDCD	
C[C@H]1C(=O)CCCN1C(=O)c1cccc(O)c1O	885052248	PKICPKYSHSYIGL-QMMMGPOBSA-N	249.266	1.291	10	20	BDCD	
C[C@H]1COC[C@@H]1NCc1cc(F)cc(F)c1O	708534682	DDCHXPKUZGARAF-CPCISQLKSA-N	243.253	1.795	10	20	BDCD	
CO[C@@H]1COC[C@H]1N[C@@H]1CCc2cccc(O)c21	842912778	WEQDVSWZTPHSTD-NQBHXWOUSA-N	249.310	1.383	10	20	BDCD	
C[C@@H](Sc1ncc(Cl)s1)C(N)=O	849997962	IGAMFJMJNYOBSK-GSVOUGTGSA-N	222.722	1.762	10	20	BDCD	
CCN(C)C(=O)[C@H](C)NCc1ccc(N)cc1	1120371808	RCSJKRMMKFDDSO-JTQLQIEISA-N	235.331	1.225	10	20	BDCD	
C[C@@H]1C[C@@H]1C(=O)NCc1ccccc1O	136334793	SKJBFURHGSNPQI-SCZZXKLOSA-N	205.257	1.664	10	20	BDCD	
C[C@H](N[C@H](C)C(N)=O)c1ccc(N(C)C)cc1	37261360	BWNVFQBCNIUVPK-VHSXEESVSA-N	235.331	1.277	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCCOC1	134306089	VYDNFLRSNAUMNB-LLVKDONJSA-N	235.283	1.435	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C(F)F)c1	194775664	SPWSSEPBHPFAFM-UHFFFAOYSA-N	231.198	1.282	10	20	BDCD	
C[C@@]1(C(=O)Nc2ccc(N)cc2)CCCNC1	237517848	CDIRJCSLFYDWDD-CYBMUJFWSA-N	233.315	1.597	10	20	BDCD	
C[C@H]1NCC[C@H]1C(=O)N(C)Cc1ccccc1O	92954827	GJFCPOIWBQPTAI-ZYHUDNBSSA-N	248.326	1.349	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)Cn2cncn2)c1	733326306	VVPMJNUULLLUNW-LLVKDONJSA-N	246.314	1.470	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H](C)O	840928562	YSKLMEFJJHDYAH-NSHDSACASA-N	222.332	1.531	10	20	BDCD	
C[C@@]1(O)CCN(C(=O)c2cc(O)cs2)C1	748508028	KOPIZSFUANSILU-SNVBAGLBSA-N	227.285	1.051	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@H]2CC(=O)N(C)C2)c1	273564585	JCVRFFBKBLRGON-MNOVXSKESA-N	248.326	1.582	10	20	BDCD	
CNC(=O)C[C@H](C)NCc1ccc(N(C)C)cc1	299283228	DHAURQKSXVHDMI-NSHDSACASA-N	249.358	1.367	10	20	BDCD	
COc1ccc(N(C)C[C@H]2CCNC2)cc1	51890131	ANXUJOCRZIOSFQ-NSHDSACASA-N	220.316	1.741	10	20	BDCD	
CN(Cc1cnn(C)c1)c1ccc2c(c1)OCO2	121242624	BREXLRCPZLRLBO-UHFFFAOYSA-N	245.282	1.785	10	20	BDCD	
C[C@@H](O)C1CCN(c2ccc(N)cc2)CC1	235348881	TUYXPZJVVUMLKC-SNVBAGLBSA-N	220.316	1.866	10	20	BDCD	
COc1cc(O)c(CNCC(F)F)cc1OC	298104944	NSRTTZVLENYSHD-UHFFFAOYSA-N	247.241	1.764	10	20	BDCD	
COc1ccc(O)c(CN2CC3(CCOC3)C2)c1	293858982	BXLMKLOEEPBPNW-UHFFFAOYSA-N	249.310	1.623	10	20	BDCD	
CNCCN[C@@H](C)c1cc(OC)ccc1O	817951402	FKLAJPWYEURIGL-VIFPVBQESA-N	224.304	1.271	10	20	BDCD	
O=C(OCCn1cccn1)c1cc(O)cs1	731912614	UWTXIXYDBYEQCX-UHFFFAOYSA-N	238.268	1.507	10	20	BDCD	
CC(F)(F)CC(=O)NCc1ccc(O)cc1O	910947848	PBWKCAWQMNXMAH-UHFFFAOYSA-N	245.225	1.759	10	20	BDCD	
C[C@@H]1C[C@@H](N)CCN1Cc1cccc(F)c1O	846701859	DUANCMORAXKYFR-KOLCDFICSA-N	238.306	1.843	10	20	BDCD	
CC[C@H](NCc1cc(C)c(C)cc1O)C(=O)O	843038917	KVQLIXOSOHMTSD-NSHDSACASA-N	237.299	1.962	10	20	BDCD	
COCCS(=O)(=O)Nc1ccc(O)cc1C	70735607	QIVHAROMTNGMNK-UHFFFAOYSA-N	245.300	1.089	10	20	BDCD	
CC[C@@H](O)CN[C@@H](C)c1c(O)cccc1F	886637606	ARFGLWKKSSLAET-DTWKUNHWSA-N	227.279	1.953	10	20	BDCD	
Oc1cc2c(cc1CN1CCO[C@H]3C[C@@H]31)CCC2	793618269	KXOJYLMJHJHIQT-ZFWWWQNUSA-N	245.322	1.854	10	20	BDCD	
C[C@@H]1CCC[C@@H]([C@@H]2CCCC(=O)C2=O)N1	130379265	AKLOMWPYVUZNHM-UTLUCORTSA-N	209.289	1.455	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CO[C@@H](C)C2)c1	402023697	GDNVGJUMKWBRPY-ONGXEEELSA-N	237.299	1.668	10	20	BDCD	
CC[C@H]1NCC[C@@H]1C(=O)NCc1ccccc1O	700654381	RLXHPQGFYKVQKE-NWDGAFQWSA-N	248.326	1.397	10	20	BDCD	
CC(C)(O)c1cn(-c2ccc(N)cc2)nn1	72155133	SHKYHTAOIORXKJ-UHFFFAOYSA-N	218.260	1.077	10	20	BDCD	
CCOC[C@@H](O)CN[C@H](C)c1ccccc1O	382449042	HPNOKGNRLCONMW-MNOVXSKESA-N	239.315	1.440	10	20	BDCD	
COc1ccc(CNCCCCO)cc1C	234871579	SMKATYIGRWRHRW-UHFFFAOYSA-N	223.316	1.866	10	20	BDCD	
O=C(O)CC1(NCc2ccccc2O)CC1	1334768758	REUFJGWYCMZHFU-UHFFFAOYSA-N	221.256	1.489	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)[C@H](C)CO	292373249	YQPQHQQIZYXCLG-GFCCVEGCSA-N	236.359	1.955	10	20	BDCD	
CNCCCNCc1c(O)ccc(Cl)c1F	841041413	FMQLNHXKMRMODD-UHFFFAOYSA-N	246.713	1.884	10	20	BDCD	
Cc1cccc(CN[C@H]2COC[C@@H]2C)c1O	710997371	HLRWBJGEOAMDLB-JQWIXIFHSA-N	221.300	1.825	10	20	BDCD	
Cc1cccc(CNC[C@H]2CCCNC2=O)c1O	839196146	SBGGEMQGCIFMSM-GFCCVEGCSA-N	248.326	1.316	10	20	BDCD	
Cc1ccc(CNCCn2ccnc2C)c(O)c1	876991936	WPNSHORDEDJFHR-UHFFFAOYSA-N	245.326	1.995	10	20	BDCD	
C[C@H](NCCC(N)=O)c1ccc(N(C)C)cc1	37262016	SBFSPDWCYNKDPB-JTQLQIEISA-N	235.331	1.279	10	20	BDCD	
C[C@@H](CCNCc1cc(F)ccc1O)N(C)C	700470950	HNDRDJJAFKGSIM-JTQLQIEISA-N	240.322	1.961	10	20	BDCD	
CCCOc1ccccc1NC[C@H](O)COC	819399397	URNNFPKKLBOXTQ-NSHDSACASA-N	239.315	1.895	10	20	BDCD	
C[C@@H](NC(=O)[C@@H](C)N(C)C)c1ccccc1O	827955891	GBWPHFONBHPXLS-NXEZZACHSA-N	236.315	1.520	10	20	BDCD	
CCN(CC)c1ccc(CNCC(=O)NC)cc1	37207218	SAITUMDKOGEVJE-UHFFFAOYSA-N	249.358	1.368	10	20	BDCD	
C[C@@H](CCO)N[C@@H](C)c1cc(F)ccc1O	132546604	AKKOQATZGVEWMQ-IUCAKERBSA-N	227.279	1.953	10	20	BDCD	
C[C@@H](C(=O)O)N(C)Cc1cc2c(cc1O)CCC2	817779291	IWKIGKDKNIYBBK-VIFPVBQESA-N	249.310	1.786	10	20	BDCD	
CNCCN[C@@H](C)c1cc(F)cc(F)c1O	817953200	WWQAKSGXIQXFOQ-ZETCQYMHSA-N	230.258	1.540	10	20	BDCD	
Cc1cc(=NC(=O)c2cc(O)cs2)cc[nH]1	732261278	GHIBSIDJHXEHCA-UHFFFAOYSA-N	234.280	1.831	10	20	BDCD	
CC[C@H](C(=O)NCc1ccccc1O)[C@@H](C)O	842230017	OXGFCCMLTQUKCC-KOLCDFICSA-N	237.299	1.415	10	20	BDCD	
C[C@@H](NCCO)c1ccc(Cl)cc1O	841743125	CTBBHHHASBLHFK-SSDOTTSWSA-N	215.680	1.689	10	20	BDCD	
C[C@@H](NCc1cc(Cl)ccc1O)C(=O)O	49354035	ZLYASCUGZWQAMC-ZCFIWIBFSA-N	229.663	1.608	10	20	BDCD	
CCOc1ccc(CN(C)C[C@H](C)N)c(O)c1	863650775	AAJINOMYKIDOOM-JTQLQIEISA-N	238.331	1.570	10	20	BDCD	
Oc1ccc(Cl)cc1CNC[C@H]1COCO1	894871357	BRQHZMJSKJXAQZ-JTQLQIEISA-N	243.690	1.508	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1C[C@H]1F	1123769328	IQRYPLKOAVMFQE-RKDXNWHRSA-N	209.220	1.366	10	20	BDCD	
CC(C)(C(=O)O)C(=O)CSc1nccs1	1589588914	NSJWUQMEFIMBKI-UHFFFAOYSA-N	245.325	1.915	10	20	BDCD	
COc1ccc(CN[C@@H](C)CC(=O)O)cc1C	1594094517	JEJLPXYOZOKJDJ-JTQLQIEISA-N	237.299	1.956	10	20	BDCD	
COC(C)(C)CNC(=O)Cc1ccc(N)cc1	157011524	RSLBJOGNUDMKKL-UHFFFAOYSA-N	236.315	1.353	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](CO)CC(F)F)c1	717823486	IFNLSTNXYGUBRP-JTQLQIEISA-N	245.269	1.806	10	20	BDCD	
CC[C@@H]1C[C@H]1NC(=O)c1cccc(O)c1O	281741328	GYSROWFOGYZVIH-VXNVDRBHSA-N	221.256	1.626	10	20	BDCD	
CCC[C@@H](NCc1ccccc1O)C(=O)O	83404747	GVUUIWJPZVFRTE-SNVBAGLBSA-N	223.272	1.735	10	20	BDCD	
CN(C)[C@@H]1CCCN(Cc2ccc(N)cc2)C1	91392482	IXSJYUINRIPMSU-CQSZACIVSA-N	233.359	1.795	10	20	BDCD	
CN(Cc1ccccc1O)Cc1nccn1C	96477929	PXJJJAPHDGNOFW-UHFFFAOYSA-N	231.299	1.758	10	20	BDCD	
O=C(NCc1ccccc1O)NCC1CCC1	299471180	DBLSEEQZYQKVOZ-UHFFFAOYSA-N	234.299	1.992	10	20	BDCD	
C[C@@H](N[C@H]1CCCNC1)c1ccc(F)cc1O	817942129	XADDSTHUDCLDOS-KOLCDFICSA-N	238.306	1.934	10	20	BDCD	
NCC(F)(F)CNCc1cccc(F)c1O	841059614	IHQWHSGPXHIGKP-UHFFFAOYSA-N	234.221	1.215	10	20	BDCD	
COc1cccc(CN[C@@H](C)CCN)c1O	841050997	MFACBJSNIOFSLA-VIFPVBQESA-N	224.304	1.228	10	20	BDCD	
Nc1ccc(CCNC(=O)NOCC2CC2)cc1	841910901	VGRFRQAJSLHUNL-UHFFFAOYSA-N	249.314	1.452	10	20	BDCD	
COC[C@@H](C)NC(=O)c1c(F)ccc(O)c1O	789940509	BELBZAAJRFRYRM-ZCFIWIBFSA-N	243.234	1.002	10	20	BDCD	
CN[C@@H](C)CCNCc1cc(F)ccc1O	1328677129	KAXKTOKVKTWDTH-VIFPVBQESA-N	226.295	1.619	10	20	BDCD	
C[C@H]1[C@H](CO)CCCN1Cc1ccc(N)cc1	1335288428	FVEKJEDXLVGCRC-AAEUAGOBSA-N	234.343	1.862	10	20	BDCD	
CNC[C@@H](C)CNCc1ccc2c(c1)CCCO2	1262487706	BQABGGLVVDOIPS-GFCCVEGCSA-N	248.370	1.957	10	20	BDCD	
CCOC(=O)C1C(=O)c2ccccc2C1=O	5854089	PVCYZWDBTRWGCB-UHFFFAOYSA-N	218.208	1.245	10	20	BDCD	
C[C@H]1CCC(=O)CN1C(=O)c1cccc(O)c1O	885083449	OFQXIHGCBXRGDS-QMMMGPOBSA-N	249.266	1.291	10	20	BDCD	
C[C@@H]1COC[C@@H]1NC(=O)Nc1ccc(N)cc1	699776764	INXZNLNAGMICJF-KCJUWKMLSA-N	235.287	1.425	10	20	BDCD	
Cc1ccc(O)c(CNCCC2(CO)CC2)c1	395860563	CRBACXARCLZYLB-UHFFFAOYSA-N	235.327	1.953	10	20	BDCD	
CCCN(CC(=O)OC)Cc1ccccc1O	112691530	VSNDLCGQEJSXOC-UHFFFAOYSA-N	237.299	1.777	10	20	BDCD	
N[C@H](CO)c1cc(Br)ccc1O	72198710	PVTGUMYIFWPGRK-SSDOTTSWSA-N	232.077	1.147	10	20	BDCD	
CCCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1	183480970	ZNXKXPYAKWXBLH-SECBINFHSA-N	237.299	1.945	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC[C@H](C)CO)c1	86629173	KKTRZHYDABDAFJ-VHSXEESVSA-N	239.315	1.680	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCC[C@H](C)O)c1	85983760	HXWSWCHZYGUJAC-UWVGGRQHSA-N	239.315	1.822	10	20	BDCD	
CN1CC[C@H](NCc2ccc(N(C)C)cc2)C1	42543749	NVCGVMUIBWXUDU-ZDUSSCGKSA-N	233.359	1.546	10	20	BDCD	
COC(=O)c1cnc(SC[C@@H](C)O)s1	295433647	ZIDBTWDYLOQILZ-RXMQYKEDSA-N	233.314	1.403	10	20	BDCD	
COCCCONC(=O)c1cc(O)cs1	807772540	PAGRHTFUNPVRBJ-UHFFFAOYSA-N	231.273	1.152	10	20	BDCD	
COc1cccc(O)c1CN1CC(C)(OC)C1	839102106	JWLKFQKYGFRRNR-UHFFFAOYSA-N	237.299	1.622	10	20	BDCD	
O=C(NC[C@H]1CCCCO1)c1cc(O)cs1	732277899	VKOLCYCYVUSIOM-SECBINFHSA-N	241.312	1.753	10	20	BDCD	
CCCONC(=O)/C=C/c1ccc(O)c(O)c1	844085266	LCCIIXLHWDFJOX-GQCTYLIASA-N	237.255	1.569	10	20	BDCD	
CCOc1cccc(CNC[C@@H](N)CC)c1O	841071709	JGMUGFZEVLUWRZ-NSHDSACASA-N	238.331	1.618	10	20	BDCD	
CC(=O)c1cc(F)cc(CN(C)CCN)c1O	842479481	UTIARWBCNAFOJH-UHFFFAOYSA-N	240.278	1.124	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)c1	895784771	LJZRGPNNWGVNRJ-LNSITVRQSA-N	247.338	1.903	10	20	BDCD	
Cc1cccc(CNC[C@H](O)C2CC2)c1O	165163716	ZWWSCTOCUUOECT-LBPRGKRZSA-N	221.300	1.561	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@H](C)CC(N)=O)c1	168827942	VBNSXNZJWLOXGX-ZJUUUORDSA-N	236.315	1.615	10	20	BDCD	
O=C1CC[C@@H](NCc2ccccc2O)CCN1	396649846	JXCNWVSGSCFTME-LLVKDONJSA-N	234.299	1.151	10	20	BDCD	
CNC(=O)CCSc1nccs1	894395615	GOCVNETUVORNKI-UHFFFAOYSA-N	202.304	1.371	10	20	BDCD	
CNCCN(C)Cc1cccc(OC)c1O	69801025	MYWVMNHDMCVMAK-UHFFFAOYSA-N	224.304	1.052	10	20	BDCD	
COCCCNC(=O)CSc1nccs1	60759990	RDGAVQIYTVLLIK-UHFFFAOYSA-N	246.357	1.388	10	20	BDCD	
O=C(NCc1ccccc1O)c1cncc(O)c1	134500550	RWTUACKCVJFMQD-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
CC(=O)N1CCCN(Cc2ccccc2O)CC1	133275339	ZKJKXJIEYXFRGQ-UHFFFAOYSA-N	248.326	1.446	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H]2C[C@H](O)C2)c1	850579200	SSBAMZHCRLBOTD-GUBZILKMSA-N	237.299	1.575	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](O)[C@@H](C)C2)c1O	250090624	QDTPTECCMUAFOU-WCQYABFASA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC/C=C/CO)c1	717532693	OPYSXNVWTCHTFU-PGLGOXFNSA-N	221.300	1.900	10	20	BDCD	
Cc1ccc([C@@H](C)NCCCON)c(O)c1	902425358	MQLAJLMEHIBJOY-SNVBAGLBSA-N	224.304	1.632	10	20	BDCD	
COc1cccc(CNC2=NCCCN2C)c1O	849002617	MPBQSQCWLILEHH-UHFFFAOYSA-N	249.314	1.182	10	20	BDCD	
Oc1ccc(F)cc1CNCC[C@@H]1CCNC1	841035825	IWWQVKOYQYMGNU-JTQLQIEISA-N	238.306	1.621	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@H]1CCNC1	841044805	INKGFHOXZKRBPV-QMMMGPOBSA-N	226.707	1.497	10	20	BDCD	
CCCN1CC(=O)N[C@H]1c1cc(F)ccc1O	840824796	ORNORHBOEAIPFY-GFCCVEGCSA-N	238.262	1.372	10	20	BDCD	
Cc1cccc(CN[C@@H](C)c2ncnn2C)c1O	276411310	FILQQLLEUIGTFI-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
O=C(C[C@@H]1CCCOC1)NCc1ccccc1O	793681832	PNTPISFZNIRVLY-NSHDSACASA-N	249.310	1.825	10	20	BDCD	
Nc1ccc(CCNC(=O)C[C@@H]2CCCN2)cc1	152572120	MTKVOLPUOSCSLA-ZDUSSCGKSA-N	247.342	1.070	10	20	BDCD	
CC1(C)[C@@H](O)C[C@H]1NC(=O)Nc1ccc(N)cc1	841296544	UZDZZUKOURAXQG-MNOVXSKESA-N	249.314	1.550	10	20	BDCD	
Cc1ccc(CN(C)CCN(C)C)c(O)c1	877522534	BWGMLYNGZFVMSB-UHFFFAOYSA-N	222.332	1.694	10	20	BDCD	
CC1(C)[C@@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@H]21	262606231	BPCHCWGHZNWWOC-CHWSQXEVSA-N	244.338	1.926	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@]1(O)CCOC1)CC2	297092009	XHHOBYKQPULUJF-SMDDNHRTSA-N	249.310	1.121	10	20	BDCD	
COc1ccc(CNCCn2cccn2)cc1C	42351654	RWMZDOWOXZXSCS-UHFFFAOYSA-N	245.326	1.990	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC/C=C\CO)c1	717544769	CEHAJSXPMHGJDA-UMBAGQNISA-N	237.299	1.600	10	20	BDCD	
CNCCCN[C@@H](C)c1cc(C)ccc1O	817939978	IWIKVXHGSHYLHN-NSHDSACASA-N	222.332	1.961	10	20	BDCD	
CON(C)C(=O)/C=C\c1ccc(O)c(O)c1	588403713	XAEAMDNMACMJBW-XQRVVYSFSA-N	223.228	1.131	10	20	BDCD	
N[C@H]1CCC[C@H](NCc2cccc(F)c2O)C1	841058270	RJWQTQKSDMQWMA-QWRGUYRKSA-N	238.306	1.891	10	20	BDCD	
CN(C(=O)C[C@@H]1CCC[C@H]1N)c1ccc(N)cc1	877074887	UZYFLXGYCAGVFK-GXFFZTMASA-N	247.342	1.749	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC[C@]2(CCCCO2)C1	409426065	HLDCDHMEVPZHBN-LLVKDONJSA-N	238.291	1.858	10	20	BDCD	
C[C@H]1[C@@H](C)NCCN1Cc1ccc(N)cc1	1334773974	BVUPSTIZVQALEL-MNOVXSKESA-N	219.332	1.451	10	20	BDCD	
C[C@@H](CNCc1ccc(F)c(F)c1O)C(=O)O	1589066785	QDYMFBPSFQCVQV-LURJTMIESA-N	245.225	1.481	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1COCCO1)CCO2	38052588	NSGCCTCJKARSJY-ZDUSSCGKSA-N	249.310	1.127	10	20	BDCD	
CC(C)NC(=O)CN(C)c1ccc(N)cc1	20374457	UDIDPGAAKXLEMX-UHFFFAOYSA-N	221.304	1.230	10	20	BDCD	
COc1cc(N(C)CCN)cc(OC)c1OC	20239797	DCTYHKLHHLTLKY-UHFFFAOYSA-N	240.303	1.107	10	20	BDCD	
COC(=O)CN(C)Cc1cc(Cl)ccc1O	171938134	KVNYTPXKHDWSCF-UHFFFAOYSA-N	243.690	1.650	10	20	BDCD	
CC[C@@H](CCO)NCc1cc(C)ccc1O	77452975	PHLJZXPXXDQSRB-LBPRGKRZSA-N	223.316	1.951	10	20	BDCD	
CCN(CC(=O)NC)Cc1cccc(C)c1O	124533294	IIJWKWIDTWHOAT-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CCN(CCOC)Cc1cc(OC)ccc1O	133265931	KUZSTBNZACATGS-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
Cc1ccc(O)c(CNCC2(C)COC2)c1	82699492	QVQTYAIDBJJBIB-UHFFFAOYSA-N	221.300	1.827	10	20	BDCD	
C[C@H](N[C@H](CN)C1CC1)c1cc(F)ccc1O	817959296	FJIHXJJFTGQVFB-QPUJVOFHSA-N	238.306	1.919	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@H](C(=O)O)C2)cc1C	818849337	VYCYASDKZAHDOB-NSHDSACASA-N	249.310	1.916	10	20	BDCD	
Cc1ccc(CN(C)CC(=O)N(C)C)c(O)c1	876541874	LFPZIVDKEYFARO-UHFFFAOYSA-N	236.315	1.221	10	20	BDCD	
CCN(CC(N)=O)Cc1c(C)cccc1O	877469787	ZEWOGWVUMVLTAD-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
Cc1cccc(CN2CC[C@H](N)[C@@H](C)C2)c1O	843053080	YMDUMSBVQDQNOW-AAEUAGOBSA-N	234.343	1.870	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCC[C@H](C)O	840942058	QTMNRXPMMZYYLB-LBPRGKRZSA-N	236.359	1.922	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)COCC2CC2)c1	862759771	LCPUDMDWDYOAPY-UHFFFAOYSA-N	249.310	1.743	10	20	BDCD	
C[C@H](N)CN(C)Cc1cccc(Cl)c1O	863651324	GMVTWGXHUMMTLW-QMMMGPOBSA-N	228.723	1.825	10	20	BDCD	
CC[C@@H](CCO)NC(=O)c1cc(O)cs1	760178297	RWRRTYJTDQOZMR-ZETCQYMHSA-N	229.301	1.345	10	20	BDCD	
COc1ccc(O)c(CNCCC(C)(C)O)c1	274992889	ZLDAHXZTTPNVRA-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
COCC1CN(Cc2c(C)cccc2O)C1	895969891	QQQNZOHSXYQRDA-UHFFFAOYSA-N	221.300	1.779	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1cc(F)cc(F)c1O	708076160	SWZNMSBMNXKAEW-ZCFIWIBFSA-N	245.225	1.575	10	20	BDCD	
CNC(=O)NCc1ccc(N(C)C)cc1	31726416	NHPPGEJQVHCFRS-UHFFFAOYSA-N	207.277	1.182	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C(F)(F)F)c1	114540890	CXWYDHDHPHKSNM-UHFFFAOYSA-N	249.188	1.579	10	20	BDCD	
CN(C)CC1(NCc2ccccc2O)CCC1	282286435	QUGCRIGMLRFCIE-UHFFFAOYSA-N	234.343	1.966	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCCNCC2)cc1	128909085	JJQYXJWIRIKJQF-AWEZNQCLSA-N	247.386	1.984	10	20	BDCD	
CCOC(=O)C[C@H](O)CSc1nccs1	135001449	DCMANOLPJFKWST-ZETCQYMHSA-N	247.341	1.549	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@@H](C)N1	220137253	LEZPBNOSARMKRZ-NXEZZACHSA-N	238.306	1.714	10	20	BDCD	
COc1cccc(CNC(=O)C(C)(F)F)c1O	284198671	WUZOAFHIOWLEGX-UHFFFAOYSA-N	245.225	1.672	10	20	BDCD	
Cc1ccc(O)c(CN2CCn3cncc3C2)c1	291540914	LFZPFGWHALWJEV-UHFFFAOYSA-N	243.310	1.913	10	20	BDCD	
CC1=NO[C@H](C(=O)NCc2ccccc2O)C1	830526269	HNBORUQJERNMJJ-NSHDSACASA-N	234.255	1.173	10	20	BDCD	
CCn1cc(CN(C)Cc2ccccc2O)nn1	1334523323	KRBRPTBIJHRKDD-UHFFFAOYSA-N	246.314	1.636	10	20	BDCD	
C[C@@H](CCO)N(C)C(=O)c1cc(O)cs1	846664104	CRWDSWMAJHAKSS-ZETCQYMHSA-N	229.301	1.297	10	20	BDCD	
Oc1ccc(F)cc1CN1CCc2n[nH]cc2C1	857876531	RYLGMBLQZFMJPY-UHFFFAOYSA-N	247.273	1.813	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@@H](C)CC(N)=O)c1	168827765	VBNSXNZJWLOXGX-UWVGGRQHSA-N	236.315	1.615	10	20	BDCD	
C[C@@H](N)[C@@H](C)C(=O)N(C)c1ccc(N)cc1	877077534	LYEBGIHDDOVAMO-RKDXNWHRSA-N	221.304	1.215	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)Cc2ccc(F)cc2)C1	409422112	AVRBBUIYJMBVBU-UHFFFAOYSA-N	234.234	1.889	10	20	BDCD	
COc1cccc(O)c1CN1C[C@H]2COC[C@H]2C1	872266835	NDMXYBDJYXXOAT-PHIMTYICSA-N	249.310	1.479	10	20	BDCD	
C[C@H](NC(=O)Cc1ccc(N)cc1)C(C)(C)O	393976603	CRNHKJUFFGFPRH-VIFPVBQESA-N	236.315	1.087	10	20	BDCD	
COCCN(C)Cc1cc(F)ccc1O	139746883	BOUBBXWMJQCKRO-UHFFFAOYSA-N	213.252	1.610	10	20	BDCD	
C[C@H](N[C@@H]1CC[C@H]1O)c1cc(F)ccc1O	378722354	GWJJWRNSQHWAPX-HNBZJPLGSA-N	225.263	1.705	10	20	BDCD	
CC(C)[C@H]1NCC[C@@H]1C(=O)Nc1ccc(N)cc1	294785023	OATZHPNBOJRRKX-QWHCGFSZSA-N	247.342	1.841	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2C[C@@]23CCCNC3)cc1	848393239	WADVVWJOSWXJOS-TZMCWYRMSA-N	245.326	1.597	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCN[C@H](C)C2)c1	841061405	IHTIKOBEDZSVDH-YPMHNXCESA-N	234.343	1.931	10	20	BDCD	
NC1(CNCc2ccccc2O)CCC1	841052405	VETXBQLPUFMJNP-UHFFFAOYSA-N	206.289	1.363	10	20	BDCD	
C[C@H](NCc1cc(F)ccc1O)C1(CO)CC1	696091765	VAPHDONFMNACAO-VIFPVBQESA-N	239.290	1.782	10	20	BDCD	
CCOC[C@@H](O)CN(C)Cc1ccccc1O	269665726	VRZZZAMNXPWHKF-LBPRGKRZSA-N	239.315	1.221	10	20	BDCD	
NCCn1ccn2nc(-c3cccnc3)cc12	409440058	VMGOZHZDTHGRKS-UHFFFAOYSA-N	227.271	1.157	10	20	BDCD	
OC[C@H]1C[C@@H](NCc2cc(Cl)ccc2O)C1	707593124	GNPPJHCXBAHZGN-DKTWLAJQSA-N	241.718	1.906	10	20	BDCD	
Oc1ccccc1CN=c1nc[nH]n1CC1CC1	1337020225	VASIQGHQPJYNTI-UHFFFAOYSA-N	244.298	1.428	10	20	BDCD	
Cc1ccc(CN(CC(=O)O)C(C)C)c(O)c1	1594359952	CCAHQMSHCOMFGS-UHFFFAOYSA-N	237.299	1.996	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)C[C@H](C)N1	19366943	LHONBGORYCTZFI-QWRGUYRKSA-N	220.316	1.574	10	20	BDCD	
CN[C@@H]1CCN(Cc2c(O)cccc2Cl)C1	150075301	PKILYXKCDGUNCD-SECBINFHSA-N	240.734	1.839	10	20	BDCD	
CC[C@H]1COCCN1C(=O)Nc1ccc(N)cc1	36327616	NMAVTSGBSQGEHC-LBPRGKRZSA-N	249.314	1.912	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCc2nnn(C)n2)c1	398085989	PWCOULVFQNYCQJ-SECBINFHSA-N	247.302	1.075	10	20	BDCD	
COCCNC(=O)N[C@H](C)c1ccccc1O	864424944	QVTVDVKMBNXBBC-SECBINFHSA-N	238.287	1.399	10	20	BDCD	
CCN1CCN(Cc2ccc(N)cc2)C[C@H]1C	250222981	FACSZJHFBODPJI-GFCCVEGCSA-N	233.359	1.795	10	20	BDCD	
CCOc1ccccc1NC[C@H](O)COC	68891309	CPDSYWHAAFLACK-JTQLQIEISA-N	225.288	1.505	10	20	BDCD	
COC(CN(C)Cc1ccccc1O)OC	131027140	BJQXITWPVOLMIL-UHFFFAOYSA-N	225.288	1.443	10	20	BDCD	
CCN(CCCO)Cc1ccc(N)cc1	43444333	WPSHLDXJTJWXQO-UHFFFAOYSA-N	208.305	1.473	10	20	BDCD	
C[C@@H](O)CN(C)Cc1cc(Cl)ccc1O	130639729	QCHQLSNQXBZIKK-MRVPVSSYSA-N	229.707	1.858	10	20	BDCD	
Cc1cccc(CN(C)CC[C@@H](C)O)c1O	132508300	ANZBVOHVNQILHB-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
O=C(O)CCN(Cc1ccccc1O)C1CC1	86736188	NNDGUYHDYRDNMY-UHFFFAOYSA-N	235.283	1.831	10	20	BDCD	
O=C(NOCC1CC1)c1c(F)ccc(O)c1O	295570799	KRNRNYCRVRAJJU-UHFFFAOYSA-N	241.218	1.308	10	20	BDCD	
C[C@H](NCCNC1CC1)c1ccccc1O	817953726	PSSRKVNLRZYDJQ-JTQLQIEISA-N	220.316	1.795	10	20	BDCD	
CCC1CN(C(=O)c2c(F)ccc(O)c2O)C1	839792167	NXKHIMRAQDVCFZ-UHFFFAOYSA-N	239.246	1.719	10	20	BDCD	
OC[C@@H](CCF)NCc1c(O)cccc1Cl	846096537	IRYVPPGSYCMYGH-MRVPVSSYSA-N	247.697	1.856	10	20	BDCD	
CCN(C)c1ccc(CN2C[C@H](C)[C@H](O)C2)cc1	773819066	OBLFKLCHNAKRMB-SWLSCSKDSA-N	248.370	1.955	10	20	BDCD	
C[C@H]1COC[C@H]1NCc1ccc2c(c1)CCO2	710894172	UBGSNECJFNWOOJ-GXFFZTMASA-N	233.311	1.746	10	20	BDCD	
COc1cccc(CNC2CCOCC2)c1O	36319448	XXZSMYYJXJGDAP-UHFFFAOYSA-N	237.299	1.669	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccccc1	39186022	IVVLOFLJZFTBSW-UHFFFAOYSA-N	206.197	1.002	10	20	BDCD	
C[C@@H](CN(C)C)NCc1ccccc1O	130162062	YHHZLTZBYZBZGC-JTQLQIEISA-N	208.305	1.432	10	20	BDCD	
COC[C@H](CNCc1cc(F)ccc1O)OC	227717470	OGHCDTPEXWNBGQ-NSHDSACASA-N	243.278	1.282	10	20	BDCD	
CN(CCn1cncn1)Cc1ccccc1O	264702179	KFFZUXHFPSHTKH-UHFFFAOYSA-N	232.287	1.116	10	20	BDCD	
CC[C@@H](O)CN[C@H](C)c1ccccc1O	162198110	LYTVOLGQKZRPPR-NXEZZACHSA-N	209.289	1.814	10	20	BDCD	
CN1CC[C@@H]1CNCc1cccc(Cl)c1O	712563955	BIMRDNZKCLVRMI-SNVBAGLBSA-N	240.734	1.839	10	20	BDCD	
Cc1cnc(C(=O)NCc2ccccc2O)o1	813810202	HCZSXOBWDMYZKO-UHFFFAOYSA-N	232.239	1.619	10	20	BDCD	
C[C@@H]1CN=C(NCc2cc(Cl)ccc2O)N1	849050320	ZJKXSLSGLIFXDW-SSDOTTSWSA-N	239.706	1.483	10	20	BDCD	
CC1(C)CCN[C@H]1C(=O)Nc1ccc(N)cc1	852789773	FPNRUGQHEPBUJH-NSHDSACASA-N	233.315	1.595	10	20	BDCD	
Nc1ccc(CN[C@@H]2CC23CCNCC3)cc1	1120269392	RWLZVPVEYMEALP-CYBMUJFWSA-N	231.343	1.501	10	20	BDCD	
Cn1cc(CN=[N+]=[N-])c(-c2cnccn2)n1	409441125	WODDFJBGIDPBBI-UHFFFAOYSA-N	215.220	1.687	10	20	BDCD	
C[C@H]1CC[C@H](CNCc2ccc(N)cc2)O1	398106444	KNRPMKOZYSJMND-GXFFZTMASA-N	220.316	1.926	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@@H](C)CC(N)=O)c1	168827671	VBNSXNZJWLOXGX-VHSXEESVSA-N	236.315	1.615	10	20	BDCD	
C[C@H](Cn1ccnc1)NCc1cc(F)ccc1O	226584588	YEMFFIMTIKENQZ-SNVBAGLBSA-N	249.289	1.906	10	20	BDCD	
COc1cccc(CNCCC[C@@H](C)O)c1O	227954023	WLJGMXCAVOHHEB-SNVBAGLBSA-N	239.315	1.651	10	20	BDCD	
CCc1nc(CN(C)Cc2ccccc2O)no1	111235171	HPGVCWDZKJNQGV-UHFFFAOYSA-N	247.298	1.970	10	20	BDCD	
CCCOCC(=O)NCc1ccccc1O	225595309	BFIGVLHIIRNJAH-UHFFFAOYSA-N	223.272	1.435	10	20	BDCD	
CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1	145434078	YQBABVBSOULFJL-LLVKDONJSA-N	248.326	1.720	10	20	BDCD	
COC(=O)[C@H](C)NCc1ccc(C)cc1O	396433522	JNMKQXJPHLXADG-VIFPVBQESA-N	223.272	1.352	10	20	BDCD	
Cc1ccc(O)c(CN2CCNC[C@@H]2C)c1	722393863	DQHOLLZBCKXPHX-NSHDSACASA-N	220.316	1.494	10	20	BDCD	
CO[C@@H]1CCC[C@H]1NC(=O)c1cc(O)cs1	834333322	KMMHORHYNQIKNH-RKDXNWHRSA-N	241.312	1.751	10	20	BDCD	
CC[C@@H]1NCC[C@@H]1C(=O)NCc1ccc(N)cc1	1122535814	IIEQYOQRWWPYLP-STQMWFEESA-N	247.342	1.273	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCCNC2)cc1	43324905	BXCPTGRAJZHBGQ-ZDUSSCGKSA-N	233.359	1.594	10	20	BDCD	
C[C@@H](NCCF)c1cc([N+](=O)[O-])ccc1O	280873980	AJPZRDWMSPVGCV-SSDOTTSWSA-N	228.223	1.921	10	20	BDCD	
CCN1CCC[C@@H](NCc2ccccc2O)C1=O	722341521	IUZIPLIBJRKZFH-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@@H]1CCN1	1579616698	DXNAVJGHSPXIGK-ZDUSSCGKSA-N	233.359	1.513	10	20	BDCD	
Nc1ccc(NC(=O)NCC2(O)CCCC2)cc1	841300588	SOEUIMBQTLBDNN-UHFFFAOYSA-N	249.314	1.695	10	20	BDCD	
CN1C[C@H](N[C@@H]2CCc3cccc(O)c32)CC1=O	297509503	CLBFIDQYEITBBP-GHMZBOCLSA-N	246.310	1.200	10	20	BDCD	
Cc1nc([C@@H](C)NCc2ccccc2O)n[nH]1	392461320	LHVOWMZMUHWMSE-MRVPVSSYSA-N	232.287	1.670	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)C[C@@H](C)N1	23477146	LHONBGORYCTZFI-PHIMTYICSA-N	220.316	1.574	10	20	BDCD	
Cc1c(C(=O)NCc2ccccc2O)cnn1C	124714181	CXOMFMAXPODDDT-UHFFFAOYSA-N	245.282	1.364	10	20	BDCD	
Cc1ccc(O)c(CNCc2ccnn2C)c1	71409419	KQSHKWBRYMXZGE-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
COCCCCNCc1cc(OC)ccc1O	44656703	GJGPETRMRGWWNE-UHFFFAOYSA-N	239.315	1.917	10	20	BDCD	
CNC(=O)[C@H](C)NCc1ccc(OC)c(C)c1	42342113	FTOPBNASTOOWHK-JTQLQIEISA-N	236.315	1.228	10	20	BDCD	
Cn1nncc1C(=O)CSc1nccs1	285185543	OFQMZSPZOGYCIC-UHFFFAOYSA-N	240.313	1.247	10	20	BDCD	
C[C@@H]1CCNCC[C@@H]1NCCc1ccc(N)cc1	817958211	SZESUKHNLPPXMO-DOMZBBRYSA-N	247.386	1.789	10	20	BDCD	
Cc1cc(O)c(CN(C)CC(N)=O)cc1Cl	824556554	YIBQFMUYLGJMTR-UHFFFAOYSA-N	242.706	1.271	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H](O)[C@H](C)C1	877433984	LCLVUBDQFLSKHU-DGCLKSJQSA-N	235.327	1.903	10	20	BDCD	
Cc1cccc(O)c1CNCc1ccn(C)n1	877125350	LBQIKCYZHLBGFF-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
CCOC(=O)[C@H](C)NCc1c(C)cccc1O	877470339	CDEMEVMCNWNEMK-JTQLQIEISA-N	237.299	1.742	10	20	BDCD	
C[C@@H](NC(=O)N[C@H]1CCNC1)c1ccccc1O	892003280	VAZMSBAGZWTBAE-ZJUUUORDSA-N	249.314	1.114	10	20	BDCD	
Cn1cc(CNc2ccc(N)cc2)nn1	389821736	GBAVQHJUFUKLDC-UHFFFAOYSA-N	203.249	1.009	10	20	BDCD	
C[C@H]1[C@@H](C)N(Cc2ccc(N)cc2)CCN1C	1334754800	RQPQKKMVWMTCRB-NWDGAFQWSA-N	233.359	1.793	10	20	BDCD	
CON(C(=O)c1cccc(O)c1O)C(C)C	1261728045	IUVJTCAFAWURND-UHFFFAOYSA-N	225.244	1.510	10	20	BDCD	
NC[C@H]1CCCC[C@@H]1NCc1ccccc1O	228406639	RPWJMAPCRFJOJS-YPMHNXCESA-N	234.343	1.999	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)C[C@H](C)N1	220137372	LEZPBNOSARMKRZ-UWVGGRQHSA-N	238.306	1.714	10	20	BDCD	
C[C@]1(C(=O)NCc2ccc(N)cc2)CCCOC1	297351224	ZEJCEEYPBKCNJN-AWEZNQCLSA-N	248.326	1.702	10	20	BDCD	
O=C(O)CC1(NCc2ccccc2O)CCC1	901706248	DEXATFNOMRVLNY-UHFFFAOYSA-N	235.283	1.879	10	20	BDCD	
O=C(NC[C@@H]1CCCCO1)c1cc(O)cs1	732277901	VKOLCYCYVUSIOM-VIFPVBQESA-N	241.312	1.753	10	20	BDCD	
COc1ccc(N2CC[C@H](CNC(=N)N)C2)cc1	849043965	NETXLMUWHJSOGS-SNVBAGLBSA-N	248.330	1.005	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H]2C[C@@]2(CO)C1	877463038	YYMQTQMLMWKSTD-FZMZJTMJSA-N	233.311	1.515	10	20	BDCD	
CN1CCC[C@@H](Sc2nccs2)C1=O	778557134	NQZDLYCEUKPVLX-SSDOTTSWSA-N	228.342	1.856	10	20	BDCD	
OCC[C@@H]1CCCN(Cc2ccccc2O)C1	770511030	VXWAHOVNIZPNBU-LBPRGKRZSA-N	235.327	1.987	10	20	BDCD	
Cc1ccc(CN[C@@H]2CCN(C)C2)c(O)c1	877019457	MQGXBXRWLOEXRE-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
C[C@@H](NC(=O)N[C@@H]1CCNC1)c1ccccc1O	892003277	VAZMSBAGZWTBAE-NXEZZACHSA-N	249.314	1.114	10	20	BDCD	
CCC(=O)NCc1ccc(OC)cc1O	794381065	JAFTVUSTZDJZRL-UHFFFAOYSA-N	209.245	1.427	10	20	BDCD	
CC[C@@H](CNCc1c(C)cccc1O)C(=O)O	1595167408	NQMLBDSHSSXGBY-JTQLQIEISA-N	237.299	1.901	10	20	BDCD	
CC[C@H](OC)C(=O)N(C)c1ccc(N)cc1	877078031	ABZJFVPGCVTIGU-NSHDSACASA-N	222.288	1.657	10	20	BDCD	
C[C@@H](CN)C(=O)N(C)Cc1ccc(N(C)C)cc1	54340667	POGIIAFBTQUWHZ-NSHDSACASA-N	249.358	1.306	10	20	BDCD	
COc1cccc(CNCC(C)(C)OC)c1O	135232792	UGBOKYPKCWSALS-UHFFFAOYSA-N	239.315	1.915	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@](C)(O)C2)c1	180197288	WXFZNDAYUURPRP-ZDUSSCGKSA-N	221.300	1.657	10	20	BDCD	
NC(=O)NCCCSc1nccs1	175600271	BWRRJXPAZUWXTG-UHFFFAOYSA-N	217.319	1.294	10	20	BDCD	
CCN(CCOC)Cc1ccccc1O	132695250	WKOYOLMWJBFYNN-UHFFFAOYSA-N	209.289	1.861	10	20	BDCD	
C[C@@H](C(=O)NCCc1ccc(N)cc1)C1CC1	148759823	OSXSUIMCEFTKTB-SNVBAGLBSA-N	232.327	1.974	10	20	BDCD	
Oc1ccccc1CN1CC2(CCOC2)C1	294231375	ZKQOBNXHNYFEFJ-UHFFFAOYSA-N	219.284	1.615	10	20	BDCD	
Cc1cc(CN2C[C@@H](C)[C@@H](O)C2)ccc1N(C)C	815081054	QOCRTPYXGBSYBA-DOMZBBRYSA-N	248.370	1.874	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CC[C@@H](C(=O)O)C2)c1	820968208	UPVVCIXYMOAEKU-LLVKDONJSA-N	249.310	1.916	10	20	BDCD	
COc1ccc(N(CC(N)=O)CC2CC2)cc1	831582628	AHGGXMCXLNMBJL-UHFFFAOYSA-N	234.299	1.397	10	20	BDCD	
CCOc1ccc(CN2CC[C@H](O)C2)c(O)c1	768410768	ZCIJCJORUUHJEV-NSHDSACASA-N	237.299	1.358	10	20	BDCD	
Cc1ccc(CN(C)C2(CO)CC2)c(O)c1	877642486	XBSKJUMIATWJIE-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
CO[C@@H](C)CNCc1ccc(C)cc1O	877465309	SWUAWPOBVKGJEA-JTQLQIEISA-N	209.289	1.825	10	20	BDCD	
Cc1ccc(CNC[C@](C)(O)C2CC2)c(O)c1	877027259	LXPUFCUPGKJEMY-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]1F	1521254362	APICYPHFDPICMA-NXEZZACHSA-N	223.247	1.709	10	20	BDCD	
Cc1nocc1NC(=O)NCc1ccc(N)cc1	1579923903	RVRSZQDKXCCOFZ-UHFFFAOYSA-N	246.270	1.887	10	20	BDCD	
CC[C@@H](N)CNCc1ccc2c(c1)CCCO2	904355318	PWMMLADVCAATTH-CYBMUJFWSA-N	234.343	1.839	10	20	BDCD	
CO[C@H](C)[C@@H](C)NC(=O)Nc1ccc(N)cc1	841299616	LMYFDNWUKKPWAT-RKDXNWHRSA-N	237.303	1.814	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H](O)C(F)(F)F	876966826	WSCGARXBHRNGCP-SNVBAGLBSA-N	249.232	1.713	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)CC[C@H]1C(=O)O	306071582	WQWCDUSQPDYHJX-CMPLNLGQSA-N	249.310	1.935	10	20	BDCD	
Cc1cccc(CN[C@H](CO)C(C)C)c1O	38313321	ZIHDWYABJPAAIO-GFCCVEGCSA-N	223.316	1.807	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)[C@@H](C)CO1	35782351	RXBTWGKUODNCHA-QWRGUYRKSA-N	248.326	1.447	10	20	BDCD	
Cc1cc(C(=O)NCc2ccc(O)c(O)c2)co1	188780848	UBIQZRARPJABDI-UHFFFAOYSA-N	247.250	1.929	10	20	BDCD	
CN(C)c1ccc(CNCCn2cccn2)cc1	42351804	SWIYCDUUQNQUJB-UHFFFAOYSA-N	244.342	1.739	10	20	BDCD	
Cc1cc(C(=O)Nc2ccc(N)cc2)on1	44584577	TYVDPSLORJQWCV-UHFFFAOYSA-N	217.228	1.818	10	20	BDCD	
C[C@H]1CCNC(=O)[C@H]1NCc1ccccc1O	193687324	BUNGSUKQRXSLDE-CABZTGNLSA-N	234.299	1.006	10	20	BDCD	
CCOC(=O)CSc1ncc([N+](=O)[O-])s1	195505276	IHIPIEQOUNWGBM-UHFFFAOYSA-N	248.285	1.707	10	20	BDCD	
C[C@H]1CCN(Cc2ccccc2O)[C@@H]1CO	191179446	ZVPANAHJGCLZTH-CMPLNLGQSA-N	221.300	1.595	10	20	BDCD	
O=C(O)[C@@H]1CCCN1C(=O)c1cc(O)cs1	821508656	CYWJBOFIXATSHO-ZETCQYMHSA-N	241.268	1.143	10	20	BDCD	
Oc1c(F)cccc1CNCC[C@@H]1CCNC1	841035868	JFJBYPVVICXECZ-JTQLQIEISA-N	238.306	1.621	10	20	BDCD	
CCOc1cccc(CN[C@@H](C)CCN)c1O	841052457	XUUQNTCCJHLWJC-JTQLQIEISA-N	238.331	1.618	10	20	BDCD	
Nc1ccc(N[C@H]2CCC[C@@H](N)C2)cc1	848715187	PSWZBZUJYRCSDI-PWSUYJOCSA-N	205.305	1.951	10	20	BDCD	
CO[C@H]1C[C@H](NCc2ccc(C)cc2O)C1	877661130	WCTPUWPMKXTTSH-HAQNSBGRSA-N	221.300	1.968	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCC[C@H]1N	85369291	DZEDWCYIEFSKNI-NWDGAFQWSA-N	248.326	1.478	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@@H](F)C1	689842646	UXRSCGXPSOHXGN-SSDOTTSWSA-N	225.219	1.282	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@H]1COCCO1	690818245	CMWPVJOXGYDRGV-ZDUSSCGKSA-N	236.315	1.116	10	20	BDCD	
CCCN[C@H](C)C(=O)NCc1ccc(N)cc1	1263303837	KQACLIRPVLCDML-SNVBAGLBSA-N	235.331	1.273	10	20	BDCD	
N[C@@H](CC(=O)O)c1cc(C(F)(F)F)ccc1O	217970265	DVNHHWYGDWJMDS-ZETCQYMHSA-N	249.188	1.886	10	20	BDCD	
O=C(O)CCCCNCc1ccc2c(c1)CCO2	258900865	OBPLCOMAPTULPG-UHFFFAOYSA-N	249.310	1.966	10	20	BDCD	
C[C@H](CC(N)=O)N[C@H](C)c1cc(F)ccc1O	168830608	DSQBONJJNUCYSL-HTQZYQBOSA-N	240.278	1.446	10	20	BDCD	
CC(C)(C)C(=O)NCC(=O)Nc1ccc(N)cc1	236779321	TXHXZUFQRJMANH-UHFFFAOYSA-N	249.314	1.370	10	20	BDCD	
CNC(=O)[C@H]1CCCN(Cc2ccccc2O)C1	179574345	RNKOTJNGXFBYQS-LBPRGKRZSA-N	248.326	1.350	10	20	BDCD	
C[C@H](N[C@H](C)c1ccccc1O)C(=O)N(C)C	36794364	CQIVYBDWPLYURD-ZJUUUORDSA-N	236.315	1.520	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccc[nH]1	82277531	XTOMVQYUZKJHRI-UHFFFAOYSA-N	216.240	1.650	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)[C@@H](C)CN1	235639689	DNWZVPBYUJOPDC-UWVGGRQHSA-N	238.306	1.714	10	20	BDCD	
O=C(NC/C=C\C1CC1)c1cccc(O)c1O	383249513	QWWIKRYASWRNLX-IHWYPQMZSA-N	233.267	1.794	10	20	BDCD	
C[C@H](NC[C@H]1CCCN1)c1ccc(F)cc1O	817951224	BXLWVNNXVCZYHA-GXSJLCMTSA-N	238.306	1.934	10	20	BDCD	
CCCN(c1ccc(CN)cc1)[C@H](C)C(=O)O	904234089	CGPDPJUHAADBSO-SNVBAGLBSA-N	236.315	1.835	10	20	BDCD	
Nc1ccc(CCNC(=O)N2CCCCO2)cc1	841958541	GPAQNJHIBDZFFM-UHFFFAOYSA-N	249.314	1.548	10	20	BDCD	
C[C@@H](NC(=O)c1cn(C)nn1)c1ccccc1O	827946586	NCOGMOKXUQLGEB-MRVPVSSYSA-N	246.270	1.012	10	20	BDCD	
CNC[C@H](C)N[C@H]1CCc2cccc(O)c21	854232472	QUBXYVCTTFBWAG-ONGXEEELSA-N	220.316	1.577	10	20	BDCD	
Cc1ccc(CN2CCn3cncc3C2)c(O)c1	877540032	XOTCSTJQYIRITA-UHFFFAOYSA-N	243.310	1.913	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1CCN(C)C1	877019729	QACMBRFMRGQSAU-LLVKDONJSA-N	220.316	1.494	10	20	BDCD	
C[C@H](NCc1cccc(F)c1O)C(=O)O	165158084	IGMKWQABMKOBKO-LURJTMIESA-N	213.208	1.094	10	20	BDCD	
C[C@H](NCCCO)c1ccc(F)c(F)c1O	191181378	DSTRZXYIGOLRML-ZETCQYMHSA-N	231.242	1.703	10	20	BDCD	
COC(=O)N1CCC(Nc2ccc(N)cc2)CC1	689497774	YSZNXLJOQXCHKZ-UHFFFAOYSA-N	249.314	1.912	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1CC1	1528770645	CCXCLYPHWAWBIO-UHFFFAOYSA-N	207.229	1.124	10	20	BDCD	
C[C@@H]1CCNC[C@H]1NCc1ccc(N(C)C)cc1	841059395	RMGNIIKWWRGANC-IUODEOHRSA-N	247.386	1.840	10	20	BDCD	
CCOC[C@H]1CCCCN1C(=O)CN=[N+]=[N-]	409425648	GJBGFBPPISLBMW-SECBINFHSA-N	226.280	1.714	10	20	BDCD	
Nc1ccc(CNC(=O)C2CC=CC2)cc1	126433320	LHVWYCIDJQRQNW-UHFFFAOYSA-N	216.284	1.851	10	20	BDCD	
CCc1nc(Cc2ccc(N)cc2)n(C)n1	54697068	ZJFRJYVFXMSDOD-UHFFFAOYSA-N	216.288	1.551	10	20	BDCD	
CNC(=O)CCN(C)Cc1cccc(C)c1O	180030308	ZMUIDPWAPHUSSQ-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
C[C@H](O)[C@@H]1CCN(Cc2cc(F)ccc2O)C1	180861516	DWKXXHQEYMKAFM-VHSXEESVSA-N	239.290	1.734	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C[C@@H]2CCC[C@H]2C1	126505400	DILCPHXNVLVRLD-UWVGGRQHSA-N	247.294	1.970	10	20	BDCD	
OC[C@H](CC(F)F)NCc1ccccc1O	381498912	NURFMXZZGUYEBT-VIFPVBQESA-N	231.242	1.498	10	20	BDCD	
CN(C)c1ccc(CNCC2(C)COC2)cc1	83523080	ZWMJQQOFYNUFRU-UHFFFAOYSA-N	234.343	1.879	10	20	BDCD	
C[C@H](NC/C=C\CO)c1cc(F)ccc1O	717573895	AIIHKDDQBHZAPC-XADBCAIWSA-N	225.263	1.730	10	20	BDCD	
C[C@H](O)CNCc1ccc(N2CC=CC2)cc1	819097073	WUZOAJWZDSCTBO-LBPRGKRZSA-N	232.327	1.533	10	20	BDCD	
C[C@@H](CCCN)NCc1cc(F)ccc1O	841078942	FEQSJFJGRORZSA-VIFPVBQESA-N	226.295	1.748	10	20	BDCD	
C[C@@H](CN)NCc1cc(Cl)ccc1O	841064257	WTJNFGVKZUVOLQ-ZETCQYMHSA-N	214.696	1.482	10	20	BDCD	
Oc1cc2c(cc1CN1C[C@H]3C[C@@H]3C1)OCO2	862440002	DCRHELDULOQMAF-RKDXNWHRSA-N	233.267	1.573	10	20	BDCD	
CCO[C@@H]1C[C@@H]1C(=O)NCc1cc(C)ccc1O	862758912	QHXXGNAFQRXZBU-WCQYABFASA-N	249.310	1.742	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H](C)N1	70075011	DSTUZCGLBSVYMD-BETUJISGSA-N	247.386	1.935	10	20	BDCD	
CC(C)[C@H](C(=O)N(C)c1ccc(N)cc1)N(C)C	877077474	JOYQZAIWTPUCQY-CYBMUJFWSA-N	249.358	1.818	10	20	BDCD	
CC1=NO[C@H](CNCc2cc(C)ccc2O)C1	895308540	MRKCPXSVMOKDMK-LBPRGKRZSA-N	234.299	1.955	10	20	BDCD	
CCOCCNCc1cc(C)cc(OC)c1O	894385996	SUUOHAXSXYJHGD-UHFFFAOYSA-N	239.315	1.835	10	20	BDCD	
C[C@@H]1C(=O)CCCN1C(=O)c1cccc(O)c1O	885052247	PKICPKYSHSYIGL-MRVPVSSYSA-N	249.266	1.291	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](N)[C@H](C)C2)c1	94338776	OAVBSIDBEVAXJY-DGCLKSJQSA-N	234.343	1.870	10	20	BDCD	
O=C(CSc1nccs1)N1CCC1	64661571	XXACQCDEEKIWDJ-UHFFFAOYSA-N	214.315	1.468	10	20	BDCD	
CN(C)c1ccc(CNC[C@H](F)C(=O)O)cc1	1334845436	VPPJZZOVDBWRBQ-NSHDSACASA-N	240.278	1.265	10	20	BDCD	
CC(C)C1(C(=O)Oc2ccc(N)cc2)COC1	1575474870	GKVBJPSHKZNMFV-UHFFFAOYSA-N	235.283	1.847	10	20	BDCD	
C[C@@H](NCc1ccc2c(c1)CCCO2)C(=O)O	1120249527	MDJNFXNTQCTCFR-SECBINFHSA-N	235.283	1.574	10	20	BDCD	
C[C@](O)(CNCc1cc(F)ccc1O)C1CC1	310415651	MZXCMUBVEMCCRI-ZDUSSCGKSA-N	239.290	1.782	10	20	BDCD	
CCC[C@@H](N)C(=O)N(C)Cc1ccccc1O	37823775	FFZFGHGWWUQEDH-LLVKDONJSA-N	236.315	1.478	10	20	BDCD	
C[C@@H](NCCCO)c1cc(F)cc(F)c1O	134904239	CPBSONISPXIQSF-SSDOTTSWSA-N	231.242	1.703	10	20	BDCD	
CC(F)(F)C(=O)NCc1ccc(O)c(O)c1	289101684	DJKJMBGEUXZGOL-UHFFFAOYSA-N	231.198	1.369	10	20	BDCD	
C[C@H]1C[C@H](NCCc2ccc(N)cc2)CCO1	817956438	YYPPZWLLNXKDNF-SMDDNHRTSA-N	234.343	1.968	10	20	BDCD	
C[C@@H](O)CCOC(=O)c1cc(O)cs1	849728655	WNAXZDRNCXGHQD-ZCFIWIBFSA-N	216.258	1.381	10	20	BDCD	
C[C@H](N[C@@H]1CCOC1=O)c1ccc(N(C)C)cc1	774481028	HBPYPHCFSVIIGM-GXFFZTMASA-N	248.326	1.719	10	20	BDCD	
O=C(NC[C@@H]1CCC=CO1)c1cc(O)cs1	782040724	WEJQCSRUQAKVRB-VIFPVBQESA-N	239.296	1.876	10	20	BDCD	
Nc1ccc(CN2C[C@H]3CCC[C@@]3(N)C2)cc1	1235245938	RSCDCFAMMBWOFY-TZMCWYRMSA-N	231.343	1.582	10	20	BDCD	
CC(C)C(=O)NCCc1ccc(O)c(O)c1	11638387	JADZUMUOHQKPNL-UHFFFAOYSA-N	223.272	1.413	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NC(=O)NCc1ccc(N)cc1	1579129755	JJFZOPIKPXVTHI-YPMHNXCESA-N	249.314	1.245	10	20	BDCD	
CO[C@@H](C)Sc1ncc(C(=O)O)s1	1599040064	RBBIEKAVJPOMNQ-SCSAIBSYSA-N	219.287	1.926	10	20	BDCD	
NC[C@@H]1CCC[C@H]1NCc1ccc2c(c1)CCO2	841028537	BEPXDNDAURPTBT-UONOGXRCSA-N	246.354	1.839	10	20	BDCD	
C[C@@H](O)CN(C(=O)Nc1ccc(N)cc1)C1CC1	709493296	XBLYPGWYKVFNAZ-SECBINFHSA-N	249.314	1.646	10	20	BDCD	
C[C@@H](O)C1(NCc2ccc3c(c2)CCO3)CC1	827579904	LANARPURSWWWON-SNVBAGLBSA-N	233.311	1.625	10	20	BDCD	
COC(=O)C[C@@H](O)CSc1nccs1	109717746	YVLXZNICLPDUBJ-ZCFIWIBFSA-N	233.314	1.159	10	20	BDCD	
CNC[C@H]1CCN(Cc2cc(F)ccc2O)C1	219964164	VKKMXWZKILFJTH-SNVBAGLBSA-N	238.306	1.573	10	20	BDCD	
CNC[C@@H]1CCCN1Cc1cc(C)ccc1O	133040077	QGAWFIQZLPUHPP-ZDUSSCGKSA-N	234.343	1.884	10	20	BDCD	
C[C@H](N)CCC(=O)NCc1ccc(N(C)C)cc1	70317432	YTGGVRKYMGHXJT-NSHDSACASA-N	249.358	1.496	10	20	BDCD	
CC[C@@H](O)CN[C@H](C)c1ccc(F)cc1O	229964460	FMWBNHUDXHVKFK-PSASIEDQSA-N	227.279	1.953	10	20	BDCD	
CN(C)c1ccc(CNCc2cnn(C)n2)cc1	290093068	JSUBBYJELROQMJ-UHFFFAOYSA-N	245.330	1.171	10	20	BDCD	
CCN(CC)C(=O)c1ccc(C)c(O)c1O	267625146	VUWOVEWWCOWFBM-UHFFFAOYSA-N	223.272	1.888	10	20	BDCD	
CN(Cc1cnn(C)n1)c1ccc2c(c1)OCO2	289396439	RUPKIDGBRQIWJT-UHFFFAOYSA-N	246.270	1.180	10	20	BDCD	
OC[C@@]1(F)CCN(Cc2ccccc2O)C1	802660975	BLBKWHHVDABBEJ-GFCCVEGCSA-N	225.263	1.299	10	20	BDCD	
CC[C@@H](N)CN[C@H](C)c1ccccc1O	817979264	JFSCAKVVELTULP-NXEZZACHSA-N	208.305	1.780	10	20	BDCD	
COC[C@H](O)CNc1ccccc1OCCF	819489404	UQJHDZYMPFPNAK-SNVBAGLBSA-N	243.278	1.454	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H](N)CC(F)F	903884922	HYQOUIGODYEGSR-SNVBAGLBSA-N	244.285	1.807	10	20	BDCD	
CCOc1ccc(CN2CCNCC2)c(O)c1	843044888	KRQGWNPVHAZIBP-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
COc1cccc(O)c1CNC[C@H](C)CN	841049218	OGQICIGNOSNEGF-SECBINFHSA-N	224.304	1.085	10	20	BDCD	
CC1(C(=O)NCc2ccc(O)cc2O)CC1	910950183	FAVJBMOPMUEQAF-UHFFFAOYSA-N	221.256	1.514	10	20	BDCD	
Nc1ccc(CN2CC[C@@H](N3CCCC3)C2)cc1	62977326	SFJLKYLFDXMMDX-OAHLLOKOSA-N	245.370	1.939	10	20	BDCD	
NC[C@H]1CC[C@@H](NCc2cccc(F)c2O)C1	841084531	KHGCNHVDCVFCOF-GXSJLCMTSA-N	238.306	1.748	10	20	BDCD	
C[C@H](NCc1cnon1)c1ccc(N(C)C)cc1	851951559	YTSBUROIKARQMO-JTQLQIEISA-N	246.314	1.986	10	20	BDCD	
CC(C)[C@@H](C(=O)N(C)c1ccc(N)cc1)[C@H](C)N	877076069	LUVAQDZZBUPXEE-GXFFZTMASA-N	249.358	1.851	10	20	BDCD	
Cc1ccc(CN2CCNC(=O)C[C@@H]2C)c(O)c1	877532958	XRMMGXKMOHVEOX-NSHDSACASA-N	248.326	1.411	10	20	BDCD	
Nc1ccc(N2C[C@H]3CCC[C@]3(CO)C2)cc1	409432340	LDJJQSPCVCVCAF-BXUZGUMPSA-N	232.327	1.868	10	20	BDCD	
CCn1ccnc1/C=C/c1cnc(C(=O)O)cn1	1777011987	FGDMXARXLHZNCB-ONEGZZNKSA-N	244.254	1.562	10	20	BDCD	
CN[C@H]1CCCN(Cc2cc(F)ccc2O)C1	219862870	ZBDLGTPZNMLHKF-LBPRGKRZSA-N	238.306	1.715	10	20	BDCD	
COC(CN(C)c1ccc2c(c1)OCO2)OC	136802446	WKCXIDPXPNATOW-UHFFFAOYSA-N	239.271	1.470	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)CCN	236731849	GGQFZUDPZUGBMO-UHFFFAOYSA-N	236.315	1.480	10	20	BDCD	
COC[C@H](CO)NCc1cc(C)c(C)cc1O	279628660	BOGGMAUCHGWPBU-LBPRGKRZSA-N	239.315	1.106	10	20	BDCD	
CCOc1ccc(O)c(CN(CC)CCO)c1	271003239	MAMHUHFLXVDKPK-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
C[C@H](NCCN)c1cc2c(cc1O)CCCC2	817934062	BEQBZTLEMOIZER-JTQLQIEISA-N	234.343	1.880	10	20	BDCD	
CC[C@@H](NCc1cc(C)c(C)cc1O)C(=O)O	818316955	KVQLIXOSOHMTSD-LLVKDONJSA-N	237.299	1.962	10	20	BDCD	
C[C@@H](N=c1nc[nH]n1C)c1ccc(N(C)C)cc1	846750954	JLFUGBZFXXRUQC-SNVBAGLBSA-N	245.330	1.476	10	20	BDCD	
Cc1cccc(CN2CC[C@H]([C@@H](C)N)C2)c1O	843056953	DEEFFOSCOIUEPO-NEPJUHHUSA-N	234.343	1.870	10	20	BDCD	
CCNCCNCc1c(O)ccc(Cl)c1F	841036137	ORUBTBKLAAUNLV-UHFFFAOYSA-N	246.713	1.884	10	20	BDCD	
C[C@@H](NCCC1OCCO1)c1ccccc1O	879649342	NZEKWQIEQAJSBK-SNVBAGLBSA-N	237.299	1.806	10	20	BDCD	
O=C(O)[C@@H](CC(F)F)NCc1ccccc1O	1119536583	MYENRFDUUVUWHD-MRVPVSSYSA-N	245.225	1.590	10	20	BDCD	
Cc1ccc(CN(C)CC[C@H](C)O)c(O)c1	876744763	AQSVVNQBQSCULK-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
Cc1ccc(CNCCC[S@@](C)=O)c(O)c1	877051946	ONETXCLNDLPDIQ-MRXNPFEDSA-N	241.356	1.559	10	20	BDCD	
CN(C)c1ccc(CNCc2cn(C)nn2)cc1	54858938	BAVAWPGPMNBKLO-UHFFFAOYSA-N	245.330	1.171	10	20	BDCD	
CCOC(=O)CN[C@H](C)c1ccccc1O	37472486	JHZCGZYSFVDCEQ-SECBINFHSA-N	223.272	1.606	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H](CO)C2(CCC2)C1	409434002	NWCCHWXIGTWZOQ-VIFPVBQESA-N	210.281	1.391	10	20	BDCD	
Nc1ccc(NC(=O)NCCN2CC=CC2)cc1	1325287384	QWOCYDZNBZXKLR-UHFFFAOYSA-N	246.314	1.262	10	20	BDCD	
Nc1ccc(CNC(=O)NCCC2CC2)cc1	1338551938	PRDGQYVZJCBCEL-UHFFFAOYSA-N	233.315	1.868	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2COC[C@@H]2C)c1	710878285	XIEARKWQNSFWOL-CABZTGNLSA-N	237.299	1.525	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H]2CCCCO2)cc1	50958886	NKZOQPYMCAKNBI-ZDUSSCGKSA-N	248.326	1.497	10	20	BDCD	
CC[C@@H](CO)N[C@@H](C)c1cc(OC)ccc1O	20195331	MBOKSNBRCAFLER-UWVGGRQHSA-N	239.315	1.822	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H](C)CO)c1	35603001	DUYOAJLSKAHSLA-RKDXNWHRSA-N	225.288	1.432	10	20	BDCD	
O=C(O)CCNCc1ccc2c(c1)CCO2	37363015	MAFNRXBEYDZFEN-UHFFFAOYSA-N	221.256	1.186	10	20	BDCD	
C[C@@H](NCCC(=O)O)c1ccc(N(C)C)cc1	37252416	YTXCEIUYJVLBCZ-SNVBAGLBSA-N	236.315	1.878	10	20	BDCD	
C[C@H](CF)NC(=O)c1cccc(O)c1O	288371089	UXIOHQQPYYCXTE-ZCFIWIBFSA-N	213.208	1.186	10	20	BDCD	
CC[C@@H](O)CN[C@@H](C)c1ccc(F)cc1O	229964453	FMWBNHUDXHVKFK-WCBMZHEXSA-N	227.279	1.953	10	20	BDCD	
Nc1ccc(NC(=O)CC[C@H]2CCCN2)cc1	294649134	BSSGQRNEMDOTAL-LLVKDONJSA-N	233.315	1.740	10	20	BDCD	
C[C@H](NC[C@@]1(C)CCC(=O)N1)c1ccccc1O	834907735	AZZKJIDDABMXSU-IINYFYTJSA-N	248.326	1.712	10	20	BDCD	
COC[C@@H](C)NC(=O)NCc1ccccc1O	748451531	SKRCOKDMEMINMZ-SECBINFHSA-N	238.287	1.226	10	20	BDCD	
CC(C)(C)OC(=O)C(=O)Nc1ccc(N)cc1	857762976	KFYDZNJQZJLCNJ-UHFFFAOYSA-N	236.271	1.549	10	20	BDCD	
CC[C@@H](NCc1cc(C)ccc1O)[C@@H](C)O	386712236	PSBIXMMZGFSQIF-ZYHUDNBSSA-N	223.316	1.950	10	20	BDCD	
CCN(CCO)Cc1ccc(N(C)CC)cc1	773748018	LVXUMFUFMGUJOJ-UHFFFAOYSA-N	236.359	1.957	10	20	BDCD	
CN(Cc1nnnn1C1CC1)c1ccc(N)cc1	702053017	FMJOHNBDWMNQAN-UHFFFAOYSA-N	244.302	1.227	10	20	BDCD	
CCc1nc(C(=O)NCc2ccccc2O)co1	773395988	DAYQBNVUYNMFLQ-UHFFFAOYSA-N	246.266	1.873	10	20	BDCD	
CCc1cccc(CN2CC(C)(C(=O)O)C2)c1O	1605830359	JFGIMKHDEVVGAO-UHFFFAOYSA-N	249.310	1.861	10	20	BDCD	
C[C@@H]1C[C@@H]1C(=O)N(C)c1ccc(N)cc1	34939053	DJUZRUTYVGXMKQ-KCJUWKMLSA-N	204.273	1.888	10	20	BDCD	
Cc1cccc(CNCC(=O)NC2CC2)c1O	158692844	AZRZOBDRZRMZAD-UHFFFAOYSA-N	234.299	1.069	10	20	BDCD	
C[C@@H](CO)N[C@H](C)c1ccc(F)cc1O	62745818	PNPUWQFNRGTZNU-JGVFFNPUSA-N	213.252	1.563	10	20	BDCD	
C[C@@]1(NC(=O)c2cccc(O)c2O)CCOC1	126548948	AHTFAHKKMRLGKA-GFCCVEGCSA-N	237.255	1.007	10	20	BDCD	
C[C@H](C(=O)NCc1ccc(O)c(O)c1)C1CC1	182526761	ONUDVEIMGXUKFY-QMMMGPOBSA-N	235.283	1.760	10	20	BDCD	
CN(Cc1cc(F)ccc1O)[C@@H]1CCNC1	220108316	QWQIWMUGIGGBNM-LLVKDONJSA-N	224.279	1.325	10	20	BDCD	
O=C(CCC1CC1)NCc1ccc(O)c(O)c1	272272204	DJIIVXGHFOSHBE-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
O=C(NCc1ccccc1O)NOCC1CC1	297545340	ZDOFSZQWMQIGBW-UHFFFAOYSA-N	236.271	1.533	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC/C=C/CO)c1	717544768	CEHAJSXPMHGJDA-HMDXOVGESA-N	237.299	1.600	10	20	BDCD	
C[C@H](CN)CN[C@H](C)c1cc(F)ccc1O	817962473	MTBXEYZVGZKRDF-RKDXNWHRSA-N	226.295	1.777	10	20	BDCD	
C[C@H](NC1CNC1)c1cc(F)cc(F)c1O	817956114	QXRHFSCZKXVYCS-LURJTMIESA-N	228.242	1.293	10	20	BDCD	
COCCNC(=S)NCc1ccccc1O	748156347	FKJVVDZONLGVTA-UHFFFAOYSA-N	240.328	1.003	10	20	BDCD	
C[C@H](N)C[C@H](C)NC(=O)Cc1ccc(N)cc1	843503277	JTDPUANMNLLOTO-UWVGGRQHSA-N	235.331	1.053	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@H]2C[C@H]1C(=O)O2	877561847	SUMULGCDIYZXFP-KOLCDFICSA-N	233.267	1.200	10	20	BDCD	
Cc1ccc(CN2CC(=O)N(C)C[C@@H]2C)c(O)c1	877461307	DKKGRLHHCVWKEH-NSHDSACASA-N	248.326	1.363	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1C[C@H]1C(=O)O	37835651	OTWNDXTWODGLKE-VHSXEESVSA-N	249.266	1.071	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC[C@@H](C(F)F)C1	409428371	MHUGIWLSABVZOZ-ZCFIWIBFSA-N	218.207	1.800	10	20	BDCD	
CCOC[C@H]1CCN(C(=O)CN=[N+]=[N-])C1	409429615	OWVCQQKXWZYCPP-QMMMGPOBSA-N	212.253	1.182	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2CCCN2C)cc1	221162815	USGLSNQBJOSJRG-OAHLLOKOSA-N	247.386	1.936	10	20	BDCD	
CCc1cccc(CNCC(F)(F)CO)c1O	691515308	VQENHFCQVJIZFU-UHFFFAOYSA-N	245.269	1.672	10	20	BDCD	
CC[C@@H](OC(=O)c1cccc(O)c1O)C(=O)O	1605121108	WRNBYLPVYLIDIJ-MRVPVSSYSA-N	240.211	1.118	10	20	BDCD	
CN(C)c1ccc(CNC(=O)c2cnc[nH]2)cc1	169932334	FBJAUDRGBOYMAH-UHFFFAOYSA-N	244.298	1.406	10	20	BDCD	
O[C@H]1C[C@@H](NCc2ccc(N3CCCC3)cc2)C1	1261256852	WIGSNVGSPCPCFF-OTVXOJSOSA-N	246.354	1.900	10	20	BDCD	
COc1cccc(CNCCC[C@H](C)O)c1O	227954031	WLJGMXCAVOHHEB-JTQLQIEISA-N	239.315	1.651	10	20	BDCD	
Cc1cccc(CNCc2cocn2)c1O	309730195	ZNTQBONKNUNUMG-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
COc1ccc(CNCCCO)cc1C	35052471	UXFULRRWNQVEBH-UHFFFAOYSA-N	209.289	1.476	10	20	BDCD	
CNc1cc(Nc2ccc(N)cc2)ncn1	258713511	SSZTWJDKXLHAIM-UHFFFAOYSA-N	215.260	1.844	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccccn1	82278743	GVEZYNXOSZAIKT-UHFFFAOYSA-N	228.251	1.717	10	20	BDCD	
CC(C)(O)CNCc1cccc(Cl)c1O	162864170	LKEVNRRPHAMGJF-UHFFFAOYSA-N	229.707	1.906	10	20	BDCD	
CN(CC(N)=O)Cc1ccc2ccccc2c1O	816484602	IQWYJEOWHUXCNF-UHFFFAOYSA-N	244.294	1.463	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2C[C@@H](O)C2)cc1Cl	826100516	QKGZMLNXEKKTOD-AOOOYVTPSA-N	241.718	1.967	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)CCN)c1	841051402	OKGNPHDKSNQBRV-JTQLQIEISA-N	208.305	1.528	10	20	BDCD	
CC1(C)CN(Cc2ccc(N)cc2)C[C@H]1O	387663660	HMSYEIWAFMGBQW-GFCCVEGCSA-N	220.316	1.472	10	20	BDCD	
CNCCCNCc1cc(Cl)cc(F)c1O	841042009	KRVTWBKNVQAQRR-UHFFFAOYSA-N	246.713	1.884	10	20	BDCD	
CC[C@](C)(O)CNC(=O)c1cc(O)cs1	748355409	KEQXIGHXBDVQLA-JTQLQIEISA-N	229.301	1.345	10	20	BDCD	
Cc1ccc(O)c(CN2CCc3c[nH]nc3C2)c1	769469063	RFMMUKZWFOEEQR-UHFFFAOYSA-N	243.310	1.982	10	20	BDCD	
CC(C)[C@H](O)CNC(=O)c1cc(O)cs1	771051821	BQMFTIFCMGTJCX-MRVPVSSYSA-N	229.301	1.200	10	20	BDCD	
C[C@@H](N[C@@H]1CCOC1=O)c1ccc(N(C)C)cc1	774481032	HBPYPHCFSVIIGM-ZWNOBZJWSA-N	248.326	1.719	10	20	BDCD	
CC[C@H](CCO)NCc1c(C)cccc1O	877055582	QIFCVYKRHSAHDW-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1C[C@H](O)C1(C)C	877430386	HHFMRSIEBWHOAI-STQMWFEESA-N	235.327	1.950	10	20	BDCD	
NCCCCN[C@@H]1CCc2cccc(O)c21	393759748	KGWDURNOVZNCRP-LLVKDONJSA-N	220.316	1.708	10	20	BDCD	
CC1(C(=O)NCc2cccc(O)c2O)CC1	1528770888	FDIFAVDAOLITFV-UHFFFAOYSA-N	221.256	1.514	10	20	BDCD	
CCOCCNCc1cc(F)ccc1O	226619316	UKRXCKPBELERKM-UHFFFAOYSA-N	213.252	1.657	10	20	BDCD	
OCCCCNCc1c(O)cccc1Cl	236499032	NGSOSTYFRAVDNC-UHFFFAOYSA-N	229.707	1.908	10	20	BDCD	
CCN[C@@H](C)C(=O)N(C)Cc1ccccc1O	707977969	DCYYMNLZHLDGPZ-JTQLQIEISA-N	236.315	1.349	10	20	BDCD	
O=C(N[C@H]1CC12CCC2)c1cccc(O)c1O	721151594	UWVKORMRFKJCLH-JTQLQIEISA-N	233.267	1.770	10	20	BDCD	
CC[C@@H](Sc1nccs1)C(N)=O	61680124	RICVZKVBGVEZAS-RXMQYKEDSA-N	202.304	1.499	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C[C@H]2CCC[C@H]2C1	126504967	DILCPHXNVLVRLD-AOOOYVTPSA-N	247.294	1.970	10	20	BDCD	
CCNC(=O)CN(C)Cc1cccc(C)c1O	124559509	ZZWJMOBNWRWBDS-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
COCCN(C)Cc1cccc(OC)c1O	132707986	WFCZDYAJNZBWSD-UHFFFAOYSA-N	225.288	1.479	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@@H]1O	190057250	BBXURCOIUWHRRZ-WFASDCNBSA-N	248.370	1.955	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1(N)CCC1	147976677	PJRFMYLCXZJESU-UHFFFAOYSA-N	234.299	1.232	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@@H](C)CN)c1	382993413	FNSGCDVBUFZTHI-VIFPVBQESA-N	224.304	1.180	10	20	BDCD	
Cc1ccc(O)c(CN(C)C[C@@H](C)C(=O)O)c1	86807683	XHKNEGWLTFCVRC-SNVBAGLBSA-N	237.299	1.853	10	20	BDCD	
CC(=O)NCc1ccc(N(C)C)c(F)c1	299345211	RHCOYDDLCOYMNI-UHFFFAOYSA-N	210.252	1.528	10	20	BDCD	
Cc1cc(O)c(CN(C)CCN)cc1C	841100043	DAQAQUFLSCEYLZ-UHFFFAOYSA-N	208.305	1.400	10	20	BDCD	
CC[C@H](N)CNCc1cccc(Cl)c1O	841071340	DIWCNMZYVQXFEE-VIFPVBQESA-N	228.723	1.873	10	20	BDCD	
Nc1ccc(CCNCC2=CCCOC2)cc1	863642044	PHTKDIKRUMHRRF-UHFFFAOYSA-N	232.327	1.748	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)NC1CC=CC1	779531955	MGXLZDZYTSWZGW-VURMDHGXSA-N	245.278	1.946	10	20	BDCD	
Cc1cccc(CN2CCNC(C)(C)C2)c1O	775665923	NUKKXBASZKYQTG-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)C1CCC1	158202835	AIAXXOONSQJHSN-UHFFFAOYSA-N	218.300	1.822	10	20	BDCD	
CCCCC(=O)NCc1ccc(O)c(O)c1	158895923	TVXJSOOVJXBRRZ-UHFFFAOYSA-N	223.272	1.904	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCNC2(C)C)cc1	841087784	XCBIIQKPFLNTMH-AWEZNQCLSA-N	247.386	1.983	10	20	BDCD	
C[C@H](N[C@H]1CCc2cccc(O)c21)C(=O)N(C)C	296485260	PHRCNGIOLKTTJG-ONGXEEELSA-N	248.326	1.446	10	20	BDCD	
Oc1ccc(F)cc1CN[C@@H]1CCC[C@H]1O	309517090	AGIRNMABKNTSKJ-ZYHUDNBSSA-N	225.263	1.534	10	20	BDCD	
C[C@@]1(CNCc2ccccc2O)CCOC1	309824823	XCXHKFQJVGZECH-ZDUSSCGKSA-N	221.300	1.908	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)c2n[nH]c(C)n2)c1	392370902	LGKSHBYDPJSUPE-SECBINFHSA-N	246.314	1.978	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H](C)CO)c(O)c1	35602321	VXJYERNHSDQEKW-NXEZZACHSA-N	209.289	1.732	10	20	BDCD	
Nc1ccc(N2CC[C@](O)(C(F)(F)F)C2)cc1	380226631	XADILDHWWNFSML-SNVBAGLBSA-N	246.232	1.772	10	20	BDCD	
C[C@H](O)CN(C)Cc1cccc(F)c1O	291032120	FHCDIKSGRQHBJV-QMMMGPOBSA-N	213.252	1.344	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C(=O)C(C)(C)C	735850686	ZGSYIQBWIJRELQ-UHFFFAOYSA-N	249.310	1.966	10	20	BDCD	
CC1=NO[C@@H](C(=O)N(C)Cc2ccccc2O)C1	830140975	LEVYGUJEEJODNK-GFCCVEGCSA-N	248.282	1.515	10	20	BDCD	
O=C(OCCCCO)c1cc(O)cs1	733497334	TUUCYWFERBQLHC-UHFFFAOYSA-N	216.258	1.383	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCC[C@@H](N)C1	843047333	LVDJSYJFNHSKBG-CQSZACIVSA-N	247.386	1.984	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCCNC(=O)C2)c1	877652569	KUTZFJIOQNROJL-LBPRGKRZSA-N	248.326	1.459	10	20	BDCD	
Cc1ccc(CNCCC(C)(C)O)c(O)c1	877421788	NXROYYIGNOBLJN-UHFFFAOYSA-N	223.316	1.951	10	20	BDCD	
CC(=O)NCCN(C)Cc1ccc(C)cc1O	877605769	IFFMYIZQXONSEI-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
COC[C@@H](C)CNCc1cccc(OC)c1O	45656413	GDDQTNNJJKFEHD-JTQLQIEISA-N	239.315	1.773	10	20	BDCD	
CN1CCCC[C@@H]1C(=O)NCc1ccccc1O	731872987	VCENYBVUPQGINV-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
O[C@@H]1CC[C@H](CNCc2ccc3c(c2)CCO3)C1	188849994	TWVHGIWHVVOUHV-GXTWGEPZSA-N	247.338	1.872	10	20	BDCD	
CO[C@@H](C)[C@H](C)NC(=O)Cc1ccc(N)cc1	832166561	OAMGPWUZHKPVGG-UWVGGRQHSA-N	236.315	1.351	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@@H]1COCCO1)CC2	386534189	PRSZTEAAHPQUPJ-NEPJUHHUSA-N	249.310	1.385	10	20	BDCD	
C[C@@H](NC(=O)CN(C)C)c1ccccc1O	827930431	KCSWUTPAISXBCW-SECBINFHSA-N	222.288	1.131	10	20	BDCD	
CN(CCn1cccn1)Cc1cc(F)ccc1O	180146789	YEHLOPZURKLOTM-UHFFFAOYSA-N	249.289	1.860	10	20	BDCD	
OC[C@@H]1CCCN(Cc2ccccc2O)C1	124985068	VWOKGBNPRSQDFQ-LLVKDONJSA-N	221.300	1.597	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)C[C@H](C)O)c1	228086017	ZFMRZCCVIVUSTI-UWVGGRQHSA-N	239.315	1.650	10	20	BDCD	
O=C(NCC(F)F)c1cccc(O)c1O	163275875	UXCHWCUGZQJPHU-UHFFFAOYSA-N	217.171	1.093	10	20	BDCD	
CC(C)ONC(=O)c1cccc(O)c1O	294064688	KITCLEHLNPYJCB-UHFFFAOYSA-N	211.217	1.168	10	20	BDCD	
O=C(NCc1ccccc1O)c1cc(F)c[nH]1	815833614	WLQKOBBXCGNEFF-UHFFFAOYSA-N	234.230	1.789	10	20	BDCD	
N[C@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)C1	906518000	MNIOBRYYZLGTHE-LJGSYFOKSA-N	244.697	1.764	10	20	BDCD	
CCOc1ccc(CN[C@@H](C)CN)c(O)c1	841064210	VQNDBWZDISUWSS-VIFPVBQESA-N	224.304	1.228	10	20	BDCD	
C[C@H](OCC1CC1)C(=O)NCc1ccccc1O	748346522	KANAWQPLRSUAHT-JTQLQIEISA-N	249.310	1.824	10	20	BDCD	
COc1ccc(CNC(=N)N(C)C2CC2)c(O)c1	849024998	IZOFPJZSEFJSKO-UHFFFAOYSA-N	249.314	1.519	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@@H]1CCCNC1	841041643	CLGKMOWLSHMUMG-LLVKDONJSA-N	240.734	1.887	10	20	BDCD	
NC[C@@H]1CC[C@H](NCc2cc(F)ccc2O)C1	841085155	VQOPANUXHMOCCO-SKDRFNHKSA-N	238.306	1.748	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1=CCCCO1	910950160	DIZQJSOVSGEEMJ-UHFFFAOYSA-N	249.266	1.408	10	20	BDCD	
Cc1ccc(CN(C)CCCO)c(O)c1	877498247	AESNRYTYYFPVOH-UHFFFAOYSA-N	209.289	1.515	10	20	BDCD	
CC[C@H](CO)C(=O)N(C)Cc1ccccc1O	779645237	WMEUTDAUQWBZDH-SNVBAGLBSA-N	237.299	1.369	10	20	BDCD	
Cc1cccc(CN[C@H]2CCOC2=O)c1O	895801784	LTJVACNPMZYZPM-JTQLQIEISA-N	221.256	1.106	10	20	BDCD	
COc1ccc(CNC(=O)c2ccoc2)c(O)c1	794386800	AWLCHIZQXGDAHO-UHFFFAOYSA-N	247.250	1.924	10	20	BDCD	
COc1ccc(CNC(=O)C2(C)CC2)c(O)c1	794391314	VYWYGTHKTTUGIM-UHFFFAOYSA-N	235.283	1.817	10	20	BDCD	
CC/C=C(\F)C(=O)NCc1cccc(O)c1O	1349076967	AXSWDCITKHNFCM-WTKPLQERSA-N	239.246	1.977	10	20	BDCD	
C[S@@](=O)CCNCc1c(O)cccc1Cl	124176395	JIANMAWXBVUSJN-HNNXBMFYSA-N	247.747	1.514	10	20	BDCD	
CO[C@H](C)C(=O)N[C@H](C)c1ccccc1O	827930226	FJXLTLNFXKAGFR-RKDXNWHRSA-N	223.272	1.604	10	20	BDCD	
CN(CC(=O)N1CCCC1)Cc1ccccc1O	121145340	GLNUAGICQSGJAZ-UHFFFAOYSA-N	248.326	1.446	10	20	BDCD	
COc1ccc(N(C)CC[C@@H](C)O)cc1	49971350	UOQWLEXUKVFLBC-SNVBAGLBSA-N	209.289	1.902	10	20	BDCD	
CN[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1	133054425	MQQPAXQVOOYFFT-ZDUSSCGKSA-N	247.342	1.022	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2C(=O)NCC[C@@H]2C)c1	193692272	UIIMQPUZGSFFKD-GWCFXTLKSA-N	248.326	1.315	10	20	BDCD	
CN/C(C)=C(/C(=O)OC)c1cc(O)ccc1O	103638481	BIOSDAQORNLDHA-YRNVUSSQSA-N	237.255	1.221	10	20	BDCD	
CO[C@H](C)CC(=O)NCc1ccc(O)cc1O	910956764	YVOBXRTZRNANDY-MRVPVSSYSA-N	239.271	1.139	10	20	BDCD	
Nc1ccc(-n2cc(CC3(O)CCC3)nn2)cc1	849134326	DRCSGVDZKJKRDM-UHFFFAOYSA-N	244.298	1.307	10	20	BDCD	
Cc1cccc(O)c1CN1CCn2ncnc2C1	877406212	SAXUFOKDSXGGHY-UHFFFAOYSA-N	244.298	1.308	10	20	BDCD	
CCN(C(=O)CN=[N+]=[N-])[C@H]1CCSC1	409425977	BQGKVKPQCQDSHN-ZETCQYMHSA-N	214.294	1.651	10	20	BDCD	
O[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1	1324716956	STILPYBQCLSXNP-HNNXBMFYSA-N	246.354	1.853	10	20	BDCD	
CC[C@]1(C(=O)N(C)c2ccc(N)cc2)CCNC1	1330625537	ONUIDWMSPZTDOW-AWEZNQCLSA-N	247.342	1.621	10	20	BDCD	
C[C@@H](NC(=O)C1(N)CCCC1)c1ccccc1O	877255466	DSGNVDJKVALNNE-SNVBAGLBSA-N	248.326	1.841	10	20	BDCD	
C[C@@H](CC(=O)O)NCc1cc(F)ccc1O	1603132618	BYZSOWOLCMCSKW-ZETCQYMHSA-N	227.235	1.484	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCCNC2)c1O	841041672	DIYYBWKVBKNBDE-GFCCVEGCSA-N	220.316	1.542	10	20	BDCD	
CO[C@H]1C[C@H](NCc2ccccc2O)C1	706538727	FQHYPFJLISJBTP-XYPYZODXSA-N	207.273	1.659	10	20	BDCD	
C[C@@H]1NCCN(Cc2ccccc2O)[C@@H]1C	379445589	WWYVHIASCSBOMC-WDEREUQCSA-N	220.316	1.574	10	20	BDCD	
COc1cccc(CNC(=O)c2cocn2)c1O	105650393	NHKHKPOTOBWJGH-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
C[C@@H](CF)NC(=O)c1cccc(O)c1O	288371086	UXIOHQQPYYCXTE-LURJTMIESA-N	213.208	1.186	10	20	BDCD	
C[C@H](NCc1ncn(C)n1)c1ccccc1O	228802358	AAVDYKSVZNAFCS-VIFPVBQESA-N	232.287	1.372	10	20	BDCD	
Cc1cc(O)c(CN[C@]2(C)CCOC2=O)cc1C	289724953	GGSRHVYKDSQHRN-CQSZACIVSA-N	249.310	1.804	10	20	BDCD	
CS[C@H](C)C(=O)NCc1ccc(N)cc1	297309782	WBLVTAZMJCASSM-MRVPVSSYSA-N	224.329	1.637	10	20	BDCD	
Cc1cccc(CN2C[C@@H](O)C[C@@H](C)C2)c1O	825315437	AIHNEIBMDTYFCY-MFKMUULPSA-N	235.327	1.903	10	20	BDCD	
CCN(CCC(=O)O)C(=O)c1cc(O)cs1	829701929	TZSNWVJKUJONHL-UHFFFAOYSA-N	243.284	1.391	10	20	BDCD	
COc1cccc([C@H](C)N[C@@H]2CCOC2)c1O	846158497	ZWTBGEHJIMZEKJ-VHSXEESVSA-N	237.299	1.840	10	20	BDCD	
CCOc1cccc(CNCC(C)(C)N)c1O	841030474	ILVMFZBBXLJTCQ-UHFFFAOYSA-N	238.331	1.618	10	20	BDCD	
O=C(NCC1(O)CCC1)c1cc(O)cs1	748355330	JOTVMAPLRYLDLX-UHFFFAOYSA-N	227.285	1.099	10	20	BDCD	
CC(=O)C(=O)CSc1ccc(C)nn1	882128394	XKXLUEJEJLODTI-UHFFFAOYSA-N	210.258	1.035	10	20	BDCD	
C[C@@H](NC(=O)NCC1(N)CC1)c1ccccc1O	1120572919	FENBBFOQZKLLQE-SECBINFHSA-N	249.314	1.244	10	20	BDCD	
COc1ccc(N(C)CC(=O)O)cc1OC	49819943	HXEMXUVOZMJUHV-UHFFFAOYSA-N	225.244	1.225	10	20	BDCD	
C[C@@]1(NC(=O)Nc2ccc(N)cc2)CCOC1=O	1576542263	VJFUSCWCPNYDDR-GFCCVEGCSA-N	249.270	1.096	10	20	BDCD	
C[C@@H](NCc1ccc2c(c1)CCO2)[C@@H](C)C(=O)O	901443926	BRGRNHOYYKWIOT-NXEZZACHSA-N	249.310	1.820	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN1C	299548735	QFVFSXDECYYDOV-LBPRGKRZSA-N	248.326	1.445	10	20	BDCD	
CN(CCCN)Cc1cccc(Cl)c1O	381723516	MFZMAAMDOJQLSU-UHFFFAOYSA-N	228.723	1.826	10	20	BDCD	
COCCNCc1ccc2c(c1)CCO2	37362329	LRPIOJSJHLZCIG-UHFFFAOYSA-N	207.273	1.358	10	20	BDCD	
CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1	253490098	HLRBVSOSUNDTBY-ZETCQYMHSA-N	209.245	1.165	10	20	BDCD	
Cc1ccc(C(=O)N2CC[C@H](C)C2)c(O)c1O	271266731	KYGUUEBSIWBKRL-QMMMGPOBSA-N	235.283	1.888	10	20	BDCD	
C[C@@H](N[C@@H]1CCNC1)c1ccc(F)cc1O	817945070	SPMLADFWIXWHQA-PSASIEDQSA-N	224.279	1.544	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)CN2CCCC2)c1	824904592	SCONINKMJRMPAE-UHFFFAOYSA-N	248.326	1.413	10	20	BDCD	
Oc1cccc(Cl)c1CNC1CCNCC1	841027191	ZITRBNIJOPKUNR-UHFFFAOYSA-N	240.734	1.887	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)NC(C)C)c1	858086477	JAXLBMFERJJRQC-UHFFFAOYSA-N	222.288	1.908	10	20	BDCD	
COC(=O)NC[C@H](N)c1ccc(N(C)C)cc1	876501228	KZHCEMBQYPXDAL-NSHDSACASA-N	237.303	1.108	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1C[C@@H](O)C1(C)C	877430383	HHFMRSIEBWHOAI-CHWSQXEVSA-N	235.327	1.950	10	20	BDCD	
Nc1ccc(CNC(=O)N2CCCOCC2)cc1	1120592200	RUULQVIXVAHVIJ-UHFFFAOYSA-N	249.314	1.201	10	20	BDCD	
Cc1noc(CN[C@H](C)c2ccccc2O)n1	38034420	QLIZEARFCGBWOS-MRVPVSSYSA-N	233.271	1.934	10	20	BDCD	
Cc1cccc(CN2CC[C@H](C(=O)O)[C@H]2C)c1O	1600532812	WRXPQWFWSCIUNR-PWSUYJOCSA-N	249.310	1.996	10	20	BDCD	
CO[C@@H]1CC[C@H](NC(=O)Cc2ccc(N)cc2)C1	234921064	DFSQQNWBROWMNB-QWHCGFSZSA-N	248.326	1.495	10	20	BDCD	
Nc1ccc(CNC(=O)C2CC(F)(F)C2)cc1	383411759	XCMYORBGFOYFCV-UHFFFAOYSA-N	240.253	1.930	10	20	BDCD	
C[C@@H](N[C@H]1CCNC(=O)CC1)c1ccccc1O	396670720	YNNYPGLOUXRISB-GHMZBOCLSA-N	248.326	1.712	10	20	BDCD	
Oc1ccccc1CNCC1(O)CCOCC1	112717343	UROZKDYBRUTBNL-UHFFFAOYSA-N	237.299	1.023	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](N)[C@H](C)C2)c1	300050388	ZKHSCGZQBRARRE-ZYHUDNBSSA-N	220.316	1.480	10	20	BDCD	
Oc1cc2c(cc1CNCC(F)F)OCO2	147313172	FWXSRHIKOJAWHU-UHFFFAOYSA-N	231.198	1.476	10	20	BDCD	
CN(CCN)Cc1c(O)cccc1Cl	128321604	BUCOYWANFYBZFO-UHFFFAOYSA-N	214.696	1.436	10	20	BDCD	
O=C(O[C@@H]1CCOC1)c1cc(O)cs1	837512727	CQIGFOCMFVPVSW-SSDOTTSWSA-N	214.242	1.399	10	20	BDCD	
CCCC(=O)NC[C@H](N)c1ccc(N(C)C)cc1	832286103	WDLJSLLOJJQORV-ZDUSSCGKSA-N	249.358	1.669	10	20	BDCD	
O=C(CC(F)(F)F)NCc1ccc(O)cc1O	910952457	UOUBRWZUZNBLLM-UHFFFAOYSA-N	249.188	1.666	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCCC[C@H]2N)cc1	911661857	YJGIMRZYMLYHNZ-NWDGAFQWSA-N	233.315	1.725	10	20	BDCD	
Cc1ccc(CNCc2ccon2)c(O)c1	877076196	NUHUELYXBSHYDT-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
CO[C@@H]1CN(Cc2cccc(C)c2O)CCO1	895968197	JLVXSDAOQPGYRC-LBPRGKRZSA-N	237.299	1.505	10	20	BDCD	
Cc1cnn(C)c1/C=C1\SC(=S)NC1=O	794687040	FBVDIGFFZJZXBI-CLTKARDFSA-N	239.325	1.217	10	20	BDCD	
CN(Cc1ccccc1O)CC1(O)CCC1	757845278	RXWMSCIMTJXNNZ-UHFFFAOYSA-N	221.300	1.739	10	20	BDCD	
C[C@H](N)[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1	156759727	XSTOFIDUSPSWHN-MNOVXSKESA-N	249.358	1.352	10	20	BDCD	
Cn1cnc(CN[C@@H]2CCc3cccc(O)c32)c1	903351111	HGSJBNARLGWKSI-GFCCVEGCSA-N	243.310	1.903	10	20	BDCD	
O[C@H]1C[C@@H](CNCc2ccc3c(c2)CCCO3)C1	922293590	LEIGUTKBZBNSMH-XBXGTLAGSA-N	247.338	1.872	10	20	BDCD	
CN1CCC[C@@H]1CNC(=O)Nc1ccc(N)cc1	226086998	ZIUBKZYTGDRNGM-GFCCVEGCSA-N	248.330	1.485	10	20	BDCD	
CCC[C@@H]1C(=O)NCCN1Cc1ccccc1O	179582459	KRJZDHBXPKSMSC-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
CCNC(=O)[C@H](C)NCc1ccc2c(c1)CCO2	37363102	HXXFCZWSUXMNHM-JTQLQIEISA-N	248.326	1.236	10	20	BDCD	
CNC[C@H](C)NCc1ccc2c(c1)CCCO2	229101103	UQTCECHVDJXCHH-NSHDSACASA-N	234.343	1.709	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c1	817978193	XYIVZXFHGNSNBC-XFOOOJQKSA-N	248.326	1.269	10	20	BDCD	
C[C@H]1CN(C(=O)c2cc(O)cs2)[C@H](C)CO1	731868505	HAZFGEBOASWYFR-SFYZADRCSA-N	241.312	1.703	10	20	BDCD	
COc1cccc(CN[C@H](CN)C2CC2)c1O	841028677	QNWADTKVLICLIG-LLVKDONJSA-N	236.315	1.228	10	20	BDCD	
CCc1cccc(CN2CCC[C@H]2CO)c1O	848883086	JAUQUCYTZBHTPT-ZDUSSCGKSA-N	235.327	1.911	10	20	BDCD	
Cc1cccc(CNC[C@H](N)C(C)C)c1O	841031022	QWKKRAHVTBSCSK-LBPRGKRZSA-N	222.332	1.774	10	20	BDCD	
CCOc1ccc(CN(C)C[C@@H](C)O)c(O)c1	776520803	GTSQWPRRNIFAPI-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
CCOC[C@H]1CC(F)(F)CN1C(=O)CN=[N+]=[N-]	409428990	HDSVMMRCOZQJHK-SSDOTTSWSA-N	248.233	1.569	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2cccs2)C1	409423475	ONZTVFVMSWGDIV-UHFFFAOYSA-N	208.246	1.883	10	20	BDCD	
CCN(C)CCNCc1cccc(C)c1O	162833599	WSCWQTCQVNHOJG-UHFFFAOYSA-N	222.332	1.742	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2cc(F)ccc2O)CO1	402183637	BQCFVGZFAGROPQ-LDYMZIIASA-N	225.263	1.798	10	20	BDCD	
CC[C@H](COC)NCc1cc(OC)ccc1O	79732928	PFPUQDSLZDIWCX-LLVKDONJSA-N	239.315	1.915	10	20	BDCD	
O=C(NCc1ccon1)c1cccc(O)c1O	126494422	OGYMUIMQGWOYSK-UHFFFAOYSA-N	234.211	1.016	10	20	BDCD	
C[C@H](NC[C@@H](C)O)c1ccc(N(C)C)cc1	37257684	CZLVRXCMSXZNIW-MNOVXSKESA-N	222.332	1.784	10	20	BDCD	
CC[C@@H](CO)NCc1c(O)cccc1OC	381538869	GVOIFEWLNZRQOX-VIFPVBQESA-N	225.288	1.261	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](C)CCO)c1	97436197	PQMBMGKLRGJOEL-SNVBAGLBSA-N	239.315	1.509	10	20	BDCD	
O=C(OCC(=O)C(F)F)c1cccc(O)c1O	800203961	VNUZANHLLSGHEF-UHFFFAOYSA-N	246.165	1.089	10	20	BDCD	
COc1cccc(CNCc2nonc2C)c1O	809743950	NYTVGODVVPEHJY-UHFFFAOYSA-N	249.270	1.382	10	20	BDCD	
C[C@H](CN)N(C)Cc1c(O)ccc(Cl)c1F	843053182	YYDLQDPBHQJDMF-SSDOTTSWSA-N	246.713	1.964	10	20	BDCD	
Cc1cc(CC(=O)NCc2ccccc2O)n[nH]1	755768363	MGXVYUJDNANWIY-UHFFFAOYSA-N	245.282	1.283	10	20	BDCD	
Cn1nccc1COC(=O)c1cccc(O)c1O	758562428	RHLFYVAYMZSSKQ-UHFFFAOYSA-N	248.238	1.188	10	20	BDCD	
Cc1ccc(O)c(CNC2CC(C(=O)O)C2)c1	874055518	BOTAWJIZEFLHNX-UHFFFAOYSA-N	235.283	1.653	10	20	BDCD	
O=C(O)[C@@H](F)CNCc1ccc2c(c1)CCO2	1119613544	JKWNBSOUYXFMCE-JTQLQIEISA-N	239.246	1.134	10	20	BDCD	
CSCCONC(=O)c1cc(O)cs1	795877970	BTBMRCHGKBJKAR-UHFFFAOYSA-N	233.314	1.478	10	20	BDCD	
COc1ccc(O)c(CNC[C@H]2CCOC2)c1	37738331	SIFKFWMOXHDSLH-SNVBAGLBSA-N	237.299	1.527	10	20	BDCD	
CCOC[C@H](O)CN(C)c1ccc(N)cc1	702126396	NZJRMUVGGXLVIM-GFCCVEGCSA-N	224.304	1.102	10	20	BDCD	
CNC[C@H](C)CNCc1ccc(N(C)C)cc1	1261370684	QTDIDKLQTFDMLL-LBPRGKRZSA-N	235.375	1.698	10	20	BDCD	
CC(C)C(=O)NCCN(C)Cc1ccc(N)cc1	1345159485	HUIQXWQLJMYKGU-UHFFFAOYSA-N	249.358	1.473	10	20	BDCD	
COc1cccc(O)c1CNCCCCN	1117953388	FYBLBEOQECFPTQ-UHFFFAOYSA-N	224.304	1.229	10	20	BDCD	
C[C@@H](NC(=O)Cc1ccc(N)cc1)[C@H]1CCCO1	35734287	DUMWFFAUTPHGDB-ZWNOBZJWSA-N	248.326	1.495	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)C[C@@H](C)N1	204050532	SKSZCTZKEAAKHM-GHMZBOCLSA-N	219.332	1.451	10	20	BDCD	
COCCOc1ccccc1NC[C@@H](C)O	819428370	ZSKCPMHULHUXIY-SNVBAGLBSA-N	225.288	1.505	10	20	BDCD	
Nc1ccc(CC(=O)NCCC(F)F)cc1	309418159	XQIIYRZOYDIWSJ-UHFFFAOYSA-N	228.242	1.583	10	20	BDCD	
CC1(C)CN(Cc2ccc(N)cc2)CC[C@H]1O	310115471	RYQXRPSYBOECIJ-CYBMUJFWSA-N	234.343	1.862	10	20	BDCD	
C[C@@H]1C[C@@H](N)CN1Cc1ccc(N(C)C)cc1	702668274	JJOZGPLCTDLMAC-DGCLKSJQSA-N	233.359	1.674	10	20	BDCD	
CCNC(=O)N[C@H](C)c1cc(OC)ccc1O	171730853	PWYLEJUGYLKTTO-MRVPVSSYSA-N	238.287	1.781	10	20	BDCD	
Cc1ccc(C(=O)N2CCCC2)c(O)c1O	177658701	LLHJWPWYJJHWRJ-UHFFFAOYSA-N	221.256	1.642	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2CC[C@H](O)C2)c1	188839850	SEALPYKZKNKIRV-YPMHNXCESA-N	235.327	1.951	10	20	BDCD	
CSCCNC(=O)c1cc(O)cs1	379373241	KWOIYNLKCMXRAL-UHFFFAOYSA-N	217.315	1.547	10	20	BDCD	
O=C(NCCNCc1ccccc1O)C1CC1	134225314	NXRLNYPGJBZVDG-UHFFFAOYSA-N	234.299	1.008	10	20	BDCD	
Cc1cccc(CN2CCC[C@@H]2CO)c1O	132486436	COAOLCAPPABMIQ-GFCCVEGCSA-N	221.300	1.657	10	20	BDCD	
C[C@@H](CSc1nccs1)C(=O)O	40676373	JVSUBDYHIZYBRM-YFKPBYRVSA-N	203.288	1.956	10	20	BDCD	
C[C@H](NCCOCCO)c1cc(F)ccc1O	94616989	GYJUOJDNJIMMKP-VIFPVBQESA-N	243.278	1.191	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](CO)C2)c1	92764595	VEQYQCRGMKYXLI-NSHDSACASA-N	221.300	1.515	10	20	BDCD	
CN(C)c1ccc(CNC(=O)c2cocn2)cc1	729303279	KBMXOHJFJLXUII-UHFFFAOYSA-N	245.282	1.671	10	20	BDCD	
O=C(O)[C@H]1CCN(Cc2cccc(F)c2O)C1	821511329	HZSUTJGSWYQUSW-VIFPVBQESA-N	239.246	1.438	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H]1C[C@@H](O)C1	862528244	RGKFRYFPBHAAOK-JNSHFYNHSA-N	248.370	1.922	10	20	BDCD	
CC[C@@H](NC)C(=O)N(C)c1ccc(N)cc1	877074166	APMFCCULQPHAKX-LLVKDONJSA-N	221.304	1.230	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H](O)C2CC2)cc1	71277939	GCBODMMHKCNRQU-CQSZACIVSA-N	234.343	1.613	10	20	BDCD	
CC1(CO)CCN(c2ccc(N)cc2)CC1	403075512	YLOYFGOGMPCHMC-UHFFFAOYSA-N	220.316	1.868	10	20	BDCD	
Cc1cccc(CN2CC(C)(C(=O)O)C2)c1O	1600532851	YGRVQFFLUNTNSN-UHFFFAOYSA-N	235.283	1.607	10	20	BDCD	
CCc1cccc(CN[C@@H](C(=O)O)C2CC2)c1O	1597586274	DFLOXHVVBKMWKD-GFCCVEGCSA-N	249.310	1.907	10	20	BDCD	
Cc1nnc(NCc2ccccc2O)nc1C	159097489	ZXXCZNQQXJDBHI-UHFFFAOYSA-N	230.271	1.806	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CO[C@@H](C)C2)c1	402034277	CHRMXFAJHIHYHB-JQWIXIFHSA-N	221.300	1.968	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC[C@H]2C[C@H]21	804300711	ZJEZVANOECOHDL-WCBMZHEXSA-N	233.267	1.722	10	20	BDCD	
C[C@H](O)CN[C@H](C)c1ccc(F)cc1O	62745810	XANCXORUHDNVIG-JGVFFNPUSA-N	213.252	1.563	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2C[C@@H](O)C2(C)C)c1	128112935	FVGLOUWQJLPNTB-CHWSQXEVSA-N	235.327	1.950	10	20	BDCD	
NC(=O)c1cc(NCc2ccccc2O)ccn1	126220643	WWCHSXGCOIGLLQ-UHFFFAOYSA-N	243.266	1.498	10	20	BDCD	
C[C@H]1C[C@@H](O)CCN1Cc1cc(F)ccc1O	292888401	YOSGWOWLGOQEBC-CABZTGNLSA-N	239.290	1.877	10	20	BDCD	
CN(C)c1ccc(OC[C@H]2CNC(=O)C2)cc1	902357662	BYVHHALPZANDFA-SNVBAGLBSA-N	234.299	1.268	10	20	BDCD	
CC[C@@H](CNCc1cccc(C)c1O)C(=O)O	903705350	KUNGDGHVBFDCCT-JTQLQIEISA-N	237.299	1.901	10	20	BDCD	
CC(C)CC(=O)NCc1ccc(O)cc1O	910957106	JCNWPVBQUCOAGP-UHFFFAOYSA-N	223.272	1.760	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCCCCO	840941123	SNQDQIUMNJLSKM-UHFFFAOYSA-N	236.359	1.923	10	20	BDCD	
OC[C@@H](CCF)NCc1ccc2c(c1)CCO2	846097524	QSOVDWXRLWBXAI-GFCCVEGCSA-N	239.290	1.432	10	20	BDCD	
CN(CCCF)c1ccc(OCC(=O)O)cc1	846279604	HNZXSQUGHCQLHX-UHFFFAOYSA-N	241.262	1.946	10	20	BDCD	
COC/C=C/C(=O)NCc1cc(C)ccc1O	862755121	DOYYCZCAXHSSDZ-ONEGZZNKSA-N	235.283	1.519	10	20	BDCD	
Cc1ccc(CN2CC(C)(O)C2)c(O)c1	877581358	YVNCNCJLPNUZPU-UHFFFAOYSA-N	207.273	1.267	10	20	BDCD	
CC[C@@H]1C(=O)NCCN1Cc1ccc(C)cc1O	876686039	NRPMTUJUZYKKJV-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
Cc1cccc(O)c1CNCCN1CCCC1=O	877613505	KVBBTEAAVUJDMN-UHFFFAOYSA-N	248.326	1.413	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](CO)C1)c1c(O)cccc1F	886644367	BITZESXYLVYLSK-BBBLOLIVSA-N	239.290	1.953	10	20	BDCD	
C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@@H]1O	897684878	YHTRMTLNWXJSSK-UFBFGSQYSA-N	241.718	1.858	10	20	BDCD	
C[C@@H]1CCN[C@H]([C@@H]2CCCC(=O)C2=O)C1	130377941	MKIWVDMMNRFFHU-UTLUCORTSA-N	209.289	1.313	10	20	BDCD	
C[C@H]1CCNC[C@@H]1NCc1ccc2c(c1)CCO2	841058003	DPJGAQOAFIYNQC-FZMZJTMJSA-N	246.354	1.709	10	20	BDCD	
CNC(=O)C[C@@H](C)NCc1cc(C)ccc1O	322748327	CZMXZMNLGZEVOO-SNVBAGLBSA-N	236.315	1.315	10	20	BDCD	
OC/C=C/CNCc1ccc2c(c1)CCCO2	922240084	MWUMQXOCOCAZMR-OWOJBTEDSA-N	233.311	1.650	10	20	BDCD	
CC[C@@H](O)CNCc1c(O)cccc1Cl	229967806	SSZWIXLXZWTGJI-MRVPVSSYSA-N	229.707	1.906	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2COCCO2)c1	71408217	SQLZITMIRKRLON-GFCCVEGCSA-N	237.299	1.206	10	20	BDCD	
C[C@@H](CN(C)C)N[C@@H](C)c1ccccc1O	130164172	OXDNMDUOAKECFR-QWRGUYRKSA-N	222.332	1.993	10	20	BDCD	
COC(=O)CN[C@H](C)c1ccc(N(C)C)cc1	37187439	AFNIVUYGRCSSMY-SNVBAGLBSA-N	236.315	1.576	10	20	BDCD	
Nc1ccc(CNC(=O)CC2CC2)cc1	49728833	UAXAIRRGABZESY-UHFFFAOYSA-N	204.273	1.685	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](C(=O)O)[C@H]2C)c1	227582300	XHSUJZLWULQOQJ-ZYHUDNBSSA-N	249.310	1.996	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCO[C@H]2C)c1	134245932	VFKZRPZJNYHXJG-CMPLNLGQSA-N	221.300	1.968	10	20	BDCD	
CCOc1ccc(N(C)CCCO)cc1	49814627	ZVOWUPNJDVBSEN-UHFFFAOYSA-N	209.289	1.904	10	20	BDCD	
CN(C)CCN(C)Cc1cc(F)ccc1O	139747047	CHUJAQDSFXQYCN-UHFFFAOYSA-N	226.295	1.525	10	20	BDCD	
C[C@@H]1C[C@H](CN)CN1Cc1cc(F)ccc1O	220338220	XHYBWYSVKBHVCD-NXEZZACHSA-N	238.306	1.700	10	20	BDCD	
O=C(NCc1ccccc1O)c1cscn1	82280442	POMUXJKLRNIRHK-UHFFFAOYSA-N	234.280	1.779	10	20	BDCD	
C[C@@H](NCC1(CC(N)=O)CC1)c1ccccc1O	817586750	RUNZFEFKRYHTQY-SNVBAGLBSA-N	248.326	1.698	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](CO)CCF)c1	846101194	RAJOMMPDFMHSCT-SNVBAGLBSA-N	243.278	1.211	10	20	BDCD	
Cc1cccc(CNCC[C@@H]2CCNC2)c1O	841036436	NLHZPWXGIHQVDJ-LBPRGKRZSA-N	234.343	1.790	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2=COCCO2)c1	862761121	FIOBQIIJSSQPNW-UHFFFAOYSA-N	249.266	1.205	10	20	BDCD	
CNC[C@@H](C)CN[C@@H]1CCc2cccc(O)c21	1118122434	WTXWLGFKGBANEA-ZYHUDNBSSA-N	234.343	1.825	10	20	BDCD	
Cc1cc(O)c(CNC2CC(C(=O)O)C2)cc1C	874055770	GOVBHOYSPMZYJE-UHFFFAOYSA-N	249.310	1.962	10	20	BDCD	
C[C@@]1(CNCc2ccc(N)cc2)CCCNC1	1120268494	GFLFVYHTSNSLSR-CQSZACIVSA-N	233.359	1.748	10	20	BDCD	
CCc1cccc(CN[C@H]2CCOC2=O)c1O	895809013	QFZSYPCOYKOJCZ-NSHDSACASA-N	235.283	1.360	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2C(=O)NCC2(C)C)c1	895316544	PIQYRIQWRUXPJT-GFCCVEGCSA-N	248.326	1.315	10	20	BDCD	
Oc1ccccc1CN1C[C@H]2CC[C@@H](O)[C@H]2C1	895785198	RRHJZEIUDMZESB-SCDSUCTJSA-N	233.311	1.595	10	20	BDCD	
N[C@@H](C(=O)O)c1cccc(Br)c1O	96880012	XULSUCHVHYXPMH-ZCFIWIBFSA-N	246.060	1.239	10	20	BDCD	
NCCCCC(=O)NCc1ccccc1O	83351971	ZJYUKNYDHUQJRE-UHFFFAOYSA-N	222.288	1.137	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@H]1C	92081952	YIDMOIGAXRWJJU-GHMZBOCLSA-N	232.327	1.926	10	20	BDCD	
CC(C)=CC(=O)NCc1ccc(O)c(O)c1	159035492	AADFJOLOWHPGAZ-UHFFFAOYSA-N	221.256	1.680	10	20	BDCD	
NC[C@@H](NCc1ccc2c(c1)CCCO2)C1CC1	904350060	GQTPYJRVSCLQBF-CQSZACIVSA-N	246.354	1.839	10	20	BDCD	
CCc1cccc(CNC[C@@H](O)C2CC2)c1O	691480010	AUDQILQDCCFHRK-CYBMUJFWSA-N	235.327	1.815	10	20	BDCD	
CO[C@@H]1COC[C@@H]1N[C@H]1CCc2cccc(O)c21	840826806	WEQDVSWZTPHSTD-GMXVVIOVSA-N	249.310	1.383	10	20	BDCD	
NC(=O)C[C@H]1CCCN(Cc2ccccc2O)C1	179582754	KPPBSRBTRZUHMY-LLVKDONJSA-N	248.326	1.480	10	20	BDCD	
COCCN[C@H](C)c1cc(F)ccc1O	87111306	YKDWRNBLDPUVGG-MRVPVSSYSA-N	213.252	1.828	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H]2C(=O)O)c1	86726639	IVJHIRJHUIYJPR-NSHDSACASA-N	235.283	1.750	10	20	BDCD	
C[C@@H](CCO)N(C)Cc1cc(F)ccc1O	846111580	QVZWXEBWHZCBNT-VIFPVBQESA-N	227.279	1.734	10	20	BDCD	
O=C(NC1CC(F)(F)C1)c1cc(O)cs1	760920265	JIDDFRUXTQHTTA-UHFFFAOYSA-N	233.239	1.981	10	20	BDCD	
Cc1ccc(CNCCn2cccn2)c(O)c1	876959751	OONSCNCLOOMGPH-UHFFFAOYSA-N	231.299	1.687	10	20	BDCD	
Cc1cccc(O)c1CNCCN1CCC1	877112065	ODYXCEUNVZRASP-UHFFFAOYSA-N	220.316	1.496	10	20	BDCD	
CCc1cccc(CNC[C@H]2C[C@H](O)C2)c1O	720940266	OUHOAIMNBQVMOZ-MJHDQNEOSA-N	235.327	1.815	10	20	BDCD	
C[C@H]1CCN(C(=O)NCc2ccc(N)cc2)C1	1338793770	VCMIYBXBCNSPMK-JTQLQIEISA-N	233.315	1.820	10	20	BDCD	
C[C@@H]1C[C@@H](C)[C@@H](C(=O)NCc2ccc(N)cc2)O1	1343473107	LBVINNSXBPZOPP-BREBYQMCSA-N	248.326	1.699	10	20	BDCD	
CC[C@@](C)(CO)NCc1cccc(C)c1O	163727965	LVRUOJSRFUPAPZ-ZDUSSCGKSA-N	223.316	1.951	10	20	BDCD	
CN(C)C(=O)CNCc1cccc(Cl)c1O	163728765	ZZQWRRGUOFLTCY-UHFFFAOYSA-N	242.706	1.223	10	20	BDCD	
CO[C@H](C)CCC(=O)NCc1ccccc1O	167353043	GJBWOLIEHUCYJJ-SNVBAGLBSA-N	237.299	1.824	10	20	BDCD	
CC[C@H](N[C@H](C)c1ccccc1O)C(N)=O	310005227	GIZSQSNYJJPFJH-SCZZXKLOSA-N	222.288	1.307	10	20	BDCD	
CN1CCC[C@@H](NCc2ccccc2O)C1=O	704366827	HWDJWWLDJNEHPS-LLVKDONJSA-N	234.299	1.103	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2cc[nH]n2)c1	114541551	SBEVFUPVIJDBKF-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
C[C@@H](NCCN(C)C)c1ccc(N(C)C)cc1	37184063	AMNJYGSYAICQGZ-GFCCVEGCSA-N	235.375	1.965	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCCNCC2)cc1	128908919	JJQYXJWIRIKJQF-CQSZACIVSA-N	247.386	1.984	10	20	BDCD	
CC[C@@H](NCCO)c1ccc(F)cc1O	285809231	VTMIGPHHDGBVIX-SNVBAGLBSA-N	213.252	1.564	10	20	BDCD	
CN(CC(C)(C)N)c1ccc2c(c1)OCO2	84496963	QLGQIPKUSABLCJ-UHFFFAOYSA-N	222.288	1.589	10	20	BDCD	
CNC(=O)[C@H](C)N[C@H](C)c1ccccc1O	42560269	OTWYEEWJIQQPFP-BDAKNGLRSA-N	222.288	1.177	10	20	BDCD	
C[C@@H](O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1	272522730	LLUSNCXLJKZVMF-TZMCWYRMSA-N	248.370	1.955	10	20	BDCD	
CC(=O)C(=O)Cn1cc(C(F)(F)F)ccc1=O	288952653	SNBOIYGYMMQOMD-UHFFFAOYSA-N	247.172	1.025	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2N)cc1	294643788	BKNBPBCUFFCEJY-WTTBSCSTSA-N	245.326	1.581	10	20	BDCD	
C[C@H](N)CN[C@H]1CCc2cccc(O)c21	817971824	HJPICKYIAZJNQD-WPRPVWTQSA-N	206.289	1.316	10	20	BDCD	
CC(C)[C@@H](F)C(=O)NCc1ccc(O)cc1O	910947838	OSNOBPRNHWJUHZ-LLVKDONJSA-N	241.262	1.708	10	20	BDCD	
O=C(N[C@@H]1CCSC1)c1cc(O)cs1	743734039	ZSXMOEVVDOZLBA-ZCFIWIBFSA-N	229.326	1.689	10	20	BDCD	
CCN[C@H](C)CNCc1ccc(N(C)C)cc1	841064321	AQXKFGNMAOQVBK-GFCCVEGCSA-N	235.375	1.840	10	20	BDCD	
COc1cc(C)cc(CNC(C)(C)CO)c1O	894391578	FYJOSNXWWADWFT-UHFFFAOYSA-N	239.315	1.570	10	20	BDCD	
Cc1ccc(CN[C@H]2C(=O)NCC2(C)C)c(O)c1	895324855	NCKLCVQQQVWYHV-LBPRGKRZSA-N	248.326	1.315	10	20	BDCD	
Cc1ccc(C(=O)N2CC(C)(C)C2)c(O)c1O	790233645	ANNBKNFNEULRDQ-UHFFFAOYSA-N	235.283	1.888	10	20	BDCD	
COCC1CCN(C(=O)CN=[N+]=[N-])CC1	409432863	WTMKZCMOPDQVQV-UHFFFAOYSA-N	212.253	1.182	10	20	BDCD	
C[C@H](N)CN(C)Cc1ccc(N(C)C)cc1	393804189	VFYXZCDJSKRHJN-NSHDSACASA-N	221.348	1.532	10	20	BDCD	
CSC[C@H](C)C(=O)NCc1ccc(N)cc1	297243545	PYZQERZYTUTDDZ-VIFPVBQESA-N	238.356	1.884	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](O)C1)c1ccc(F)c(F)c1O	295987799	PHEVGJFSEAUYGX-PRJMDXOYSA-N	243.253	1.844	10	20	BDCD	
C[C@@H](NC(=O)C1CC1)c1ccccc1O	827917929	RBOXBTGJODISFE-MRVPVSSYSA-N	205.257	1.979	10	20	BDCD	
CS/C=C/C(=O)NCc1ccc(O)c(O)c1	778919131	VAGUUUFRHLDQMN-SNAWJCMRSA-N	239.296	1.591	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1COCCO1)CCO2	38052587	NSGCCTCJKARSJY-CYBMUJFWSA-N	249.310	1.127	10	20	BDCD	
C[C@H](NC[C@@H]1CCN1C)c1ccc(F)cc1O	712594666	NPGBUMQSPHPECH-ONGXEEELSA-N	238.306	1.886	10	20	BDCD	
CC[C@H](NCc1cc(OC)ccc1O)C(=O)O	1261481903	URGDZOUGHISHOW-JTQLQIEISA-N	239.271	1.354	10	20	BDCD	
Nc1ccc(CC(=O)N2C[C@H]3C=C[C@H]2C3)cc1	1333732751	PRGIKRPEXOFSQA-AAEUAGOBSA-N	228.295	1.598	10	20	BDCD	
O=C(NCCc1ccco1)c1cccc(O)c1O	126301297	BWPWNYBEJMSMOI-UHFFFAOYSA-N	247.250	1.663	10	20	BDCD	
NC1(CC(=O)NCc2ccccc2O)CCC1	228423896	PBLMOJOVMAYETE-UHFFFAOYSA-N	234.299	1.280	10	20	BDCD	
COCC[C@H](C)NCc1cc(OC)ccc1O	81705325	WBQHAOYEZGOLLC-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
C[C@H]1C[C@H](CO)CN(Cc2ccccc2O)C1	817412730	ONBBIHFUUTWYID-RYUDHWBXSA-N	235.327	1.843	10	20	BDCD	
CN1CC(=O)N[C@H]1c1cc(Cl)ccc1O	917500606	VLZWFPDKKXCSTQ-SNVBAGLBSA-N	226.663	1.106	10	20	BDCD	
NC[C@H](NCc1cc(F)ccc1O)C1CC1	841027447	BEFGLMDWNBEVIR-NSHDSACASA-N	224.279	1.358	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](CO)C1)c1c(O)cccc1F	927142262	BITZESXYLVYLSK-OPRDCNLKSA-N	239.290	1.953	10	20	BDCD	
CC[C@H]1COCCN1C(=O)c1cc(O)cs1	754904929	BQYAAGNGFSJZBD-QMMMGPOBSA-N	241.312	1.705	10	20	BDCD	
COc1ccc2c(c1)CCCN2CC1OCCO1	777553173	FYOZVYVZLSFEIE-UHFFFAOYSA-N	249.310	1.821	10	20	BDCD	
CCOc1ccc(CNC2CSC2)c(O)c1	877635310	LVMOWEAJIPUTOS-UHFFFAOYSA-N	239.340	1.996	10	20	BDCD	
C[C@H]1CCCN(Cc2ccc(N)cc2)[C@H]1CN	1120263965	YGYDIFMYWQDIHU-FZMZJTMJSA-N	233.359	1.828	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@H]1C[C@@H]1F	1123669324	OVENCJRKZPNVLD-YUMQZZPRSA-N	225.219	1.072	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)[C@@H]2CC=CCC2)C1	409422969	KGPPGFCHFPITLD-MRVPVSSYSA-N	206.249	1.864	10	20	BDCD	
Nc1ccc(CNC(=O)c2cc(N)ccn2)cc1	1580445537	ISNMGUBSOAQXAM-UHFFFAOYSA-N	242.282	1.176	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H](F)C(=O)O)cc1	1777040055	VPPJZZOVDBWRBQ-LLVKDONJSA-N	240.278	1.265	10	20	BDCD	
COCC1(CC(=O)NCc2ccccc2O)CC1	401304701	BGFAHAQQKQXXNG-UHFFFAOYSA-N	249.310	1.825	10	20	BDCD	
CC[C@@H](CO)N[C@H](C)c1cc(OC)ccc1O	20195335	MBOKSNBRCAFLER-ZJUUUORDSA-N	239.315	1.822	10	20	BDCD	
COc1cc(Cl)cc(CN(C)CCO)c1O	184671998	FEAKPYSVISEAGG-UHFFFAOYSA-N	245.706	1.478	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1[C@H]2CCC[C@H]12	182519350	BQAVFRWWJSOAKM-UWVGGRQHSA-N	247.294	1.760	10	20	BDCD	
CS[C@H](C)CNC(=O)Cc1ccc(N)cc1	136160522	XZTKPGZBAMDEFX-SECBINFHSA-N	238.356	1.679	10	20	BDCD	
Nc1ccc(CN2CCC[C@@H]2CO)cc1	48859608	QVIXAMXKUNBXRA-GFCCVEGCSA-N	206.289	1.226	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC[C@@H](C)CO)c1	86629170	KKTRZHYDABDAFJ-ZJUUUORDSA-N	239.315	1.680	10	20	BDCD	
Nc1ccc(NC(=O)N[C@@H]2CCSC2)cc1	231356538	GSJJVPUXDQVGGK-SNVBAGLBSA-N	237.328	1.896	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)CCN	237056587	GWZJKHKPFDFUFD-UHFFFAOYSA-N	235.331	1.026	10	20	BDCD	
CN(CC(=O)N1CCC1)c1ccc2c(c1)OCO2	270139127	ICWQQJHXIZSSOF-UHFFFAOYSA-N	248.282	1.084	10	20	BDCD	
Oc1ccc(F)cc1CN1CCn2cncc2C1	291568381	NQKDSICBOPMAHZ-UHFFFAOYSA-N	247.273	1.744	10	20	BDCD	
CC[C@H](N)CN[C@@H]1CCc2cccc(O)c21	817980653	WFAXKQLJADDYJS-WDEREUQCSA-N	220.316	1.706	10	20	BDCD	
NCC1CCC(NCCc2ccc(N)cc2)CC1	841039013	XERFLNXZAIMJNG-UHFFFAOYSA-N	247.386	1.918	10	20	BDCD	
Cc1cccc(O)c1CNCCNC(=O)C1CC1	876892782	TVLAKHJCHIYGBT-UHFFFAOYSA-N	248.326	1.316	10	20	BDCD	
COC(=O)[C@H](C)NCc1c(C)cccc1O	877476644	JUGWXXDXRPFSCF-VIFPVBQESA-N	223.272	1.352	10	20	BDCD	
C[S@](=O)CCNCc1cc(F)cc(F)c1O	708435157	BBHOXIIODWTGFD-INIZCTEOSA-N	249.282	1.139	10	20	BDCD	
C=C=CCNC(=O)NCc1ccc(N(C)C)cc1	1263697727	LMLDBYLNWVEVFB-UHFFFAOYSA-N	245.326	1.893	10	20	BDCD	
COc1cccc(CNC(=O)[C@H]2C[C@H]2F)c1O	1521265820	ISVLACGKSOTNQH-DTWKUNHWSA-N	239.246	1.375	10	20	BDCD	
NC[C@@H]1CCCCN1C(=O)Cc1ccc(N)cc1	237835012	CGLDZCIHOVNEGA-ZDUSSCGKSA-N	247.342	1.151	10	20	BDCD	
C[C@@H](C(=O)NCc1ccccc1O)n1cccn1	133758404	DGYJNFMVECTBQE-JTQLQIEISA-N	245.282	1.466	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](O)C(C)(C)C2)c1	280554040	UIJVOCZEQYAMMZ-ZDUSSCGKSA-N	235.327	1.903	10	20	BDCD	
C[C@@H](NCc1cc(Cl)c(F)cc1O)C(N)=O	816593021	BXGPCTMVNCYIBR-RXMQYKEDSA-N	246.669	1.148	10	20	BDCD	
C[C@H](NC[C@@H]1CCCN1)c1ccc(F)cc1O	817951227	BXLWVNNXVCZYHA-ONGXEEELSA-N	238.306	1.934	10	20	BDCD	
O=C(NCc1ccccc1O)c1cocn1	729529738	FNYIMADQEGKOJD-UHFFFAOYSA-N	218.212	1.310	10	20	BDCD	
Cc1ncc(/C=C/C(=O)N(C)c2cn[nH]c2)s1	749244264	QVGKFNFFNSKVDE-ONEGZZNKSA-N	248.311	1.851	10	20	BDCD	
NCC[C@@H](NCc1cc(F)ccc1O)C(F)F	841074400	PMAFEBRYCDAJNL-SECBINFHSA-N	248.248	1.603	10	20	BDCD	
CCc1cccc(CN(C)C2CC(O)C2)c1O	848903543	WAQISUCOHCDRCV-UHFFFAOYSA-N	235.327	1.910	10	20	BDCD	
Cc1ccn(CC(=O)NCc2ccccc2O)n1	857471619	FQQMPZLXOZXAHD-UHFFFAOYSA-N	245.282	1.214	10	20	BDCD	
CNC[C@@H](C)N[C@H](C)c1cc(F)cc(F)c1O	854231719	KSAWDYFCXHIHRK-HTQZYQBOSA-N	244.285	1.929	10	20	BDCD	
O=C(O)[C@H]1C[C@@H](NCc2cccc(F)c2O)C1	874046445	YJZWIWALMFLFFP-DTORHVGOSA-N	239.246	1.484	10	20	BDCD	
COCCN(CCO)Cc1ccc(C)cc1O	876682180	DYYZSWICVAIBHJ-UHFFFAOYSA-N	239.315	1.141	10	20	BDCD	
CN(C(=O)CC(C)(C)N)c1ccc(N)cc1	877079098	QIYRZJSFJZQLDK-UHFFFAOYSA-N	221.304	1.359	10	20	BDCD	
CC[C@@H](CO)NCc1cc(C)cc(OC)c1O	894157608	WLKFWEKGEYLLJT-NSHDSACASA-N	239.315	1.570	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCC[C@H]2O)c1O	133259253	FJFPAGHGHYRMLF-VXGBXAGGSA-N	221.300	1.704	10	20	BDCD	
CO[C@@H]1COC[C@H]1N[C@H]1CCc2cccc(O)c21	842912777	WEQDVSWZTPHSTD-DMDPSCGWSA-N	249.310	1.383	10	20	BDCD	
CCN(C[C@H](C)N)c1ccc(OC)c(OC)c1	20239640	MECWGCBKYYFRTL-JTQLQIEISA-N	238.331	1.877	10	20	BDCD	
CC[C@@H](N[C@H](C)c1ccccc1O)C(=O)OC	305450819	LQAHRUFDDCFUKX-MWLCHTKSSA-N	237.299	1.994	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1N	300048538	LBKIXPNWTVAPAT-BXUZGUMPSA-N	233.359	1.532	10	20	BDCD	
CC1(C)C[C@@H]1C(=O)NCc1ccc(O)c(O)c1	182533242	QBUTZUZPCFPHKX-SECBINFHSA-N	235.283	1.760	10	20	BDCD	
CC1(C)[C@@H](O)C[C@H]1NCc1cc(F)ccc1O	189967842	RISCGNHGUPMMPW-NEPJUHHUSA-N	239.290	1.780	10	20	BDCD	
CC1(C)[C@@H](NCc2cc(F)ccc2O)C[C@H]1O	189967889	RISCGNHGUPMMPW-NWDGAFQWSA-N	239.290	1.780	10	20	BDCD	
COc1ccc(CNCCn2ccnc2)cc1C	41064151	WPYSNMMABUDOAE-UHFFFAOYSA-N	245.326	1.990	10	20	BDCD	
CC[C@H](C(=O)NCc1ccccc1O)N(C)C	269138051	KYBBCXDIAQQXLN-LLVKDONJSA-N	236.315	1.349	10	20	BDCD	
Oc1ccccc1CN1C[C@H]2COC[C@H]2C1	718252183	XGFXTOUUDDIWQI-TXEJJXNPSA-N	219.284	1.470	10	20	BDCD	
C[C@H](N[C@@H]1CC[C@H]1O)c1cc(F)cc(F)c1O	818358049	QCRNKLYOLHIIND-MQOMDTIOSA-N	243.253	1.844	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H](O)[C@H]2C)cc1C	825104451	XGNUUKYSNOZOOZ-DGCLKSJQSA-N	235.327	1.964	10	20	BDCD	
COCSc1ncc(C(=O)OC)s1	829680633	CGAJJDGJSZWVHY-UHFFFAOYSA-N	219.287	1.626	10	20	BDCD	
CCOc1cccc(CNCCCON)c1O	904458422	YLDQERLFMVSYMB-UHFFFAOYSA-N	240.303	1.161	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](C)CN)c1	841050183	ZABPPGFSXZBWMO-JTQLQIEISA-N	208.305	1.385	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2[C@H]3C(=O)CC[C@H]32)cc1	911661458	VBMYYTJFOSGCGQ-YUSALJHKSA-N	230.267	1.432	10	20	BDCD	
CNCCCN1CCCc2cc(CN)ccc21	843350612	PYMQZOQYXUWQDX-UHFFFAOYSA-N	233.359	1.507	10	20	BDCD	
CC[C@@H]1CC[C@H](C(=O)NCc2ccccc2O)O1	268268063	SCKRTXXBQFWARL-DGCLKSJQSA-N	249.310	1.966	10	20	BDCD	
CN(C(=O)CNCC1CC1)c1ccc(N)cc1	877078813	GEDKUVJVXNOQHG-UHFFFAOYSA-N	233.315	1.231	10	20	BDCD	
COc1cccc(O)c1CN1C[C@H]2C[C@]2(CO)C1	783735431	QEODIIAWHJBMJX-QMTHXVAHSA-N	249.310	1.215	10	20	BDCD	
CN1CCCC[C@@H]1C(=O)NCc1ccc(N)cc1	1343567326	PESBKEKLWYXZQC-CYBMUJFWSA-N	247.342	1.369	10	20	BDCD	
C[C@H](CNCc1ccccc1O)N(C)C	38088757	IMETWNOLLUKPIG-SNVBAGLBSA-N	208.305	1.432	10	20	BDCD	
NCCCCCC(=O)NCCc1ccc(N)cc1	34276389	PLWCPSHUASTSPV-UHFFFAOYSA-N	249.358	1.447	10	20	BDCD	
CN(C(=O)c1cnncc1O)c1ccc(N)cc1	1578393001	TWPWBPSWADAWJA-UHFFFAOYSA-N	244.254	1.041	10	20	BDCD	
C[C@@H](NCc1cn(C)nn1)c1ccccc1O	389835636	OHPLMMOADUSXKZ-SECBINFHSA-N	232.287	1.372	10	20	BDCD	
Cc1ccc(C(=O)NCc2ccco2)c(O)c1O	177658177	REHHDMXWDNTDFP-UHFFFAOYSA-N	247.250	1.929	10	20	BDCD	
CCOC1CN(Cc2cccc(C)c2O)C1	297382500	IRADMJYQVNVGEC-UHFFFAOYSA-N	221.300	1.921	10	20	BDCD	
CC(=O)C(=O)COc1c(F)cccc1[N+](=O)[O-]	808033109	HELAXLGTTALQFJ-UHFFFAOYSA-N	241.174	1.271	10	20	BDCD	
CC[C@@H](N[C@@H](C)CN)c1ccc(F)cc1O	817970189	NSIQBHHHRDHMIB-GZMMTYOYSA-N	226.295	1.919	10	20	BDCD	
Oc1ccccc1CN1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	824838809	SGDFLIUMFZQNBW-DDHJSBNISA-N	243.306	1.777	10	20	BDCD	
Nc1ccc(CCNC[C@H](N)CC(F)F)cc1	903917348	LLEXJOORUUIPBO-LLVKDONJSA-N	243.301	1.383	10	20	BDCD	
CC1=NNC(=O)[C@@H]1Sc1nccs1	916760446	YKQRFSOITSDDAH-RXMQYKEDSA-N	213.287	1.110	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1C[C@@H](CO)C1	865662468	CKTCTHUHIJKBLH-AOOOYVTPSA-N	237.299	1.261	10	20	BDCD	
CC(C)CNCc1cc2c(cc1O)OCO2	42879044	OADGNQAKUQZHSL-UHFFFAOYSA-N	223.272	1.867	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](C)[C@@H](O)C2)c1	897684009	JCLFFDBFUCOINX-MFKMUULPSA-N	221.300	1.513	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)C[C@@H]1CN	1205317943	QXLSHAPMSMURMJ-YPMHNXCESA-N	233.359	1.686	10	20	BDCD	
C[C@H](NCCCC(=O)O)c1ccccc1O	37418421	FBAOQESOACKDFJ-VIFPVBQESA-N	223.272	1.908	10	20	BDCD	
CN(Cc1cc(F)ccc1O)CC(C)(C)N	691993306	QJBUFQRGCJZUQF-UHFFFAOYSA-N	226.295	1.700	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1CCCN1)CCO2	259018531	YKFVJQIKIUESHB-CYBMUJFWSA-N	232.327	1.463	10	20	BDCD	
CCn1nncc1CN[C@@H](C)c1ccccc1O	845990990	SOKKUBYXECOXNG-JTQLQIEISA-N	246.314	1.854	10	20	BDCD	
C[C@@H](NCc1cncn1C)c1ccccc1O	271722141	YCXITRLCRPMZHO-SNVBAGLBSA-N	231.299	1.977	10	20	BDCD	
COCC1(NC(=O)Nc2ccc(N)cc2)CCC1	378709879	SHDCYFOPAHYVTN-UHFFFAOYSA-N	249.314	1.959	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@H]2CCN(C)C2=O)c1	690257088	GDCGNPZQGMZWQJ-LBPRGKRZSA-N	248.326	1.363	10	20	BDCD	
Cc1ccc(C(=O)Nc2cn[nH]c2)c(O)c1O	181960446	VVGIQNQOUKRDMI-UHFFFAOYSA-N	233.227	1.382	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H]([C@@H](C)N)C2)c1	126870939	RIACFKIKJZPWHG-VXGBXAGGSA-N	234.343	1.870	10	20	BDCD	
CSC[C@@H](O)CN(C)Cc1ccccc1O	188058267	PIDAIOCMMSKTKQ-NSHDSACASA-N	241.356	1.548	10	20	BDCD	
C[C@H](CCO)N[C@H](C)c1cc(F)ccc1O	132547165	AKKOQATZGVEWMQ-RKDXNWHRSA-N	227.279	1.953	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)CCN1	224462357	VEYJWFBZRTVNSX-SNVBAGLBSA-N	205.305	1.063	10	20	BDCD	
CN(C)c1ccc(OCC(=O)N(C)C2CC2)cc1	277697539	DUZFIIXLAIJEBM-UHFFFAOYSA-N	248.326	1.752	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(F)cc1F	808488190	OXXTXODEIRXFEC-UHFFFAOYSA-N	242.177	1.280	10	20	BDCD	
C[C@@H](CN)CN[C@H](C)c1ccc(N(C)C)cc1	817962958	PSYGJIQEARGIKX-NWDGAFQWSA-N	235.375	1.998	10	20	BDCD	
NC1CC(NCc2cccc(Cl)c2O)C1	906510107	MSVSEAHMEDXRNJ-UHFFFAOYSA-N	226.707	1.625	10	20	BDCD	
O=C(Nc1ncccc1O)c1cc(O)cs1	731863825	FLLKIUVSFTWSTD-UHFFFAOYSA-N	236.252	1.807	10	20	BDCD	
C[C@H]1COCCCN1C(=O)c1cc(O)cs1	746301239	KAFYQAASYYQIDV-QMMMGPOBSA-N	241.312	1.705	10	20	BDCD	
OC[C@H](CCF)NCc1cc(Cl)ccc1O	846097263	PACUQUPJQJIXLJ-JTQLQIEISA-N	247.697	1.856	10	20	BDCD	
CCCN(C)Cc1cc2c(cc1O)OC[C@@H]2O	768441263	YAHCFTOKPNERCU-LBPRGKRZSA-N	237.299	1.660	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H]3CC[C@H](C2)N3)c1	873217874	SQBDLUIYFOKPDU-TXEJJXNPSA-N	248.326	1.337	10	20	BDCD	
OC[C@@H]1CSCCN1Cc1ccccc1O	877780338	NCOULJUJZNYDAR-LLVKDONJSA-N	239.340	1.302	10	20	BDCD	
Cc1ccc(CN2CCNC(=O)[C@@H]2C)c(O)c1	876651486	CPOAZTMYVHSRCB-JTQLQIEISA-N	234.299	1.021	10	20	BDCD	
Cc1ccc(CN2CC[C@H]([C@@H](C)O)C2)c(O)c1	877183260	BECMAKMANVUXGM-NEPJUHHUSA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(CNCCNC(=O)C2CC2)c(O)c1	876892796	UDYBTHGXWCCEEM-UHFFFAOYSA-N	248.326	1.316	10	20	BDCD	
O=C(N[C@@H](CO)CC1CC1)c1cc(O)cs1	778511192	NYPYCPTVFRQKIF-MRVPVSSYSA-N	241.312	1.345	10	20	BDCD	
Nc1ccc(CNC[C@H]2CCCNC2)cc1	1120268504	GLTNWNCUHJYPLT-LBPRGKRZSA-N	219.332	1.358	10	20	BDCD	
Cc1cccc(CNC2CCN(C)CC2)c1O	83361138	HTTMOIVXVHKQSU-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@H](C)c1ccc(N(C)C)cc1	161364521	PUUJPRYFYWJEQB-WDEREUQCSA-N	249.358	1.667	10	20	BDCD	
NC(=O)[C@@H]1CC[C@H](NCc2ccccc2O)C1	825279039	LUIZQYBUZALJIP-KOLCDFICSA-N	234.299	1.136	10	20	BDCD	
C[C@H](Sc1nccs1)c1nnnn1C	188977357	PVVALTMLCVQUGJ-YFKPBYRVSA-N	227.318	1.520	10	20	BDCD	
COc1cccc(CNCc2ccno2)c1O	231881923	GZOHMLRMUONJCO-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
COc1ccc(CN[C@]2(C)CCOC2=O)cc1C	289890264	SOVQAOMUSUEROO-CQSZACIVSA-N	249.310	1.799	10	20	BDCD	
C[C@@H](NC/C=C\CO)c1ccccc1O	717533042	MAJPWVZJDWTZEC-UMCURTJPSA-N	207.273	1.591	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)[C@H]1CCCCN1	817957442	MENXUNLKZZBCLJ-SWLSCSKDSA-N	247.386	1.932	10	20	BDCD	
C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(N(C)C)cc1	817976518	MWSLVCGSEZUDPW-BSLXNSKLSA-N	245.370	1.621	10	20	BDCD	
OC[C@@H]1CCN1Cc1cc2c(cc1O)CCCC2	902630399	AUARUIYIWYVZFK-AWEZNQCLSA-N	247.338	1.838	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCN[C@@H](C)C1	840908964	ZLNGSKWBLIMDJK-ZDUSSCGKSA-N	247.386	1.855	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C(C)(C)CO)c1	862756996	CPBHZMWLMHWJDD-UHFFFAOYSA-N	237.299	1.335	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@]2(C)CCOC2)c1	862757616	ZYQYUYHNUWLBHA-AWEZNQCLSA-N	249.310	1.743	10	20	BDCD	
Cc1cccc(O)c1CNCc1cncn1C	877537585	PPJJRLSHKUJPMJ-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
CCCNCCNCc1ccc(N)cc1	1120371284	UMOUHIYPFAURPO-UHFFFAOYSA-N	207.321	1.358	10	20	BDCD	
CC1=NO[C@@H](CNCc2ccc(C)cc2O)C1	895302963	XZFXGRXGLJFPSI-GFCCVEGCSA-N	234.299	1.955	10	20	BDCD	
CCN(C)c1ccc([C@@H](C)NCCO)cc1	166477083	VSIWJEDNNZJBLY-LLVKDONJSA-N	222.332	1.786	10	20	BDCD	
C[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)CCN1	841062477	XDYVJAZUXKFROK-SMDDNHRTSA-N	246.354	1.852	10	20	BDCD	
C[C@@H](CCO)NCc1cc(F)ccc1O	226610776	HIZCABKDXDERCD-QMMMGPOBSA-N	213.252	1.392	10	20	BDCD	
CC[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(N)=O	379212074	FJHDJWYREYHCFS-ZWNOBZJWSA-N	249.358	1.667	10	20	BDCD	
C[C@@H](CNCc1ccc(N(C)C)cc1)C(=O)O	848638145	PJRVOLJRKNMRLR-JTQLQIEISA-N	236.315	1.563	10	20	BDCD	
Nc1ccc(CCNC(=O)C2CCOCC2)cc1	61671047	QFABQTPBEQIAAX-UHFFFAOYSA-N	248.326	1.354	10	20	BDCD	
CCN(CC(=O)N(C)C)Cc1ccc(N)cc1	35361318	OHUOQPUOQJLWLC-UHFFFAOYSA-N	235.331	1.179	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC[C@H](C)O)c1	35629071	WFPWAOXCHZCBEI-VHSXEESVSA-N	209.289	1.732	10	20	BDCD	
COC[C@H](O)CN[C@@H](C)c1cc(C)ccc1O	71265166	LBIKVFCCIAOASP-WDEREUQCSA-N	239.315	1.359	10	20	BDCD	
CNCCCNCc1cc(Cl)ccc1O	83356449	RDUPPONKBCCIHB-UHFFFAOYSA-N	228.723	1.745	10	20	BDCD	
COc1cccc(CN2CCOC[C@@H]2C)c1O	132174044	ZGESUGDWMWFXLE-JTQLQIEISA-N	237.299	1.622	10	20	BDCD	
Nc1ccc(CNC(=O)CC[C@H]2CCCO2)cc1	87206445	QOAMBHSCHRSLOZ-CYBMUJFWSA-N	248.326	1.844	10	20	BDCD	
CN(C(=O)/C=C\c1cccnc1)c1cnn(C)c1	254930900	CIXKFUVVMQDYHE-WAYWQWQTSA-N	242.282	1.491	10	20	BDCD	
CN(C)c1ccc(CN(CCO)CC2CC2)cc1	748817717	QUANIIKYENKQCA-UHFFFAOYSA-N	248.370	1.957	10	20	BDCD	
C[C@H]1CN(Cc2cccc(F)c2O)[C@H](C)CN1	843120084	VJHDWKKQDMBRSF-VHSXEESVSA-N	238.306	1.714	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)OCC(F)F	759579600	NCCJWESEPJSVOJ-DUXPYHPUSA-N	244.193	1.919	10	20	BDCD	
Cc1ccc(CN2CC3(CCOC3)C2)c(O)c1	877554594	LTNOFRICXYNZDE-UHFFFAOYSA-N	233.311	1.923	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C[C@@H](C)O)c(O)c1	877195863	PBDIYTNQKWHZFV-WDEREUQCSA-N	223.316	1.950	10	20	BDCD	
NCC[C@H](NCc1ccc(N)cc1)C(F)(F)F	1120269588	UVHNFVYZINEDCA-JTQLQIEISA-N	247.264	1.638	10	20	BDCD	
CN(C)c1ccc(CNCc2cnc[nH]2)cc1F	894207891	ANZJIKPZUPJXNC-UHFFFAOYSA-N	248.305	1.905	10	20	BDCD	
COc1cc(CN2CCO[C@@H]3C[C@@H]32)c(O)cc1C	793621693	ZQQRRUAUIAYKTO-SMDDNHRTSA-N	249.310	1.682	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@H](C)CO)c1	35629076	RIBKYERJTKUHEX-ZJUUUORDSA-N	209.289	1.732	10	20	BDCD	
O[C@H](CNCc1ccc2c(c1)CCO2)C1CCC1	316036702	VNRHHQIXGBYINZ-CQSZACIVSA-N	247.338	1.872	10	20	BDCD	
COC[C@@H]1CN(Cc2ccc(N)cc2)CCO1	705830363	QERIDXGPRNRWQW-ZDUSSCGKSA-N	236.315	1.116	10	20	BDCD	
C[C@@H]1NCCN(Cc2cc(F)ccc2O)[C@H]1C	379439309	PWTSYSAGSOBINC-UWVGGRQHSA-N	238.306	1.714	10	20	BDCD	
COC1(C)CN(C(=O)Nc2ccc(N)cc2)C1	382624368	KZQPPMHZEMSBCS-UHFFFAOYSA-N	235.287	1.521	10	20	BDCD	
CCN(Cc1ccccc1O)[C@@H]1CCNC1=O	281798981	OSOSABQEXZYAEZ-LLVKDONJSA-N	234.299	1.103	10	20	BDCD	
C[C@H](O)C[C@H](C)NCc1cc(F)ccc1O	228836387	YJNRWBIHWFAMPE-IUCAKERBSA-N	227.279	1.780	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCCCON)c1	902425338	MGXVNHUYUWRIJP-SNVBAGLBSA-N	224.304	1.632	10	20	BDCD	
C[C@H](N)[C@@H]1CCN(Cc2cccc(F)c2O)C1	843058756	XNTFKSGCMNVVJB-VHSXEESVSA-N	238.306	1.700	10	20	BDCD	
CNC(=O)CCCC(=O)Nc1ccc(N)cc1	843294104	VSLCBQRBJXBWGT-UHFFFAOYSA-N	235.287	1.124	10	20	BDCD	
Cc1nc[nH]c1CC(=O)NCc1ccccc1O	774061518	AIZPHWOZALBIOO-UHFFFAOYSA-N	245.282	1.283	10	20	BDCD	
Cc1ccc(CN2CCCOCC2)c(O)c1	876618415	UULMDHOZAOJCDL-UHFFFAOYSA-N	221.300	1.923	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C[C@@H](CO)C2)c1	707630590	FKZVXEOYSHLXLO-KLPPZKSPSA-N	221.300	1.561	10	20	BDCD	
Oc1cccc(F)c1CN[C@@H]1CCCNC1	1574440553	XDOIBUYKMXSZEP-SECBINFHSA-N	224.279	1.373	10	20	BDCD	
Cc1cccc(O)c1CN1CCC(C(=O)O)CC1	1594408523	NBAZNXBFTCTNFC-UHFFFAOYSA-N	249.310	1.997	10	20	BDCD	
COc1cccc(CN(C)CC(C)(C)N)c1O	692028291	JHKUWTXDEPYPRX-UHFFFAOYSA-N	238.331	1.570	10	20	BDCD	
C[C@H](NCc1cnn[nH]1)c1ccc(N(C)C)cc1	398339438	MHCPTCLRCJHTCD-JTQLQIEISA-N	245.330	1.722	10	20	BDCD	
NC(=O)NCc1c(O)ccc2c1CCCC2	173957216	JJCMYAWYVJUFMW-UHFFFAOYSA-N	220.272	1.439	10	20	BDCD	
C[C@@H](O)[C@@H]1CCN(Cc2cc(F)ccc2O)C1	180861535	DWKXXHQEYMKAFM-NXEZZACHSA-N	239.290	1.734	10	20	BDCD	
Cc1ccc(O)c(CN(C)CC(=O)O)c1	78636250	KWJGPIFLKBUHKY-UHFFFAOYSA-N	209.245	1.217	10	20	BDCD	
C[C@@H]1CCN[C@H](C(=O)NCc2ccccc2O)C1	127714218	SGBABAVXEMQNQV-PWSUYJOCSA-N	248.326	1.397	10	20	BDCD	
CN(C)c1ccc(CN2CCNCC2)cc1F	82653922	MDJXIWLIYPPACA-UHFFFAOYSA-N	237.322	1.297	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCOC2)c1	87784956	WNAUBPSVOHZYLE-LLVKDONJSA-N	207.273	1.579	10	20	BDCD	
CC[C@H](CO)N[C@@H](C)c1cc(F)ccc1O	87111340	COJWEHCPVQVWFR-WCBMZHEXSA-N	227.279	1.953	10	20	BDCD	
CCN(CC)C(=O)c1c(F)ccc(O)c1O	276751225	WAUJAFBXEFOBDL-UHFFFAOYSA-N	227.235	1.719	10	20	BDCD	
OC/C=C/CNCc1cccc(Cl)c1O	717534702	SAJPKSZYWCQOBL-OWOJBTEDSA-N	227.691	1.684	10	20	BDCD	
CC[C@@](C)(CNC(=O)c1cc(O)cs1)OC	833798448	AHYFDKBNYOBAGP-NSHDSACASA-N	243.328	1.999	10	20	BDCD	
N[C@H](CNCc1ccc2c(c1)CCCO2)C1CC1	904355462	NYYSKDABVXZCNC-CQSZACIVSA-N	246.354	1.839	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCC1(N)CC1	904444835	SRHNQRPZUIXGDB-UHFFFAOYSA-N	233.359	1.642	10	20	BDCD	
CCOc1ccc(CN2CC[C@@H](N)C2)c(O)c1	843045554	UXUVONKJKSFTFN-LLVKDONJSA-N	236.315	1.324	10	20	BDCD	
CN[C@@H]1CCN(Cc2cccc(Cl)c2O)C1	843044844	KXGIAXLZGLOPDX-SNVBAGLBSA-N	240.734	1.839	10	20	BDCD	
Oc1ccccc1CNC(=S)NC1CC1	748155843	BKSPTBRTARPMEM-UHFFFAOYSA-N	222.313	1.519	10	20	BDCD	
CC1(CC(=O)NCc2ccc(O)c(O)c2)CC1	760455369	PWFGVUKHBWXPHC-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CC[C@@H]1NCC[C@H]1C(=O)N(C)c1ccc(N)cc1	877076928	XHOHEXKVNJZYNP-OLZOCXBDSA-N	247.342	1.620	10	20	BDCD	
CCOC1CN(Cc2ccc(C)cc2O)C1	877580798	YPFBEPIOPLNXSG-UHFFFAOYSA-N	221.300	1.921	10	20	BDCD	
C[C@H](NCCN1CCC1)c1c(O)cccc1F	886555362	QQONVHWXBYDXBZ-JTQLQIEISA-N	238.306	1.888	10	20	BDCD	
CCC[C@H](O)C(=O)N(C)c1ccc(N)cc1	1122094032	IAPHBMVEFQKQSZ-NSHDSACASA-N	222.288	1.393	10	20	BDCD	
Oc1c(F)cc(F)cc1CN[C@@H]1CCOC1	708393829	JTCQNNMTIWZBTK-SECBINFHSA-N	229.226	1.549	10	20	BDCD	
CN1CCC(C(=O)NCc2ccc(N)cc2)CC1	691935173	YWPQPEMLFIYHFH-UHFFFAOYSA-N	247.342	1.227	10	20	BDCD	
CN1CCc2cc(CN3CCNCC3)ccc21	50287730	UJHSBKVNRLDXKR-UHFFFAOYSA-N	231.343	1.084	10	20	BDCD	
CC(C)CN(C)C(=O)Cc1ccc(N)cc1	37098831	GZJCNAWNFGICAI-UHFFFAOYSA-N	220.316	1.926	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C(=O)CCN	33465566	MTPLDAKUMOWPTL-UHFFFAOYSA-N	235.331	1.060	10	20	BDCD	
CC(C)(O)CNCc1cc(Cl)ccc1O	82687385	MUVTUJZJUXLZSJ-UHFFFAOYSA-N	229.707	1.906	10	20	BDCD	
CC[C@H](O)CNCc1ccc(OC)c(C)c1	229969014	FLDRMTRCODXQPP-LBPRGKRZSA-N	223.316	1.864	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)CC[C@H]1N	251830937	PNNFQMRBBZTXKA-ZYHUDNBSSA-N	220.316	1.561	10	20	BDCD	
C[C@@H](N[C@H]1CCNC1)c1ccc(F)cc1O	817945071	SPMLADFWIXWHQA-SCZZXKLOSA-N	224.279	1.544	10	20	BDCD	
Cc1cc2c(c(-c3nccn3C)c1)CCNC2=O	656369577	DNYOTRUSFNPVRL-UHFFFAOYSA-N	241.294	1.681	10	20	BDCD	
C[C@H](Cc1cnccn1)NCc1ccccc1O	725849390	MBWOSTABWQCDOP-LLVKDONJSA-N	243.310	1.903	10	20	BDCD	
CCn1cc(NC(=O)c2cc(O)cs2)cn1	732271151	DEDUQRWDTKXREH-UHFFFAOYSA-N	237.284	1.922	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)NCC(F)F	588406694	BNLRWGPQRSXLAW-RQOWECAXSA-N	243.209	1.492	10	20	BDCD	
CC[C@H](N)CNCc1c(O)cccc1Cl	841071335	DECIXAQDMAQPMS-QMMMGPOBSA-N	228.723	1.873	10	20	BDCD	
CCc1cccc(CN2C[C@@H](O)C[C@H]2C)c1O	848905979	OTRSUNDXEVTQFS-MFKMUULPSA-N	235.327	1.910	10	20	BDCD	
CCN[C@@H](C)C(=O)N(C)c1ccc(N)cc1	877074400	IYDXBCZDQNFIJG-VIFPVBQESA-N	221.304	1.230	10	20	BDCD	
CCN(C)c1ccc(Cn2cnc(C#N)n2)cc1	153751875	QINIBKHIXCFRMC-UHFFFAOYSA-N	241.298	1.654	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)[C@@H](CN)C1CC1	842511832	YTLATCBVJWTFIE-ZDUSSCGKSA-N	247.342	1.007	10	20	BDCD	
C[C@H]1C[C@@H](NCc2cc(F)cc(F)c2O)CO1	708483521	DVXZMKNGTZZYSS-OIBJUYFYSA-N	243.253	1.937	10	20	BDCD	
COc1ccc(CN[C@H](C)CCN)cc1C	841051444	QALXRUOVMGCWMD-LLVKDONJSA-N	222.332	1.831	10	20	BDCD	
C[C@@H](NCc1ccccc1O)[C@@H]1CCOC1	127042422	UKCTUNZLCHDHGP-ZYHUDNBSSA-N	221.300	1.907	10	20	BDCD	
CN(C)c1ccc(CNCC(=O)NC2CC2)cc1	35142460	LXLAUAFRYJSLQZ-UHFFFAOYSA-N	247.342	1.121	10	20	BDCD	
Nc1ccc(N2CCN(CC3CC3)CC2)cc1	11756065	XKRBQRAKPNGUGG-UHFFFAOYSA-N	231.343	1.801	10	20	BDCD	
COC[C@H]1CN(Cc2ccccc2O)CCO1	179577480	NAZONRWAQRCMCL-GFCCVEGCSA-N	237.299	1.239	10	20	BDCD	
CN(C)c1noc(CNCc2ccccc2O)n1	190009735	NGFIXJVTKSWFPK-UHFFFAOYSA-N	248.286	1.131	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C2(C)COC2)cc1	272761433	PXMDUMZKLPECNP-UHFFFAOYSA-N	248.326	1.405	10	20	BDCD	
CC[C@H](O)CSc1ncc(C(=O)OC)s1	296108762	KXTKHDOOWJVGIO-LURJTMIESA-N	247.341	1.793	10	20	BDCD	
COc1ccc(O)c(CN(C)Cc2cnc[nH]2)c1	826769659	QNFSAWHBKJVMOW-UHFFFAOYSA-N	247.298	1.756	10	20	BDCD	
COc1cccc(CNC(=N)N2CCC2)c1O	849002733	SOJYCVIGYMGVGD-UHFFFAOYSA-N	235.287	1.131	10	20	BDCD	
O=C1CC[C@H](Sc2nccs2)C(=O)N1	765829804	RWVXXOFGXMCQRJ-YFKPBYRVSA-N	228.298	1.040	10	20	BDCD	
CN(C)C1(C(=O)NCc2ccccc2O)CCC1	769365032	MODJDNQWQNPKQU-UHFFFAOYSA-N	248.326	1.493	10	20	BDCD	
Cc1ccc([C@H](C)NCc2nncn2C)c(O)c1	38007642	GZDRMVLIADARNF-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
COCC1(C)CCN(C(=O)CN=[N+]=[N-])CC1	409435923	XISXQSCTVVCSJP-UHFFFAOYSA-N	226.280	1.572	10	20	BDCD	
Cc1ccc(O)c(CNCc2csnn2)c1	398499326	YXZJSSBGWAALRN-UHFFFAOYSA-N	235.312	1.842	10	20	BDCD	
CC(C)Oc1ccc(N2CCN(C)CC2)cc1N	215977105	HXDAATULUKRKKG-UHFFFAOYSA-N	249.358	1.808	10	20	BDCD	
CNC[C@@H](C)NCc1ccc(Cl)cc1O	1578638746	TWKMMJODPVMYKD-MRVPVSSYSA-N	228.723	1.743	10	20	BDCD	
CCCN(CCO)Cc1cccc(OC)c1O	161222010	WKMXEDXHNZFUNH-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CO[C@@H](C)C2)c1	402034273	CHRMXFAJHIHYHB-CMPLNLGQSA-N	221.300	1.968	10	20	BDCD	
CCCN(CC(N)=O)Cc1cc(F)ccc1O	310446747	UOJDMLJFYCYGNX-UHFFFAOYSA-N	240.278	1.229	10	20	BDCD	
CC(C)NC(=O)CN(C)Cc1ccccc1O	109772627	CVGAPZSDMGHDKM-UHFFFAOYSA-N	236.315	1.349	10	20	BDCD	
C[C@H]1CCN[C@@H](C(=O)NCc2ccccc2O)C1	127714787	SGBABAVXEMQNQV-CMPLNLGQSA-N	248.326	1.397	10	20	BDCD	
C[C@@]1(C(N)=O)CCN(Cc2ccccc2O)C1	235382464	KOOVJLXEHONQIN-CYBMUJFWSA-N	234.299	1.090	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)CCN	841049664	GKVGVCUBNADOPM-GFCCVEGCSA-N	235.375	1.888	10	20	BDCD	
CCC(=O)[C@H](C)OC(=O)c1cccc(O)c1O	758548305	QZAPFYPIQCYBAZ-ZETCQYMHSA-N	238.239	1.622	10	20	BDCD	
COc1cc(O)c(CN2C[C@H]3C[C@@H]3C2)cc1OC	862444168	YYHRCGDGOHDQCE-NXEZZACHSA-N	249.310	1.861	10	20	BDCD	
Cc1ccc(CNCC[C@H](C)O)c(O)c1	877477122	XUTZSAMXTRQTMV-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](N)[C@@H](C)C2)c1	227054736	OAVBSIDBEVAXJY-AAEUAGOBSA-N	234.343	1.870	10	20	BDCD	
CN(C)C(=O)CSc1nccs1	60760176	GHWDFYGPKVOTFI-UHFFFAOYSA-N	202.304	1.323	10	20	BDCD	
COc1cccc(CN(C)C[C@@H](C)OC)c1O	289211770	CAFOEZPRYOJURK-SNVBAGLBSA-N	239.315	1.868	10	20	BDCD	
Oc1ccc(F)cc1CNCc1ccon1	226613762	TWYSTNBEKVCJFZ-UHFFFAOYSA-N	222.219	1.809	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)[C@H]1CO	299914837	SXRJSZRBOYKINN-MFKMUULPSA-N	220.316	1.472	10	20	BDCD	
COC1(C)CN(Cc2ccc(N(C)C)cc2)C1	813332429	ZQHRPSKUPUSSGU-UHFFFAOYSA-N	234.343	1.973	10	20	BDCD	
OC/C=C\CNCc1ccc2c(c1)CCO2	717532498	JWYPWEREGSHURQ-UPHRSURJSA-N	219.284	1.260	10	20	BDCD	
C[C@@H](CN)N[C@@H](C)c1cc(F)ccc1O	817970050	KHDXHVNKKFDADO-YUMQZZPRSA-N	212.268	1.529	10	20	BDCD	
C[C@H]1CN=C(NC(=O)c2cc(O)cs2)S1	822482126	XYBLUFIXDITZAK-YFKPBYRVSA-N	242.325	1.675	10	20	BDCD	
CC(C)[C@H](CNCc1ccccc1O)C(=O)O	848638666	BJAGOYYPUOHAMJ-NSHDSACASA-N	237.299	1.839	10	20	BDCD	
O=C1CC[C@@H](C(=O)NCc2ccc(O)c(O)c2)C1	843833203	ZNFOLIWLLWHTKK-SECBINFHSA-N	249.266	1.083	10	20	BDCD	
Nc1ccc(-n2cc(CCCCCO)nn2)cc1	849134881	UFPZBJOSWNSPBQ-UHFFFAOYSA-N	246.314	1.555	10	20	BDCD	
CC[C@H](O)CN[C@@H](C)c1cccc(OC)c1O	846171487	SZFVJTDKMJNOGK-UWVGGRQHSA-N	239.315	1.822	10	20	BDCD	
C[C@@H]1C[C@H](CN)CN1Cc1cccc(F)c1O	843058045	NZRRFYRTVYDVOW-NXEZZACHSA-N	238.306	1.700	10	20	BDCD	
CN(C)c1ccc(CNCC(F)(F)CN)cc1	841059433	DANQUXPVDXRMON-UHFFFAOYSA-N	243.301	1.436	10	20	BDCD	
C[C@@H]1C[C@H](N)CCN1Cc1ccc(N)cc1	1120268400	DHIPQJVDIYXVOU-ZWNOBZJWSA-N	219.332	1.580	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCc2ncn(C)n2)c1	186214141	CYTSLGJPNJZSIG-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
OCCCNCc1c(O)ccc(Cl)c1F	190673042	ZTSKPDVPTGFPJK-UHFFFAOYSA-N	233.670	1.657	10	20	BDCD	
OCCCCNCc1cc(F)cc(F)c1O	708393428	DUWQJRNZXVQJPO-UHFFFAOYSA-N	231.242	1.533	10	20	BDCD	
CNC[C@H]1CCN(Cc2ccc(N)cc2)C1	1335285586	QEQFPBBKSBBCGL-GFCCVEGCSA-N	219.332	1.310	10	20	BDCD	
CNC[C@H](C)CNCc1c(O)cccc1Cl	1331420370	WWENSANGUXGZBQ-VIFPVBQESA-N	242.750	1.991	10	20	BDCD	
CO[C@@H]1CCC[C@H]1C(=O)NCc1ccccc1O	1353617677	IZHPWCHNKGOHAV-DGCLKSJQSA-N	249.310	1.824	10	20	BDCD	
Cc1cccc(CN[C@@H]2CC=C(C(=O)O)C2)c1O	1600532489	SSNHKZLQCMZTMG-GFCCVEGCSA-N	247.294	1.964	10	20	BDCD	
Cc1ccc([C@H](C)NCCOCCO)c(O)c1	20199204	KNXFRXBAPQDZND-NSHDSACASA-N	239.315	1.360	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)CC[C@H]1C(=O)O	306071588	WQWCDUSQPDYHJX-ZYHUDNBSSA-N	249.310	1.935	10	20	BDCD	
Oc1ccccc1CNC[C@H]1CC[C@H](O)C1	188818653	IWYRJVOFKJLDAE-JQWIXIFHSA-N	221.300	1.643	10	20	BDCD	
Cc1cccc(CNC[C@H]2CC[C@H](O)C2)c1O	187987336	BVFAMUXVBMKLCW-AAEUAGOBSA-N	235.327	1.951	10	20	BDCD	
COCCCNC(=O)c1ccc(CN=[N+]=[N-])o1	1537962971	MEUZOOMAMHAMAA-UHFFFAOYSA-N	238.247	1.856	10	20	BDCD	
CNC(=O)[C@H](C)N[C@H](C)c1cc(C)ccc1O	42561414	UPCQXQGLOBJMJO-ZJUUUORDSA-N	236.315	1.486	10	20	BDCD	
OC[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1	92763759	MYWIBLWJLDNDLA-SECBINFHSA-N	241.718	1.860	10	20	BDCD	
CC[C@@H](N[C@H]1C[C@@H](O)C1)c1ccccc1O	294896031	RFOIFYXRJDVRLC-JFGNBEQYSA-N	221.300	1.956	10	20	BDCD	
Cc1cc(CC(=O)NCc2ccccc2O)on1	816912095	JZFDMHXOSDYKNW-UHFFFAOYSA-N	246.266	1.548	10	20	BDCD	
Nc1ccc(NC(=O)C[C@@H](N)C2CC2)cc1	832244830	ZJNJCTSMRYSGAC-LLVKDONJSA-N	219.288	1.335	10	20	BDCD	
COc1cccc(O)c1CN1CCCNCC1	843047690	VQJIQODKNIXVAU-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
C[C@@H]1NCCC[C@@H]1NCc1cc(F)ccc1O	841063573	NQFJXCDNSPOVNN-CABZTGNLSA-N	238.306	1.761	10	20	BDCD	
Cc1cccc(CN[C@H](CN)C2CC2)c1O	841028771	RLYPBXPXTKBPFB-GFCCVEGCSA-N	220.316	1.528	10	20	BDCD	
CCCN1CC[C@H](NCc2ccccc2O)C1	328527889	VNHPPVJJUIVGEQ-ZDUSSCGKSA-N	234.343	1.966	10	20	BDCD	
COC(=O)CN(Cc1ccccc1O)C(C)C	179559582	VHZWMVFRETZCIR-UHFFFAOYSA-N	237.299	1.776	10	20	BDCD	
COc1ccc(O)c(CNC(=O)[C@H]2C[C@H]2C)c1	114543224	IPCRGUJBKKEIDR-KCJUWKMLSA-N	235.283	1.673	10	20	BDCD	
N[C@H](C(=O)O)c1cccc(Br)c1O	72196620	XULSUCHVHYXPMH-LURJTMIESA-N	246.060	1.239	10	20	BDCD	
COCC(C)(C)NCc1ccc(N)cc1	1120371112	QYSATPLRWIRUHT-UHFFFAOYSA-N	208.305	1.783	10	20	BDCD	
Cc1cc(O)c(CN2CCC[C@@H](O)C2)cc1C	298575201	BIZGSSQISWBELX-CYBMUJFWSA-N	235.327	1.966	10	20	BDCD	
Cc1cccc(CN2CC(=O)N[C@H](C)C2)c1O	295091660	TXNVJZTUBNYNCH-SNVBAGLBSA-N	234.299	1.021	10	20	BDCD	
C[C@@H](CCCCN)NCCc1ccc(N)cc1	817957061	IDBGCSNCBGXYLX-LBPRGKRZSA-N	235.375	1.918	10	20	BDCD	
CCOc1ccc(O)c(CN[C@@H]2CC[C@H]2O)c1	818231803	VIMQQCJJZMGLKR-DGCLKSJQSA-N	237.299	1.404	10	20	BDCD	
C[C@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](C)O1	731861923	SOYWLXGCJDCLDI-OCAPTIKFSA-N	241.312	1.703	10	20	BDCD	
CN(CCC(=O)O)C(=O)c1cc(O)cs1	737991947	UUGKTUVJXHJZOT-UHFFFAOYSA-N	229.257	1.000	10	20	BDCD	
Cc1cccc(CN2C[C@H](CN)C[C@H]2C)c1O	843057260	HQPKZQKXOPMRLL-NEPJUHHUSA-N	234.343	1.870	10	20	BDCD	
C[C@@H](C[C@@H](C)N)NCc1cccc(F)c1O	843129576	PXIDOIYLXMHSMR-BDAKNGLRSA-N	226.295	1.747	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H]1CCCNC1	841043870	YBUWOJJOZLFIIP-AWEZNQCLSA-N	247.386	1.903	10	20	BDCD	
C[C@@H]1CNCCN1Cc1cccc(Cl)c1O	843047451	MMXFQRNZLQQXIQ-SECBINFHSA-N	240.734	1.839	10	20	BDCD	
COCCN(C)Cc1cc2c(cc1O)CCC2	921048686	RHUAFNGERUMGKV-UHFFFAOYSA-N	235.327	1.959	10	20	BDCD	
CC(C)[C@H](CO)ONC(=O)c1cc(O)cs1	854830823	XOIJNSRLNAVTSV-QMMMGPOBSA-N	245.300	1.132	10	20	BDCD	
COC[C@H](O)CN[C@H](C)c1ccc(C)cc1O	71264963	YVMWENYSVJPPTL-GHMZBOCLSA-N	239.315	1.359	10	20	BDCD	
COC(=O)[C@@H]1CCN(Cc2ccccc2O)[C@H]1C	787420564	IYECOHSCTKIPNA-CMPLNLGQSA-N	249.310	1.776	10	20	BDCD	
CCOc1ccc(CNC[C@H](C)OC)c(O)c1	785560254	QBEGPQFHXFJUIE-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
O=[N+]([O-])c1ccc(O)c(CNC2CC2)c1	50273166	PNXNZJRXSYVIAP-UHFFFAOYSA-N	208.217	1.552	10	20	BDCD	
CCOC(=O)CCN(C)Cc1ccccc1O	84857715	IQQXESOAOLTAIN-UHFFFAOYSA-N	237.299	1.777	10	20	BDCD	
COCC1(N(C)C(=O)Cc2ccc(N)cc2)CC1	706416735	LYNGSLBFGWBFCJ-UHFFFAOYSA-N	248.326	1.449	10	20	BDCD	
O=C1CC[C@@H](C(=O)NCc2cccc(O)c2O)C1	1521850825	ADPHPLFKQMGWAV-MRVPVSSYSA-N	249.266	1.083	10	20	BDCD	
CCCN(CCO)Cc1ccccc1O	304754399	YUZAJTMSVIPGFN-UHFFFAOYSA-N	209.289	1.597	10	20	BDCD	
OC[C@H]1C[C@@H](NCc2ccccc2O)C1	707607014	UBVWPXVROHIHLD-JGZJWPJOSA-N	207.273	1.253	10	20	BDCD	
NC(=O)[C@H]1CCCCN1Cc1ccccc1O	179553362	NCDJOEODXNQVSW-LLVKDONJSA-N	234.299	1.232	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccnc(F)c1	133832974	BFDFDYFXCWQSMD-UHFFFAOYSA-N	246.241	1.856	10	20	BDCD	
CCOC(=O)[C@H](C)NCc1ccc2c(c1)CCO2	49371147	DTQPWKGTFMNQNM-JTQLQIEISA-N	249.310	1.663	10	20	BDCD	
O=C(O)c1nc(-c2ccc(O)c(O)c2)cs1	381378369	JRCHMAYOCOESRR-UHFFFAOYSA-N	237.236	1.920	10	20	BDCD	
C[C@H](CNCc1cc(F)ccc1O)N(C)C	226619576	DJMXUNIXBOLXHS-SECBINFHSA-N	226.295	1.571	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1	367802726	VCSHBSJSNJYQIV-ITGUQSILSA-N	249.310	1.071	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CC(=O)N[C@H](C)C2)c1	840131786	CVUVXXCDIHOLBS-LLVKDONJSA-N	248.326	1.329	10	20	BDCD	
Cc1nnc(NC(=O)c2cc(O)cs2)n1C	753508280	VPNIAXXBQCUBCI-UHFFFAOYSA-N	238.272	1.143	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)CC1CC(O)C1	191168044	GZLOPDZCJSRJJZ-UHFFFAOYSA-N	248.370	1.955	10	20	BDCD	
COCCCNCc1cc(F)cc(F)c1O	708436291	KUHQQYNEERQDFX-UHFFFAOYSA-N	231.242	1.797	10	20	BDCD	
COc1cccc(O)c1CNCCOC(C)C	757979084	XFDJJDAFUHGUTO-UHFFFAOYSA-N	239.315	1.915	10	20	BDCD	
CCC[C@H]1C(=O)NCCN1Cc1ccc(N)cc1	1262488023	NHJHSUKEKXTZIF-ZDUSSCGKSA-N	247.342	1.369	10	20	BDCD	
Cc1ccc(CNCCC(=O)O)c(O)c1	1594362610	SPNWLBYDWQIYDL-UHFFFAOYSA-N	209.245	1.265	10	20	BDCD	
C[C@H]1CN(C(=O)c2cccc(O)c2O)C[C@@H]1C	126471973	URBKVWXSEISMQM-IUCAKERBSA-N	235.283	1.826	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)C(N)=O	78269005	SICACEHGQLUQKG-UHFFFAOYSA-N	221.304	1.653	10	20	BDCD	
Cc1ccc(O)c(CN2CCCOCC2)c1	132725443	LSZDHPNWHMASFF-UHFFFAOYSA-N	221.300	1.923	10	20	BDCD	
CN(Cc1ccc(N)cc1)Cc1cn(C)nn1	234303645	HGHQMVQOLCTHOT-UHFFFAOYSA-N	231.303	1.029	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(F)c(F)c1	808491710	QDTGTIXTMIVQFO-UHFFFAOYSA-N	242.177	1.280	10	20	BDCD	
Cc1nonc1CNCc1cc(F)ccc1O	809745436	TYRAMVXJWNFLSY-UHFFFAOYSA-N	237.234	1.513	10	20	BDCD	
OC/C=C/CNCc1ccc2c(c1)CCO2	717532497	JWYPWEREGSHURQ-OWOJBTEDSA-N	219.284	1.260	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCC[C@H](C)N)c1	817954320	YMQKPYXCJNPNRY-VHSXEESVSA-N	238.331	1.789	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCC2(N)CC2)c1	902407834	VZBBZOTZZDNNTM-SECBINFHSA-N	236.315	1.543	10	20	BDCD	
C[C@H]1c2nncn2CCN1Cc1ccc(N)cc1	1120268199	BVFGFZWEHLJLOE-JTQLQIEISA-N	243.314	1.437	10	20	BDCD	
C[C@H]1C[C@H](NCc2ccccc2O)CCN1	709372055	SYVZTLIIAKYDFZ-CMPLNLGQSA-N	220.316	1.622	10	20	BDCD	
CO[C@H](C)CC(=O)N(C)Cc1ccccc1O	195495729	JVPNDNMTNOIDCM-SNVBAGLBSA-N	237.299	1.776	10	20	BDCD	
C[C@H]1CCN(CCNCc2ccccc2O)C1	692601765	FOZHECGSHDWEDD-LBPRGKRZSA-N	234.343	1.824	10	20	BDCD	
C[C@@H](NCc1ccccc1O)[C@@H]1CCCNC1	699704010	YUORTUJPCBFGQL-VXGBXAGGSA-N	234.343	1.870	10	20	BDCD	
C[C@H]1COC[C@H]1NC(=O)NCc1ccc(N)cc1	1336978826	VXSUZKAQTHRSOB-JOYOIKCWSA-N	249.314	1.103	10	20	BDCD	
CCOc1ccc(O)c(CN2CC(C)(O)C2)c1	1336755300	RWTVYIXPAAPFSN-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
CO[C@@H]1CCC[C@@H]1C(=O)NCc1ccc(N)cc1	1263303746	HCEFYZBCNKIVQU-QWHCGFSZSA-N	248.326	1.700	10	20	BDCD	
CON(C)CCN[C@H](C)c1cc(F)ccc1O	850478990	JNMRUSWEKBEJLF-SECBINFHSA-N	242.294	1.675	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCN[C@@H](C)C2)c1O	841061559	KCIHKRWJMGXLTK-WCQYABFASA-N	234.343	1.931	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CO[C@H](C)C2)c1	402023692	GDNVGJUMKWBRPY-KOLCDFICSA-N	237.299	1.668	10	20	BDCD	
COC[C@H](NC(=O)Nc1ccc(N)cc1)C1CC1	397353965	JKSBMKLOYUVBFZ-LBPRGKRZSA-N	249.314	1.815	10	20	BDCD	
O=C1NC(=S)S/C1=C/c1cncs1	129882900	SRGZDGRNAGHVDP-ORCRQEGFSA-N	228.323	1.632	10	20	BDCD	
Cc1cc(CNC(=O)c2cccc(O)c2O)on1	126359513	ZFFZCVGSPUMNBH-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
Cc1n[nH]nc1C(=O)N(C)Cc1ccccc1O	189282230	KHEBDNLNFHWESK-UHFFFAOYSA-N	246.270	1.091	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N(C)C)cc2)[C@@H]1CO	191187239	SJHXNKMPUKVEMC-SWLSCSKDSA-N	248.370	1.955	10	20	BDCD	
OCCCN[C@@H]1CCc2cccc(O)c21	296009500	OTEOSLNJOJNZKX-SNVBAGLBSA-N	207.273	1.352	10	20	BDCD	
Cn1ncc(CCCNCc2ccccc2O)n1	293007488	PJMARRBHQJFVKL-UHFFFAOYSA-N	246.314	1.243	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)C1CNC1	817895026	SVXNKSFUAVEUSG-GFCCVEGCSA-N	247.386	1.759	10	20	BDCD	
C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccccc1O	817977879	QZJXHFUCAAMQAY-MVVXRAEJSA-N	218.300	1.261	10	20	BDCD	
Cc1ccc(C(=O)N2CCO[C@@H]3C[C@H]32)c(O)c1O	816901418	LQFKTCLNXCDHGP-NXEZZACHSA-N	249.266	1.020	10	20	BDCD	
C[C@H](N)CN[C@H](C)c1ccc(N(C)C)cc1	817972186	UWPPINVTCIYUCL-WDEREUQCSA-N	221.348	1.750	10	20	BDCD	
CC(=O)C[C@H](C)NC(=O)c1cc(O)cs1	830873447	OJZXJVVRPVQFGZ-LURJTMIESA-N	227.285	1.551	10	20	BDCD	
CC1=NNC(=O)[C@H]1Sc1nccs1	916760448	YKQRFSOITSDDAH-YFKPBYRVSA-N	213.287	1.110	10	20	BDCD	
NC[C@H]1CC[C@@H](NCc2cc(F)ccc2O)C1	841085154	VQOPANUXHMOCCO-JOYOIKCWSA-N	238.306	1.748	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCNC[C@@H]1C	843047158	HOPFCHZKCIBGBN-ZDUSSCGKSA-N	247.386	1.855	10	20	BDCD	
C[C@@H](NCC1(CO)CC1)c1c(O)cccc1F	886534230	DKNGXRAOYWRCJF-SECBINFHSA-N	239.290	1.954	10	20	BDCD	
FCCOCCNCc1ccc2c(c1)CCO2	702633060	OOOQOJDUFCTWEI-UHFFFAOYSA-N	239.290	1.697	10	20	BDCD	
C[C@@H](NC(=O)c1cc(O)cs1)C(F)F	1548717466	IRGTYUJJCZVOCA-SCSAIBSYSA-N	221.228	1.837	10	20	BDCD	
CN[C@H]1CCN(Cc2ccc(F)c(F)c2O)C1	1578609828	ZOEGBLOAXUOYRI-VIFPVBQESA-N	242.269	1.464	10	20	BDCD	
CC(C)C[C@H](O)CNCc1ccccc1O	163761035	BWECKNDQZSWSDA-LBPRGKRZSA-N	223.316	1.889	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H](C(N)=O)C2)cc1	157067830	HNNNCGLMDAAQFR-GFCCVEGCSA-N	247.342	1.060	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@](C)(O)C2CC2)c1	310132944	LBINZXHTPIDVSH-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C[C@H](O)C2(C)C)c1	128112733	FVGLOUWQJLPNTB-STQMWFEESA-N	235.327	1.950	10	20	BDCD	
C[C@H](N[C@H](C)C(=O)N(C)C)c1ccccc1O	36794365	CQIVYBDWPLYURD-VHSXEESVSA-N	236.315	1.520	10	20	BDCD	
COC[C@H](C)CNC(=O)Nc1ccc(N)cc1	45647924	IUMQNIMKSXNPBG-SECBINFHSA-N	237.303	1.673	10	20	BDCD	
O=C(C[C@@H]1CCCN1)NCc1ccccc1O	228420318	WANQFANORAWMID-NSHDSACASA-N	234.299	1.151	10	20	BDCD	
O=C(CNCC1CC1)NCc1ccccc1O	228420289	USOAJQXQVVLDPD-UHFFFAOYSA-N	234.299	1.008	10	20	BDCD	
CC[C@@H](CO)NCc1ccc(C)cc1O	83345887	VNDMMXWEMUJRFW-NSHDSACASA-N	209.289	1.561	10	20	BDCD	
COC(=O)CCC(=O)CSc1nccs1	195438964	HQMZWVBITVVTRT-UHFFFAOYSA-N	245.325	1.758	10	20	BDCD	
C[C@H](CN)CN[C@H](C)c1ccccc1O	817961683	CHXFIXBAVWZMKV-NXEZZACHSA-N	208.305	1.638	10	20	BDCD	
COC/C=C/C(=O)N[C@H](C)c1ccccc1O	827916805	JZJCSAOZSLATAM-VHODGJRUSA-N	235.283	1.772	10	20	BDCD	
O=C(O)CN(Cc1ccccc1O)C(=O)C1CC1	911484763	POLPBHUMDXRLOB-UHFFFAOYSA-N	249.266	1.215	10	20	BDCD	
Nc1ccc(N[C@@H]2CCC[C@@H](N)C2)cc1	848715188	PSWZBZUJYRCSDI-ZYHUDNBSSA-N	205.305	1.951	10	20	BDCD	
CCNC(=S)NCc1ccccc1O	748156583	GRWCZAKXMQPBBV-UHFFFAOYSA-N	210.302	1.376	10	20	BDCD	
NC[C@@H]1CC[C@@H](NCc2cc(F)ccc2O)C1	841085152	VQOPANUXHMOCCO-BXKDBHETSA-N	238.306	1.748	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC[C@H](N)C1	843047418	UQGAISSCKZLGHR-ZDUSSCGKSA-N	233.359	1.594	10	20	BDCD	
Cc1cc(O)c(CN(C)C2CC(N)C2)cc1C	843125353	SZWYMSIZXCROCH-UHFFFAOYSA-N	234.343	1.931	10	20	BDCD	
Cc1ccc(/C=C2\SC(=S)NC2=O)cn1	764887918	JPQOYGLWSQJLSK-YWEYNIOJSA-N	236.321	1.879	10	20	BDCD	
Oc1ccccc1CNCCN1CCC1	389982858	KECRFYFHFYUMMQ-UHFFFAOYSA-N	206.289	1.188	10	20	BDCD	
C[C@H]1COC[C@H](C)N1Cc1ccc(N)cc1	91301839	HENXFLISWTXENK-QWRGUYRKSA-N	220.316	1.878	10	20	BDCD	
CCN(CCC(=O)O)Cc1cccc(C)c1O	1596314731	GYBPPPRDHCHWGR-UHFFFAOYSA-N	237.299	1.997	10	20	BDCD	
CC(=O)N1CC[C@@H](NCc2ccccc2O)C1	152881656	SNEPBVIONVSTPX-GFCCVEGCSA-N	234.299	1.103	10	20	BDCD	
Cc1ccc(O)c(CN2CCN[C@@H](C)[C@H]2C)c1	379473031	UKARXLNTWNJFGE-NWDGAFQWSA-N	234.343	1.883	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](CO)C1)c1cc(F)ccc1O	927146990	HROIXPWZKAUWDK-QXEWZRGKSA-N	239.290	1.953	10	20	BDCD	
COc1cccc(CNC(=O)[C@H]2C[C@@H]2C)c1O	68488614	YLAVUKZVOIRKRU-WPRPVWTQSA-N	235.283	1.673	10	20	BDCD	
C[C@H](NCCn1ccnc1)c1ccccc1O	41119232	HZFUMHDAWLPZMN-NSHDSACASA-N	231.299	1.940	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)CCCN)c1	841081359	VLANYNTUUOZFON-SNVBAGLBSA-N	238.331	1.618	10	20	BDCD	
C[C@@H](N[C@@H](CO)CCF)c1ccccc1O	846207674	BCJSORLFVRDVDB-NXEZZACHSA-N	227.279	1.763	10	20	BDCD	
Cc1cc(O)c(CN[C@@H]2CCCNC2)cc1C	841041656	CWECPXMCTCPBJO-CYBMUJFWSA-N	234.343	1.851	10	20	BDCD	
COC(C)(C)CN(C)C(=O)c1cc(O)cs1	759099013	OLYMBQBGZKCLCI-UHFFFAOYSA-N	243.328	1.951	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCCCCN	1117953462	HQVIKQWGEQDOJE-UHFFFAOYSA-N	235.375	1.890	10	20	BDCD	
CC(C)CC[C@H](N)C(=O)N(C)c1ccc(N)cc1	877074761	RYSHBTGMJGXSGP-ZDUSSCGKSA-N	249.358	1.995	10	20	BDCD	
COc1ccc(O)c(CN[C@@]2(C)CCOC2)c1	164777317	NPFLHJUTEDWAKO-ZDUSSCGKSA-N	237.299	1.669	10	20	BDCD	
O=C(NC[C@H]1CC[C@@H](O)C1)c1cc(O)cs1	789918721	VZCAUPSGDSYKIV-JGVFFNPUSA-N	241.312	1.345	10	20	BDCD	
N[C@H](CC1CC1)C(=O)NCc1ccccc1O	83360980	SCLRARBMNGRUQK-LLVKDONJSA-N	234.299	1.136	10	20	BDCD	
COC(=O)[C@H](NCc1cccc(C)c1O)C1CC1	276458863	KYZKXIGVPCPNFL-GFCCVEGCSA-N	249.310	1.742	10	20	BDCD	
CC(C)(C)C(=O)NCc1ccc(N)cc1	32011619	XUPKULYKSHBJBH-UHFFFAOYSA-N	206.289	1.931	10	20	BDCD	
CN1CCN(Cc2cccc(Cl)c2O)CC1	162804006	QZVTZUPDDKTVNR-UHFFFAOYSA-N	240.734	1.793	10	20	BDCD	
COc1ccc(O)c(CNCC2(O)CCC2)c1	164699461	VWLDCRSJPGKWHG-UHFFFAOYSA-N	237.299	1.405	10	20	BDCD	
C[C@H](NC[C@@H]1CNCCO1)c1ccccc1O	817984034	VCIKIOFLHGPVRD-QWRGUYRKSA-N	236.315	1.031	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2CCCOCC2)cc1	310893809	ZQUKHOPNHAMNFA-ZDUSSCGKSA-N	248.326	1.497	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCNC(=O)CC2)c1	396664130	VDZPQDTXWSVJRB-GFCCVEGCSA-N	248.326	1.459	10	20	BDCD	
COc1c([N+](=O)[O-])ccc(CNC(C)C)c1O	278917536	UIIRTCBGGMZCOG-UHFFFAOYSA-N	240.259	1.807	10	20	BDCD	
CCOc1ccc(O)c(CNC2CC(N)C2)c1	906510705	RJXTZKXJTUOEGJ-UHFFFAOYSA-N	236.315	1.370	10	20	BDCD	
C[C@](O)(CNC(=O)c1cc(O)cs1)C1CC1	743716529	YAOULMAFXRBRHN-NSHDSACASA-N	241.312	1.345	10	20	BDCD	
CNC(=O)[C@@H]1CCCCN1Cc1ccc(N)cc1	44412653	HNLIEAHBPDJHED-ZDUSSCGKSA-N	247.342	1.369	10	20	BDCD	
CCCC[C@@H](CN)NC(=O)Cc1ccc(N)cc1	262596515	KZLZQRILGCHSGT-ZDUSSCGKSA-N	249.358	1.445	10	20	BDCD	
CC(C)C[C@H](CN)NC(=O)Cc1ccc(N)cc1	262591135	CLBKDDMVUZWKFD-CYBMUJFWSA-N	249.358	1.301	10	20	BDCD	
C[C@@H]1C[C@H](NCc2cc(F)ccc2O)CO1	402183633	BQCFVGZFAGROPQ-KCJUWKMLSA-N	225.263	1.798	10	20	BDCD	
Nc1ccc(CN2CCCC3(C2)OCCO3)cc1	133690702	XLPPWDMYDPZNOT-UHFFFAOYSA-N	248.326	1.608	10	20	BDCD	
COc1ccc(CNC[C@H](C)CN)cc1C	258658610	BMGZGCWKZVDBQH-SNVBAGLBSA-N	222.332	1.688	10	20	BDCD	
C[C@H](NC(=O)c1c(F)ccc(O)c1O)C1CC1	276669544	NMKSGOAGOYHUTJ-LURJTMIESA-N	239.246	1.765	10	20	BDCD	
CN(C)c1ccc(CNC(=O)NCCF)cc1	280559833	FQCZGQLABPEJTI-UHFFFAOYSA-N	239.294	1.521	10	20	BDCD	
CNCCN[C@@H](C)c1cc(F)ccc1O	817952899	WJXKDRLBUOOZIN-QMMMGPOBSA-N	212.268	1.401	10	20	BDCD	
CC1=NO[C@H](CNCc2cc(F)ccc2O)C1	826567405	XVIHQRWAUVPTKB-NSHDSACASA-N	238.262	1.786	10	20	BDCD	
COCCOC1CN(Cc2ccccc2O)C1	838988049	RLTAFXLNFFZPEN-UHFFFAOYSA-N	237.299	1.239	10	20	BDCD	
COc1cccc(CNC[C@H](C)CN)c1O	841048533	JYPUNIMBHXISPA-SECBINFHSA-N	224.304	1.085	10	20	BDCD	
CCN[C@H](C)CNCc1cc(OC)ccc1O	841067055	ZZVATBSLZVGQHS-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
C[C@H](CCN)NCc1cccc(F)c1O	841052274	SQRXWZDGQZUXDI-MRVPVSSYSA-N	212.268	1.358	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CCCN2)c1	841035729	LAUAGPSVQBMVAZ-GFCCVEGCSA-N	220.316	1.542	10	20	BDCD	
CCOc1ccc(O)c(CN[C@@H](C)CNC)c1	853250005	XUZNSQOFSPEUAP-JTQLQIEISA-N	238.331	1.488	10	20	BDCD	
C[C@@H]1CC[C@@H](CNCc2ccc(N)cc2)O1	398106445	KNRPMKOZYSJMND-MFKMUULPSA-N	220.316	1.926	10	20	BDCD	
C[C@H](N)C(=O)N[C@H](C)c1ccc(N(C)C)cc1	1574073382	CPHXHNJCISDMEI-VHSXEESVSA-N	235.331	1.277	10	20	BDCD	
CC(C)[C@H](N)C(=O)N[C@H](C)c1ccccc1O	870988047	FAIVLJKMSZMUHI-SKDRFNHKSA-N	236.315	1.553	10	20	BDCD	
C[C@@H](Cn1cccn1)NCc1ccccc1O	37154845	YRWXLBVHCCMDJV-NSHDSACASA-N	231.299	1.767	10	20	BDCD	
C[C@@H](N[C@H]1CCN(C)C1=O)c1ccccc1O	120856262	AHWDXIFYPVROOO-KOLCDFICSA-N	234.299	1.274	10	20	BDCD	
CCNCCNCc1ccc2c(c1)CCCO2	228715311	DSIXMRYREFNJLW-UHFFFAOYSA-N	234.343	1.711	10	20	BDCD	
COC[C@@H](CCO)N[C@H](C)c1ccccc1O	228793928	SPWVTWJNSOXVAH-GHMZBOCLSA-N	239.315	1.440	10	20	BDCD	
COc1ccc(N(C)C[C@@H](C)O)cc1F	192742050	SKXMHSZMYAEWQZ-MRVPVSSYSA-N	213.252	1.651	10	20	BDCD	
CC(C)[C@@H](NCc1cc(F)ccc1O)C(=O)O	232704425	VKECOBDYAXXSRH-LLVKDONJSA-N	241.262	1.730	10	20	BDCD	
COc1cccc(SCC(=O)C(C)=O)c1	289810398	ZDPYVBDPQUQLSZ-UHFFFAOYSA-N	224.281	1.945	10	20	BDCD	
COCC1(NC(=O)c2cc(O)cs2)CC1	807660624	FDJYOMZLSGRGBS-UHFFFAOYSA-N	227.285	1.363	10	20	BDCD	
Cc1ccc([C@@H](C)NC/C=C/CO)c(O)c1	717531293	DPJUROGCWZQKRK-PGLGOXFNSA-N	221.300	1.900	10	20	BDCD	
C[C@@H](N)C[C@@H](C)NCc1ccc(N(C)C)cc1	817894125	BTJNRLBMZOIQPS-VXGBXAGGSA-N	235.375	1.968	10	20	BDCD	
CO[C@@H]1CN(CCN=[N+]=[N-])C[C@@H]1n1cccn1	409432639	LMIXWTZHWZQMRA-VHSXEESVSA-N	236.279	1.065	10	20	BDCD	
CC[C@H](CNCc1ccc(C)cc1O)C(=O)O	1573805446	OWOXNOYWJNSYOY-SNVBAGLBSA-N	237.299	1.901	10	20	BDCD	
Cc1ccc(O)c(CN2CCO[C@H](CF)C2)c1	840955384	UMIOPGPGQMNWBF-GFCCVEGCSA-N	239.290	1.871	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@@H]2CCN(C)C2=O)c1	690257083	GDCGNPZQGMZWQJ-GFCCVEGCSA-N	248.326	1.363	10	20	BDCD	
OC[C@@H](CC1CC1)NCc1cc(F)ccc1O	779099585	LEECHLACNFDGFI-GFCCVEGCSA-N	239.290	1.782	10	20	BDCD	
COc1cccc(CNC(=O)[C@@H](C)OC)c1O	105649389	LFXHXPQXOUDMNO-MRVPVSSYSA-N	239.271	1.052	10	20	BDCD	
CCONC(=O)/C=C/c1ccc(O)c(O)c1	180901623	GNEUTARLMBLJBW-GQCTYLIASA-N	223.228	1.179	10	20	BDCD	
Cc1cccc(CN2CCS(=O)CC2)c1O	162818436	AQHMZLZPUFKXBL-UHFFFAOYSA-N	239.340	1.265	10	20	BDCD	
CN(C)c1ccc(OC[C@H]2CNC(=O)O2)cc1	289320760	CGNJEYVQVGJZHJ-LLVKDONJSA-N	236.271	1.240	10	20	BDCD	
CSC[C@@H](C)NC(=O)c1cc(O)cs1	736710737	LDULVGUQHOZVSX-ZCFIWIBFSA-N	231.342	1.935	10	20	BDCD	
Nc1ccc(NC(=O)C2(N)CCCC2)cc1	843294795	JVHBJNJPJOVIOF-UHFFFAOYSA-N	219.288	1.479	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC[C@@H]2C[C@@H]2C1	856060741	BJCJCBKPTNPUJY-HTQZYQBOSA-N	223.297	1.936	10	20	BDCD	
COc1ccc2c(c1)CCCN2CN1CCC1=O	857234036	DQWXODWWLNASEX-UHFFFAOYSA-N	246.310	1.638	10	20	BDCD	
COC(=O)CCn1ccc2cc(N)ccc21	68959436	WWAGINKXUZAAPD-UHFFFAOYSA-N	218.256	1.787	10	20	BDCD	
O=C(NC[C@@H]1CC[C@@H](O)C1)c1cc(O)cs1	789918720	VZCAUPSGDSYKIV-HTQZYQBOSA-N	241.312	1.345	10	20	BDCD	
CC(C)N1CCN(Cc2ccccc2O)CC1=O	780793630	UKEKFIBFAGHYJC-UHFFFAOYSA-N	248.326	1.445	10	20	BDCD	
Cn1cnnc1CSc1nccs1	161035651	MXRVPUXVYWVMGT-UHFFFAOYSA-N	212.303	1.564	10	20	BDCD	
COCC(=O)CSc1ncc(C(=O)O)s1	1599141225	LFSSDEDDXCWSMZ-UHFFFAOYSA-N	247.297	1.149	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C[C@H]1C[C@@H](O)C1	817274238	GZLOPDZCJSRJJZ-OTVXOJSOSA-N	248.370	1.955	10	20	BDCD	
COc1cccc(O)c1CN1CCC[C@H](N)C1	843043830	JPZHSFXFFDEUHK-JTQLQIEISA-N	236.315	1.324	10	20	BDCD	
CO[C@H](CNC(=O)Nc1ccc(N)cc1)C1CC1	378715195	YFAGLKOKOQYSNH-GFCCVEGCSA-N	249.314	1.815	10	20	BDCD	
C[C@H](C(=O)N(C)c1ccc(N)cc1)N(C)C	877076659	OURUEYRNRRRSJL-SECBINFHSA-N	221.304	1.182	10	20	BDCD	
CC[C@@H]1COCCN1Cc1ccc(N)cc1	36322306	LJKDKPYAZQABHQ-CYBMUJFWSA-N	220.316	1.880	10	20	BDCD	
Oc1ccccc1CNC[C@@H]1CC[C@H](O)C1	188818630	IWYRJVOFKJLDAE-PWSUYJOCSA-N	221.300	1.643	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1O	126784368	ZQJZFEQYCCMRLU-GWCFXTLKSA-N	220.316	1.472	10	20	BDCD	
C[C@@H](C(=O)O)N(C)Cc1ccccc1O	83406841	KJGXRCXISSERAH-QMMMGPOBSA-N	209.245	1.297	10	20	BDCD	
Nc1ccc(CN2CC[C@@H](CO)C2)cc1	161586184	OYFPHOMFBGBTMI-LLVKDONJSA-N	206.289	1.083	10	20	BDCD	
Nc1ccc(NC(=O)N2CCC[C@@H](O)C2)cc1	42471486	KLPVDUXVXAFMOM-LLVKDONJSA-N	235.287	1.257	10	20	BDCD	
CN[C@@H]1CCCN(Cc2cccc(F)c2O)C1	843048539	GBULESLBFGFIOZ-LLVKDONJSA-N	238.306	1.715	10	20	BDCD	
CCOc1ccc(CN[C@H]2C[C@H](O)C2)c(O)c1	850417635	GNAWYLWDUCHXAA-XYPYZODXSA-N	237.299	1.404	10	20	BDCD	
CC(=O)C(=O)CSc1ncc(C(C)(C)C)[nH]1	865382776	BHTOIRBHYMALBG-UHFFFAOYSA-N	240.328	1.957	10	20	BDCD	
CCN(CC)c1ccc(CNC(=O)CN)cc1	83362621	XVMJLOBUMGTPOM-UHFFFAOYSA-N	235.331	1.108	10	20	BDCD	
Nc1ccc(N2C[C@H]3COC[C@@H]3C2)cc1	409425186	FJTXFYGNLHCKNJ-UWVGGRQHSA-N	204.273	1.351	10	20	BDCD	
CN(C(=O)CN=[N+]=[N-])[C@H]1CCSC1	409433629	MZWGIQZUONWQJC-LURJTMIESA-N	200.267	1.261	10	20	BDCD	
C[C@@H](O)[C@@H](C)NCc1ccc(N2CC=CC2)cc1	1327979773	XMCSHSNTDMJVAT-CHWSQXEVSA-N	246.354	1.922	10	20	BDCD	
CC(C)NCC(=O)NCc1ccccc1O	162968648	FGBRQQVREBFLBW-UHFFFAOYSA-N	222.288	1.006	10	20	BDCD	
COC[C@@H](NC(=O)Cc1ccc(N)cc1)C1CC1	125360991	JSMFYPBFHLTHME-CYBMUJFWSA-N	248.326	1.353	10	20	BDCD	
CC[C@H](N)CNCc1ccc(N(C)C)cc1	841070595	RIJNJQNDJIIUBC-LBPRGKRZSA-N	221.348	1.580	10	20	BDCD	
CN(C(=O)/C=C/c1cccnc1)c1cnn(C)c1	173182601	CIXKFUVVMQDYHE-AATRIKPKSA-N	242.282	1.491	10	20	BDCD	
CN(CC(=O)N1CCCC1)c1ccc(N)cc1	20374427	JQASWCVINATNHR-UHFFFAOYSA-N	233.315	1.327	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC(N)=O)c1	171409138	STLDXCBUSCGRKH-ZCFIWIBFSA-N	210.233	1.130	10	20	BDCD	
C[C@@H](NCc1ccccc1O)[C@@H](C)C(=O)O	162956278	ORLUZOBJTMFWEP-RKDXNWHRSA-N	223.272	1.591	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@](C)(O)C2)c1	180634268	IOLBFYOOOUCRDW-ZDUSSCGKSA-N	237.299	1.358	10	20	BDCD	
OC[C@@H]1CC[C@H](CNCc2ccccc2O)O1	292746764	QZMRUAVGRGGPMP-NEPJUHHUSA-N	237.299	1.022	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)c1nccn1C	817955489	BZQXXKUXISRLSQ-NSHDSACASA-N	244.342	1.896	10	20	BDCD	
O=C(NC[C@H]1CCCO1)c1cc(O)cs1	731863891	JBWIPYNQSVFCJG-MRVPVSSYSA-N	227.285	1.363	10	20	BDCD	
O=C(O)CCCCNC(=O)c1cc(O)cs1	739671249	ZZDZUXUWOXLJAI-UHFFFAOYSA-N	243.284	1.438	10	20	BDCD	
CN(C)c1ccc([C@@H](N)CNCC2CC2)cc1	841042076	HKJLFBXWGXPBIJ-AWEZNQCLSA-N	233.359	1.752	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](CCN)C(F)F)c1	841074327	NUSNUHZRUUMQQD-JTQLQIEISA-N	244.285	1.773	10	20	BDCD	
Oc1ccc(F)cc1CN[C@@H]1CCCNC1	841043035	MYZSBJBJYLOMCD-LLVKDONJSA-N	224.279	1.373	10	20	BDCD	
C[C@H](CCN)NCc1cc(F)ccc1O	841052379	UUGCNFOEJDMKHI-MRVPVSSYSA-N	212.268	1.358	10	20	BDCD	
COc1ccc(CN[C@H]2[C@@H]3CNC[C@@H]32)cc1C	841077176	CQAAPJOPLUMVDU-IMRBUKKESA-N	232.327	1.311	10	20	BDCD	
OC[C@H](CNCc1ccccc1O)CC1CC1	850386585	MHDJLWJVYYIXOO-LBPRGKRZSA-N	235.327	1.890	10	20	BDCD	
Cc1cc(CN(C)[C@@H]2CCNC2)ccc1N(C)C	923288568	XTLQIMBELRSTQA-CQSZACIVSA-N	247.386	1.855	10	20	BDCD	
CC[C@@H](OC)C(=O)NCc1cc(C)ccc1O	862758987	SGGOPQKREVPXTO-GFCCVEGCSA-N	237.299	1.742	10	20	BDCD	
CC[C@H](NCc1ccc(C)cc1O)C(=O)NC	877575810	FFHVEPUOXSMVCN-NSHDSACASA-N	236.315	1.315	10	20	BDCD	
CN(C)C(=O)CNCc1c(O)cccc1Cl	83551481	TZLAPDIPSIBHOV-UHFFFAOYSA-N	242.706	1.223	10	20	BDCD	
CO[C@@H](C)CC(=O)NCc1ccccc1O	749941097	FBEPPTCDKFMAOK-VIFPVBQESA-N	223.272	1.433	10	20	BDCD	
CO[C@H](C)CNCc1cccc(C)c1O	191203638	KNUMPAKDOWJTCS-SNVBAGLBSA-N	209.289	1.825	10	20	BDCD	
CC(F)(F)C(=O)[C@H]1CCCC(=O)C1=O	300862940	JJRYZKPQXYYBFD-YFKPBYRVSA-N	204.172	1.149	10	20	BDCD	
CNC[C@H](C)NCc1ccc2c(c1)CCO2	162155167	BARNLDVEHHJHDL-JTQLQIEISA-N	220.316	1.319	10	20	BDCD	
Cc1cccc(CN[C@H]2CCN[C@@H](C)C2)c1O	841061557	KCIHKRWJMGXLTK-AAEUAGOBSA-N	234.343	1.931	10	20	BDCD	
COc1ccc(N(C)C[C@@H](C)N)cc1OC	20239524	MFZJCCQHUWCDMR-SECBINFHSA-N	224.304	1.487	10	20	BDCD	
OCC1(CNCc2cc(Cl)ccc2O)CC1	118907015	ICYYZLJCDGVNSY-UHFFFAOYSA-N	241.718	1.908	10	20	BDCD	
C[C@@H](CNCc1ccc(N(C)C)cc1)N(C)C	38088906	AEXYQKYPVKDSBY-LBPRGKRZSA-N	235.375	1.792	10	20	BDCD	
O=C(C[C@@H]1CCNC1)NCc1ccccc1O	228421164	XHFZCVNFANPYQZ-JTQLQIEISA-N	234.299	1.008	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H]2CCOC2)c1	131191879	NPVIULSMWWYILP-UWVGGRQHSA-N	237.299	1.840	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@H]2C[C@@H](O)C2)c1	296026750	SMCBTWJNNKXQTI-GARJFASQSA-N	221.300	1.875	10	20	BDCD	
COCCCCC(=O)NCc1ccccc1O	299533167	HCTIDLLQVZXARB-UHFFFAOYSA-N	237.299	1.825	10	20	BDCD	
CCN(CC[S@](C)=O)c1ccc(OC)cc1	828172890	UZJQNUJXJUJZEK-INIZCTEOSA-N	241.356	1.900	10	20	BDCD	
C[C@@H](O)CCOC(=O)c1cccc(O)c1O	1327475445	GLZZTNBEBBOMDA-SSDOTTSWSA-N	226.228	1.026	10	20	BDCD	
CCCCC(=O)NCc1cccc(O)c1O	1528771429	PABRXLUWNPPHRL-UHFFFAOYSA-N	223.272	1.904	10	20	BDCD	
COC[C@@H](C)NCc1cc(OC)ccc1O	20087724	IISOBCDJUCVSPD-SECBINFHSA-N	225.288	1.525	10	20	BDCD	
CN(C)c1ccc(CN2CCOCC2)cc1F	154503686	QIBYVBOIKKYSGN-UHFFFAOYSA-N	238.306	1.724	10	20	BDCD	
CCc1cccc(CNCC(=O)NC2CC2)c1O	709429298	GANATUZKTKYEFM-UHFFFAOYSA-N	248.326	1.323	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H](N)CC1CC1	302666578	KGMXIFFUDAPJFB-GFCCVEGCSA-N	248.326	1.478	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@@H](O)C2)c1	127995391	UOJFEJXYMIPTGK-GFCCVEGCSA-N	221.300	1.657	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@@H](C)CO)c1	35602999	DUYOAJLSKAHSLA-DTWKUNHWSA-N	225.288	1.432	10	20	BDCD	
Cc1ccc(O)c(CNCC[C@H](C)O)c1	78780379	PAIFFKDBCXKHLW-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
C[C@@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1	33465778	HDFQIFXNSLHAMP-JTQLQIEISA-N	236.315	1.658	10	20	BDCD	
CN1CCCN(Cc2cc(F)ccc2O)CC1	226561102	JDWMRKIGGJPIAS-UHFFFAOYSA-N	238.306	1.669	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)NCc2ccccc2O)CO1	132779499	OCRIOIMFYCRHFM-KOLCDFICSA-N	235.283	1.433	10	20	BDCD	
C[C@H](O)C[C@H](C)NCc1ccc2c(c1)CCO2	228074560	OSKJWSZOUHNROG-QWRGUYRKSA-N	235.327	1.871	10	20	BDCD	
CCN(CCn1cncn1)c1ccc(OC)cc1	264154262	XARWAAJMFRSGNX-UHFFFAOYSA-N	246.314	1.813	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NOCC1CC1	293759589	LLTMLDJHAAWZJX-GQCTYLIASA-N	249.266	1.569	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](O)C1)c1cc(F)cc(F)c1O	834905796	LJEXDUAEJVWNTA-VDAHYXPESA-N	243.253	1.844	10	20	BDCD	
Oc1ccccc1CNC(=S)NCC1CC1	849256088	OYJXVOXMLIBXJJ-UHFFFAOYSA-N	236.340	1.766	10	20	BDCD	
NCC(F)(F)CNCc1ccc2c(c1)CCO2	841059963	OMWLIPDEHFFPBW-UHFFFAOYSA-N	242.269	1.305	10	20	BDCD	
O=C(NCCOC1CCC1)c1cc(O)cs1	743746864	MMOLMCDKKIAXHA-UHFFFAOYSA-N	241.312	1.753	10	20	BDCD	
O=C(OC[C@H]1CCCO1)c1cccc(O)c1O	758562282	QBYQJNOFKQNKQU-MRVPVSSYSA-N	238.239	1.434	10	20	BDCD	
CC[C@]1(C(=O)Nc2ccc(N)cc2)CCNC1=O	876504264	LDIDMAPUXNFOLD-ZDUSSCGKSA-N	247.298	1.124	10	20	BDCD	
CC[C@@H](NCc1ccc(C)cc1O)C(=O)NC	877575809	FFHVEPUOXSMVCN-LLVKDONJSA-N	236.315	1.315	10	20	BDCD	
C[C@H]1C[C@@H](O)CN1C(=O)c1cc(O)cs1	788592310	QCIVDCWNTLVIST-NKWVEPMBSA-N	227.285	1.049	10	20	BDCD	
CC(C)(CN)NCc1ccc2c(c1)CCCO2	258865593	OWIDYKUGWQGTIS-UHFFFAOYSA-N	234.343	1.839	10	20	BDCD	
COc1ccc(CN[C@H]2C[C@H](O)C2)cc1C	850417914	QWODNWCDUCUQGA-HAQNSBGRSA-N	221.300	1.617	10	20	BDCD	
Oc1ccccc1CN[C@H]1CC[C@H](O)CC1	252704714	OCJYIOTZKSPAQR-HAQNSBGRSA-N	221.300	1.785	10	20	BDCD	
Cc1ccc(C(=O)N(C)C(C)C)c(O)c1O	181860070	KNLQPDVWBXPOJG-UHFFFAOYSA-N	223.272	1.887	10	20	BDCD	
C[C@@H](O)[C@@H]1CCCN(Cc2ccccc2O)C1	136822214	JDVONYTWGVEICU-VXGBXAGGSA-N	235.327	1.985	10	20	BDCD	
Cc1ccc(O)c(CN(CC(=O)O)C2CC2)c1	86751831	OVQRFQJVXIMJBQ-UHFFFAOYSA-N	235.283	1.750	10	20	BDCD	
Oc1cc2c(cc1CNCc1ncc[nH]1)OCO2	80580888	MFKHMPZOEGBODU-UHFFFAOYSA-N	247.254	1.134	10	20	BDCD	
C[C@H](CN)N(C)Cc1c(O)cccc1Cl	383024996	XWUDLWNPJJUFAI-MRVPVSSYSA-N	228.723	1.825	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2CCCNC2)c1	841033415	UIRNPWDWXJGDOX-LBPRGKRZSA-N	234.343	1.790	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H](N)C2)cc1C	843045454	RKRZXGSWNKEHDR-GFCCVEGCSA-N	220.316	1.542	10	20	BDCD	
CCOc1ccc(O)c(CNCCCNC)c1	841043141	RMVOODNKAYXKNG-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
O=C(NCCn1cccc1)c1cc(O)cs1	748370991	WOGURCPVFWQPMH-UHFFFAOYSA-N	236.296	1.685	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)C[C@@H](C)N	863652771	WZCQZQPXAGDPGT-GFCCVEGCSA-N	235.375	1.840	10	20	BDCD	
COc1cc(CN2CCO[C@H]3C[C@H]32)c(O)cc1C	793621691	ZQQRRUAUIAYKTO-RISCZKNCSA-N	249.310	1.682	10	20	BDCD	
CCc1cccc(CNCCCCO)c1O	691469734	YEVOIDXXAHFLQJ-UHFFFAOYSA-N	223.316	1.817	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@@H]1COCCO1	690818244	CMWPVJOXGYDRGV-CYBMUJFWSA-N	236.315	1.116	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCC[C@H]1CO	1328105905	DXQIYQKGJUSOEJ-QMMMGPOBSA-N	241.312	1.441	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@@H]1C[C@H]1F	1352304147	ZZRYTVXGKHZTAL-RKDXNWHRSA-N	225.219	1.072	10	20	BDCD	
COc1ccc2c(c1)CCCCN2CC(=O)O	1610350909	JIJUQMDAZXCSMO-UHFFFAOYSA-N	235.283	1.923	10	20	BDCD	
CN(C)CCCNCc1ccccc1O	19958357	MULAZUQKYDJFFW-UHFFFAOYSA-N	208.305	1.434	10	20	BDCD	
CON(C)CCN[C@@H](C)c1ccc(F)cc1O	850479433	SUGQYOWMYOEIFV-VIFPVBQESA-N	242.294	1.675	10	20	BDCD	
C[C@@H]1[C@H](CO)CCN1C(=O)Cc1ccc(N)cc1	385964778	ZIXICMMDTUAGQM-PWSUYJOCSA-N	248.326	1.041	10	20	BDCD	
CO[C@H](C)CN(C)c1ccc2c(c1)OCO2	182365652	GZYPFMMDXMXICU-SECBINFHSA-N	223.272	1.886	10	20	BDCD	
O=C(Cc1cccnc1)NCc1ccccc1O	134500578	PSOPXKUNGWGZFX-UHFFFAOYSA-N	242.278	1.646	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2C[C@H]3CC[C@H]2NC3)c1	530245897	HBCKZIHKURNGOQ-MRVWCRGKSA-N	246.354	1.931	10	20	BDCD	
C[C@H]1C[C@@H](CO)CCN1Cc1ccccc1O	290144725	KPMDALLQQACRHE-RYUDHWBXSA-N	235.327	1.985	10	20	BDCD	
NCCCCC(=O)NCCc1ccc(N)cc1	832659303	ZEZITCUENNMHNL-UHFFFAOYSA-N	235.331	1.057	10	20	BDCD	
CNC[C@H](C)CN[C@@H]1CCc2cccc(O)c21	1118122431	WTXWLGFKGBANEA-CMPLNLGQSA-N	234.343	1.825	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](O)[C@H](C)C2)c1	897684010	JCLFFDBFUCOINX-ZWNOBZJWSA-N	221.300	1.513	10	20	BDCD	
Oc1ccc(F)cc1CN[C@H]1CC[C@H](O)CC1	272506145	WJMQZKZCYZWVQO-HAQNSBGRSA-N	239.290	1.924	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@H]1C[C@@H](O)C1)CC2	720991736	IMZKOUDRTPHHKO-ADEWGFFLSA-N	233.311	1.740	10	20	BDCD	
CCOCC(=O)N(C)c1ccc(N)cc1	20373744	XFCZCIMGBKXODO-UHFFFAOYSA-N	208.261	1.268	10	20	BDCD	
C[C@@]1(C(=O)O)CCN(Cc2ccc(N)cc2)C1	1604500049	CORUYCFUUPBUJT-CYBMUJFWSA-N	234.299	1.565	10	20	BDCD	
CCn1ccnc1CNCc1ccccc1O	134294522	QQQKZSYWYHZEQA-UHFFFAOYSA-N	231.299	1.898	10	20	BDCD	
CC[C@H](CO)NCc1cc(Cl)ccc1O	20195363	YGMAKENSWRMOLK-SNVBAGLBSA-N	229.707	1.906	10	20	BDCD	
CC(=O)C(=O)CSc1nnc(C)s1	308169582	ZAEYSCCATUNQDO-UHFFFAOYSA-N	216.287	1.097	10	20	BDCD	
C[C@@H](NCCO)c1cc(Cl)ccc1O	134910566	UIBUDCOAVONEEH-SSDOTTSWSA-N	215.680	1.689	10	20	BDCD	
Oc1ccccc1CN1C[C@@H]2CCCN[C@@H]2C1	221427770	PTCPJIJVOXCWTL-WCQYABFASA-N	232.327	1.576	10	20	BDCD	
CC(C)[C@H](CO)CNC(=O)c1cc(O)cs1	807777359	OYYLYSUKBZAISH-QMMMGPOBSA-N	243.328	1.448	10	20	BDCD	
Cc1cc(O)c(CNCCCON)cc1C	904457365	QDIWWZLCKBSXBL-UHFFFAOYSA-N	224.304	1.379	10	20	BDCD	
COc1ccc(N(C)Cc2cnon2)cc1F	851807700	HSDMZHMSVJMNIG-UHFFFAOYSA-N	237.234	1.854	10	20	BDCD	
CN(CC1(C)COC1)c1ccc2c(c1)OCO2	756655470	WDEJHQSAPKOSJJ-UHFFFAOYSA-N	235.283	1.888	10	20	BDCD	
C[C@H](O)CCN(C)C(=O)c1cc(O)cs1	764324443	NCVHNJIYDWFDKD-ZETCQYMHSA-N	229.301	1.297	10	20	BDCD	
CCOCCC(=O)NCc1ccc(O)c(O)c1	768917871	XFWXKYDDFSOATC-UHFFFAOYSA-N	239.271	1.141	10	20	BDCD	
COC(=O)[C@H]1C[C@H](NCc2c(C)cccc2O)C1	877641476	VPOOJKYHODNENB-XYPYZODXSA-N	249.310	1.742	10	20	BDCD	
c1cc2c(cc1CN[C@@H]1CCCOC1)CCO2	103962854	VRHFLUHSHDXODY-CYBMUJFWSA-N	233.311	1.890	10	20	BDCD	
CNC[C@@H]1CCCN(Cc2ccc(N)cc2)C1	1337833978	IWPJJSFMHUGBAK-ZDUSSCGKSA-N	233.359	1.700	10	20	BDCD	
C[C@H](CCN)NCc1cc(F)c(F)cc1O	1575962376	QQPLOQBCXJLKPY-SSDOTTSWSA-N	230.258	1.497	10	20	BDCD	
Cc1cccc(CNC[C@@H](O)C2CC2)c1O	165163834	ZWWSCTOCUUOECT-GFCCVEGCSA-N	221.300	1.561	10	20	BDCD	
COc1cccc(O)c1CN1[C@H]2CC[C@H]1COC2	839180864	TUOWDMURDMAJSC-QWRGUYRKSA-N	249.310	1.764	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cnccn1	42116500	XRMAAERQZYWIOW-UHFFFAOYSA-N	243.266	1.454	10	20	BDCD	
CN(C)c1ccc(CNCCCCN)cc1	37714611	IAHGWPFDLUCFDS-UHFFFAOYSA-N	221.348	1.581	10	20	BDCD	
CC(C)N(CCO)Cc1ccccc1O	128549990	BGRQZRXGXOWAEO-UHFFFAOYSA-N	209.289	1.595	10	20	BDCD	
CCCOCC(=O)N(C)c1ccc(N)cc1	37285462	MATIVMNAYVKWJE-UHFFFAOYSA-N	222.288	1.658	10	20	BDCD	
C[C@H](O)CN(C)Cc1cc(Cl)ccc1O	130639531	QCHQLSNQXBZIKK-QMMMGPOBSA-N	229.707	1.858	10	20	BDCD	
CC(C)(N)CCNCc1ccccc1O	379849046	INGKFPLWMANLKI-UHFFFAOYSA-N	208.305	1.609	10	20	BDCD	
CNCCCNCc1ccc2c(c1)CCCO2	228395533	DEAMGCJKFCYNBG-UHFFFAOYSA-N	234.343	1.711	10	20	BDCD	
C[C@@H](NCC1OCCO1)c1ccccc1O	381339589	XCFDDNPEVWNIAL-SECBINFHSA-N	223.272	1.416	10	20	BDCD	
C[C@H](NC[C@@H](C)CO)c1cc(F)ccc1O	87111424	IJJORDKEBAVHLH-BDAKNGLRSA-N	227.279	1.810	10	20	BDCD	
CC(=O)C(=O)COc1ccc([N+](=O)[O-])c(C)c1	808016493	NKVMMBNPZPKMPK-UHFFFAOYSA-N	237.211	1.440	10	20	BDCD	
CCNCCN[C@@H](C)c1cc(OC)ccc1O	817951895	KXWSLDUBVBZABI-JTQLQIEISA-N	238.331	1.661	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](C)C(=O)O)cc1C	818849293	OJINRUWLWKMLGB-VIFPVBQESA-N	223.272	1.572	10	20	BDCD	
Cc1cnc(CCNCc2ccccc2O)cn1	835061499	MDSUBWSHOFHFON-UHFFFAOYSA-N	243.310	1.823	10	20	BDCD	
CCCCC(=O)NCc1ccc(O)cc1O	910952508	WFESUNPRESRXLJ-UHFFFAOYSA-N	223.272	1.904	10	20	BDCD	
Cc1cccc(CN[C@H](C)C[C@@H](C)N)c1O	843129550	PPFDTAJXUVKKSN-GHMZBOCLSA-N	222.332	1.916	10	20	BDCD	
CN(CC(=O)Nc1ccc(N)cc1)C(=O)C1CC1	843296010	WFVGFBRXDXTGDD-UHFFFAOYSA-N	247.298	1.076	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H]1C[C@H](F)CN1	841077320	AGUBAWSSEPNQDR-QWRGUYRKSA-N	242.269	1.321	10	20	BDCD	
COC[C@@H]1CC(F)(F)CN1C(=O)CN=[N+]=[N-]	409429484	HNQIKKCPJYMKGS-LURJTMIESA-N	234.206	1.179	10	20	BDCD	
Cc1c(NC(=O)c2cccc(O)c2O)cnn1C	193132054	MEBFRAWJOAUKSN-UHFFFAOYSA-N	247.254	1.392	10	20	BDCD	
CCCN(C)C(=O)NCc1ccc(N)cc1	1338792388	FCZZRJICKFDHHJ-UHFFFAOYSA-N	221.304	1.820	10	20	BDCD	
CCN(CC)c1ccc([C@H](N)CO)cc1	72198072	IACKUZRDXAIBBW-GFCCVEGCSA-N	208.305	1.525	10	20	BDCD	
CO[C@H]1CCN(Cc2ccccc2O)C1	234903072	BJRIDLNRQGBHAX-NSHDSACASA-N	207.273	1.613	10	20	BDCD	
Cc1cccc(CN(C)CC(=O)NC2CC2)c1O	179606749	AHVGYTUNTIJLHC-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
Cc1ccc(O)c(CN(C)C[C@H](O)C2CC2)c1	809751775	KGFPMAQVECMUKO-AWEZNQCLSA-N	235.327	1.903	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)CC(=O)O	901575319	OCQDNONWGJHYSC-UHFFFAOYSA-N	236.315	1.577	10	20	BDCD	
Nc1ccc(CN2CC(=O)N(C3CC3)C2)cc1	1356083141	LGAWJJCPYXPMON-UHFFFAOYSA-N	231.299	1.033	10	20	BDCD	
CN(C)c1ccc(CNC(=O)c2cnco2)cc1	758146349	TUKPOXIMXYRCJR-UHFFFAOYSA-N	245.282	1.671	10	20	BDCD	
CNC[C@H](C)N[C@H](C)c1ccc(C)cc1O	854232738	SKNSDZOCPDTFDI-WDEREUQCSA-N	222.332	1.959	10	20	BDCD	
Cc1cc(O)c(CN2C[C@H]3CNC[C@@H]3C2)cc1C	770395095	OOPJACQIPRKUSF-ZIAGYGMSSA-N	246.354	1.660	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCCO1	785430660	BPLSMWKAPNJBRF-UHFFFAOYSA-N	213.258	1.621	10	20	BDCD	
CNCCCNCc1ccc(OC)c(C)c1	83352247	QQUKAXNMBQTPNA-UHFFFAOYSA-N	222.332	1.703	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CCCOC2)c1	103960260	MKXYBDJHMZQYRY-LLVKDONJSA-N	237.299	1.669	10	20	BDCD	
CCOC1[C@H]2C[C@H]1CN(CCN=[N+]=[N-])C2	409429834	PJQLXJMJFKXGPN-IUCAKERBSA-N	210.281	1.654	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CCCCN2)cc1	169815806	AUXBWFKJZCBIBL-NSHDSACASA-N	219.288	1.349	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@@H]1CCC=CO1	1263894830	WZRASASDOFYNRG-NSHDSACASA-N	249.266	1.407	10	20	BDCD	
CC(C)[C@@H](C(=O)NCc1ccc(N)cc1)[C@@H](C)N	1515331488	FFDFRQPUJDECCT-ZWNOBZJWSA-N	249.358	1.504	10	20	BDCD	
CC[C@@H](O)CCNCc1cccc(C)c1O	162707601	OGZPYHXVMOFFQT-GFCCVEGCSA-N	223.316	1.951	10	20	BDCD	
Cc1cccc(CN2CCCN(C)CC2)c1O	124495069	LWUHOMKXPZVNPV-UHFFFAOYSA-N	234.343	1.838	10	20	BDCD	
C[C@@H]1C[C@H](N)CCN1C(=O)Cc1ccc(N)cc1	237396753	QYYKDHPTONFRNY-ZWNOBZJWSA-N	247.342	1.150	10	20	BDCD	
Oc1ccccc1CNC[C@@H]1CCCCN1	236564371	IXSDPYCEWSQMMZ-LBPRGKRZSA-N	220.316	1.624	10	20	BDCD	
Cc1ccc(O)c(CNc2nnc(CO)o2)c1	283854944	KKBUXCGITAWABQ-UHFFFAOYSA-N	235.243	1.188	10	20	BDCD	
OC[C@@H]1CCCN(Cc2ccccc2O)CC1	294100232	RZZTZBIDJZAPRL-GFCCVEGCSA-N	235.327	1.987	10	20	BDCD	
C[C@H](N)CCN[C@H](C)c1ccccc1O	817952229	IRJLRNSTGUMCKE-VHSXEESVSA-N	208.305	1.780	10	20	BDCD	
OC/C=C\CN[C@@H]1CCc2cccc(O)c21	717532239	IJADYHRJSWGVKJ-RFMOXSJOSA-N	219.284	1.518	10	20	BDCD	
Cc1ccc(O)c(CN=c2nc[nH]n2C(C)C)c1	840886564	GXUXAUSWOAFTHF-UHFFFAOYSA-N	246.314	1.907	10	20	BDCD	
CC(=O)CCCOC(=O)c1cccc(O)c1O	758581886	OZOWBIYRICVVLW-UHFFFAOYSA-N	238.239	1.624	10	20	BDCD	
Oc1cc2c(cc1CN1C[C@@H]3C[C@H]3C1)OCO2	862440001	DCRHELDULOQMAF-IUCAKERBSA-N	233.267	1.573	10	20	BDCD	
COCCCN(C)Cc1c(O)cccc1OC	769138839	AWGQUXGQVVOBJK-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
CC(C)[C@H](O)COC(=O)c1cccc(O)c1O	1118459102	STTSALAQDITJGL-SNVBAGLBSA-N	240.255	1.272	10	20	BDCD	
Cc1cccc(O)c1CNCC1(CC(N)=O)CC1	877594511	GYEUDLBECUVJKO-UHFFFAOYSA-N	248.326	1.446	10	20	BDCD	
C[C@@H]1CCN[C@@H](C(=O)N(C)c2ccc(N)cc2)C1	877076705	UDDXLQQQDSQLFI-ZWNOBZJWSA-N	247.342	1.620	10	20	BDCD	
Oc1c(F)cc(Cl)cc1CN1CC[C@H](O)C1	775648588	DEQHFAWYFZPYLU-VIFPVBQESA-N	245.681	1.751	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@@H](C)c1c(O)cccc1F	886543171	LIVPPSBYLVVUBP-YUMQZZPRSA-N	240.278	1.446	10	20	BDCD	
CCOC(=O)[C@@H]1CCN(Cc2ccccc2O)C1	896961870	GMBBMIWOSQGKDZ-GFCCVEGCSA-N	249.310	1.777	10	20	BDCD	
CSCCNC(=O)NCc1ccc(N)cc1	1336975226	KENZKRHBKLOPFN-UHFFFAOYSA-N	239.344	1.431	10	20	BDCD	
CC[S@@](C)(=O)=NC(=O)c1cccc(O)c1O	395788108	ROXMUZKKBMHONQ-MRXNPFEDSA-N	243.284	1.356	10	20	BDCD	
CCc1cccc(CNCCC(=O)NC)c1O	691491618	DPKZYBVQEXRDAZ-UHFFFAOYSA-N	236.315	1.180	10	20	BDCD	
Nc1ccc(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)cc1	1337833995	JOIHHEALCWOPMG-AEGPPILISA-N	245.370	1.828	10	20	BDCD	
Cc1cccc(CN2CC[C@H](C(=O)O)[C@@H]2C)c1O	1600532811	WRXPQWFWSCIUNR-JQWIXIFHSA-N	249.310	1.996	10	20	BDCD	
CCOCCCNCc1cccc(OC)c1O	19962929	CLBCMFPVDFIOQH-UHFFFAOYSA-N	239.315	1.917	10	20	BDCD	
OC[C@H](NCc1c(O)cccc1Cl)C1CC1	309576829	PBPJVHPUGFDNKV-NSHDSACASA-N	241.718	1.906	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@H]2C[C@H]2C1	699172569	JUTQLVFGCSXLKO-IUCAKERBSA-N	233.267	1.580	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1CCNC1	843357327	INUPKRWIXVXEFO-NSHDSACASA-N	220.316	1.434	10	20	BDCD	
Cc1cccc(CNC[C@H]2CCCN2C)c1O	224569607	SEGHZEJGPAPJNX-CYBMUJFWSA-N	234.343	1.884	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CC(=O)N(C)C2)c1	264977738	SWVHMRQKIXUGLI-NSHDSACASA-N	234.299	1.021	10	20	BDCD	
C[C@H]1OCC[C@]1(C)NC(=O)Nc1ccc(N)cc1	235617150	BSSTUCMMGFMUNW-RNCFNFMXSA-N	249.314	1.958	10	20	BDCD	
Nc1ccc(CCNC(=O)C2(N)CCCC2)cc1	262438275	MGRNLCXJYPEANE-UHFFFAOYSA-N	247.342	1.199	10	20	BDCD	
Cc1cc(O)c(CN[C@@H]2CC(=O)N(C)C2)cc1C	266204935	MHNXCSVKFLGXDH-GFCCVEGCSA-N	248.326	1.329	10	20	BDCD	
O=C(COC(F)F)NCc1ccccc1O	802777933	SOAXYUNDVVTWSX-UHFFFAOYSA-N	231.198	1.248	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cc2ccccc2o1	808484134	KIRMXJAUHAXAIM-UHFFFAOYSA-N	246.218	1.748	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)C[C@H](C)N)c1	843128162	IIJBBYWEMVXPEG-WDEREUQCSA-N	222.332	1.916	10	20	BDCD	
CC1CC(NC(=O)NCCc2ccc(N)cc2)C1	841849536	ZOPKZLSESZJKJK-UHFFFAOYSA-N	247.342	1.909	10	20	BDCD	
C[C@@H](O)[C@H]1CCCN1C(=O)c1cc(O)cs1	855869358	MQRACYDTYGWKKN-VXNVDRBHSA-N	241.312	1.439	10	20	BDCD	
Cc1ccc(CN2CCO[C@@H](C)C2)c(O)c1	876557022	DUMPTKQLSGMIAJ-NSHDSACASA-N	221.300	1.921	10	20	BDCD	
CC(C)[C@H](N)C(=O)N(C)c1ccc(N)cc1	877079153	SNVFNVQGZNGTDN-NSHDSACASA-N	221.304	1.215	10	20	BDCD	
COCCCNCc1cc(C)cc(OC)c1O	894145626	FVDTVOFKEFZSAW-UHFFFAOYSA-N	239.315	1.835	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@@H]1CCOC1	87784407	NTBIMHREWYAGHS-SNVBAGLBSA-N	227.691	1.924	10	20	BDCD	
COc1cccc(CNC(=O)[C@@H]2C[C@@H]2C)c1O	68488616	YLAVUKZVOIRKRU-WCBMZHEXSA-N	235.283	1.673	10	20	BDCD	
C[C@H](N[C@H](C)CO)c1cc([N+](=O)[O-])ccc1O	273435647	WWHNQNDCKOLWAB-SFYZADRCSA-N	240.259	1.332	10	20	BDCD	
C[C@@H](C[C@@H](C)N)NCc1ccc(N(C)C)cc1	817894122	BTJNRLBMZOIQPS-NEPJUHHUSA-N	235.375	1.968	10	20	BDCD	
CCCNC(=O)COC(=O)c1cc(O)cs1	731910460	RRYSBTJWFLIVDE-UHFFFAOYSA-N	243.284	1.137	10	20	BDCD	
CO[C@H](C)C(=O)NCc1cc(C)ccc1O	862759119	WPNFWTKJQPQFMM-SECBINFHSA-N	223.272	1.352	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@@H](N)C2)c1	70955775	UVPIYEPCWUUVER-GFCCVEGCSA-N	220.316	1.624	10	20	BDCD	
CNC(=S)N[C@H](C)c1ccc(N(C)C)cc1	774256866	OUYLMFIQPSMQFG-SECBINFHSA-N	237.372	1.908	10	20	BDCD	
Cc1ccc(CNCc2cn(C)nn2)c(O)c1	877194455	NEDZDCIPLCMURC-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@@H]1CCC=CO1	778927883	VSCDMLJNPBPOQE-LBPRGKRZSA-N	249.266	1.407	10	20	BDCD	
CCN1CCC[C@@H]1CNCc1ccccc1O	19959871	VYZFVGWSSXTIKK-CYBMUJFWSA-N	234.343	1.966	10	20	BDCD	
COc1ccc(N(C)CC2(CO)COC2)cc1	258869406	BEGLMAMOJMDMMF-UHFFFAOYSA-N	237.299	1.140	10	20	BDCD	
CC[C@H](NCc1ccc2c(c1)CCO2)[C@@H](C)O	386857609	JBHXACFPALARIC-MFKMUULPSA-N	235.327	1.871	10	20	BDCD	
COc1ccc(O)c(CN2CCNC[C@@H]2C)c1	722387076	NIKMQJPDJQRGTH-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
C[C@@H](NCc1cc[nH]n1)c1ccccc1O	41014124	XPRVGRJUPIZNFH-SECBINFHSA-N	217.272	1.966	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cccc(C)c1O	83352579	TUPHZTZUPIFTGT-SECBINFHSA-N	223.272	1.352	10	20	BDCD	
CN(Cc1c(O)cccc1Cl)C1CC(N)C1	384866977	OAGHPEIJUOKUFK-UHFFFAOYSA-N	240.734	1.967	10	20	BDCD	
Nc1ccc(CN(CCO)CC(F)F)cc1	231310561	NMJGNGVAXFGZBJ-UHFFFAOYSA-N	230.258	1.328	10	20	BDCD	
CN(C(=O)c1cc(O)cs1)[C@@H]1CCCOC1	807678258	HCMCNPBUSYZVFW-MRVPVSSYSA-N	241.312	1.705	10	20	BDCD	
CCCNCCN[C@@H]1CCc2cccc(O)c21	817963662	WWUYSOKIMVMJEN-GFCCVEGCSA-N	234.343	1.969	10	20	BDCD	
Nc1ccc(CCNCC[C@@H]2CCOC2)cc1	841038774	QCEWSSIJIFFJJW-CYBMUJFWSA-N	234.343	1.828	10	20	BDCD	
C[C@H]1C[C@H](NCc2cc(F)ccc2O)CCN1	841062933	ZMOZHXMWGBPUSZ-JOYOIKCWSA-N	238.306	1.761	10	20	BDCD	
C[C@H](CN)CNCc1cc(Cl)ccc1O	841048313	HHCBCSBDZOQTTR-MRVPVSSYSA-N	228.723	1.730	10	20	BDCD	
COc1ccc(O)c(CNC2=NCCCN2C)c1	849009041	SPSUSZAOWPJDGK-UHFFFAOYSA-N	249.314	1.182	10	20	BDCD	
C[C@@H](NCc1ccc2c(c1)CCO2)C1(CO)CC1	696129926	FBYWMHJSCSOUPP-LLVKDONJSA-N	247.338	1.872	10	20	BDCD	
Cc1ccc(C(=O)N2N[C@H]3CC[C@H]2C3)c(O)c1O	862910453	SNQDPZAEMUSXTR-IUCAKERBSA-N	248.282	1.288	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@H]1C[C@H](O)C1	708438149	VIFAMMOPPXTNMH-GVJMRKKJSA-N	243.253	1.531	10	20	BDCD	
CCc1cccc(CNCC(=O)N(C)C)c1O	709424988	TWACSGIPXKBALD-UHFFFAOYSA-N	236.315	1.132	10	20	BDCD	
Cc1ccc(C(=O)NOC2CCC2)c(O)c1O	1324936503	HTLIHIQRBMXGOR-UHFFFAOYSA-N	237.255	1.620	10	20	BDCD	
Oc1cccc2c1[C@@H](NCc1cc[nH]n1)CC2	383663180	MFZDTGGVEKRPDA-NSHDSACASA-N	229.283	1.892	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](O)C(C)C)c1	123905814	AFVPJOOCPKZNFD-CYBMUJFWSA-N	223.316	1.807	10	20	BDCD	
COc1cccc(CN2CC[C@@](C)(O)C2)c1O	180195007	DFIZANLURKSGNK-CYBMUJFWSA-N	237.299	1.358	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H](CO)C2)c1	305205685	ODXCSSBRXNCKBN-LBPRGKRZSA-N	235.327	1.905	10	20	BDCD	
CCCN1CCN(Cc2ccccc2O)CC1	131691431	CQWOFAXPOKTVTP-UHFFFAOYSA-N	234.343	1.920	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](C)CCO)c1	97436196	PQMBMGKLRGJOEL-JTQLQIEISA-N	239.315	1.509	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H]2CCNC2)c(O)c1	817944586	HGRSXBNSDIXAFX-QWRGUYRKSA-N	220.316	1.713	10	20	BDCD	
CCO[C@H](C)C(=O)NCc1ccccc1O	748346433	XCOCGAJDYUZWFF-SECBINFHSA-N	223.272	1.433	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC[C@@H](CO)C1	840913556	XSPNLACPAQNEEP-CYBMUJFWSA-N	248.370	1.875	10	20	BDCD	
COCC1(NC(=O)c2cccc(O)c2O)CC1	697477015	DRHUGAVGTZLQSM-UHFFFAOYSA-N	237.255	1.007	10	20	BDCD	
C[C@@H](O)CCc1cn(-c2ccc(N)cc2)nn1	864620518	QQKBWUYRYJMPQL-SECBINFHSA-N	232.287	1.163	10	20	BDCD	
COC(=O)CC1(NCc2ccccc2O)CCC1	779110695	DDVPCNMNNNPGLK-UHFFFAOYSA-N	249.310	1.968	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C[C@H](C)O)c(O)c1	877195862	PBDIYTNQKWHZFV-QWRGUYRKSA-N	223.316	1.950	10	20	BDCD	
CC1=NO[C@@H](CNCc2c(C)cccc2O)C1	895305423	SDZBIJAWKCSQKB-LLVKDONJSA-N	234.299	1.955	10	20	BDCD	
CCO[C@H]1CN(CCN=[N+]=[N-])C[C@H]1OCC	409430441	IOUKTVSZWMZCFZ-AOOOYVTPSA-N	228.296	1.423	10	20	BDCD	
Cc1cccc(CNC[C@H]2C[C@H](O)C2)c1O	720976132	CYAUKCIUWAERDP-UMSPYCQHSA-N	221.300	1.561	10	20	BDCD	
C[C@@H]1C[C@@H]1C(=O)NCc1cccc(O)c1O	1521852479	WLWAGZLJOJPOKK-APPZFPTMSA-N	221.256	1.370	10	20	BDCD	
Oc1ccc(Br)c(O)c1O	33861528	TYRFQQZIVRBJAK-UHFFFAOYSA-N	205.007	1.566	10	20	BDCD	in-vitro
OCC1(NCc2cc(F)ccc2O)CCCC1	226620213	SGPOIJBNDLAFFU-UHFFFAOYSA-N	239.290	1.926	10	20	BDCD	
CNC(=O)N1CCOc2cc(N(C)C)ccc21	176657957	IFQGFCRDEBEJNE-UHFFFAOYSA-N	235.287	1.291	10	20	BDCD	
C[C@H](O)CN[C@H](C)c1cc(F)ccc1O	87111361	CECSZDLHXUAKEF-JGVFFNPUSA-N	213.252	1.563	10	20	BDCD	
C[C@@H](CO)CNCc1ccc(N(C)C)cc1	88195049	NAGJLYSHLZJTTM-LLVKDONJSA-N	222.332	1.471	10	20	BDCD	
CC(C)N(CC(=O)O)Cc1cc(F)ccc1O	232670623	HRHDSICCZFVGQK-UHFFFAOYSA-N	241.262	1.826	10	20	BDCD	
COC(=O)c1cnc(S[C@@H](C)[C@H](C)O)s1	296375523	VYKGZKMLLNOUOV-WDSKDSINSA-N	247.341	1.791	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)c1nccn1C	817955488	BZQXXKUXISRLSQ-LLVKDONJSA-N	244.342	1.896	10	20	BDCD	
CC(C)[C@@H](C(=O)Nc1ccc(N)cc1)[C@H](C)N	818556218	BLRQSZJEEZVFFG-JOYOIKCWSA-N	235.331	1.827	10	20	BDCD	
CCNCCNCc1cccc(C)c1O	841035695	JLMYHDNZEKZQPV-UHFFFAOYSA-N	208.305	1.400	10	20	BDCD	
COc1ccc(N(C)CCN(C)C(N)=O)cc1	844281750	PHCBKSFRMKPINY-UHFFFAOYSA-N	237.303	1.142	10	20	BDCD	
Cc1nn(C)cc1CNCCc1ccc(N)cc1	841036584	WOQNXSHGXQDHTH-UHFFFAOYSA-N	244.342	1.643	10	20	BDCD	
CNC[C@H](C)NCc1ccc(N(C)C)cc1C	853250013	YBBCVULVJLRZLH-LBPRGKRZSA-N	235.375	1.759	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1C[C@H]2C[C@H]2C1	862557480	XGCCGEZMUSAFOK-BUYCOLMZSA-N	245.278	1.589	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C1CC(O)C1	761222155	IKNUFLCLDABHBS-UHFFFAOYSA-N	225.263	1.486	10	20	BDCD	
CNC[C@H](C)CNCc1cc(F)ccc1O	1118020451	WFLAFXRDLXHGNU-VIFPVBQESA-N	226.295	1.476	10	20	BDCD	
COc1cc(C)cc(CN(C)CCCO)c1O	894664815	SPCODDWLBASFJD-UHFFFAOYSA-N	239.315	1.523	10	20	BDCD	
C[C@H](CCO)CNCc1ccc2c(c1)CCO2	97439161	NXNBPYJPFIQWCK-LLVKDONJSA-N	235.327	1.730	10	20	BDCD	
CC[C@](C)(O)CNCc1cccc(C)c1O	162826535	LIYTZXCMCSFIPX-ZDUSSCGKSA-N	223.316	1.951	10	20	BDCD	
CSCC(=O)NCc1ccc(N(C)C)cc1	8171391	XUKDYDCDKZCWLT-UHFFFAOYSA-N	238.356	1.732	10	20	BDCD	
C[C@@H](CNC(=O)Nc1ccc(N)cc1)N(C)C	45110177	JFFCJYOTGREWOL-VIFPVBQESA-N	236.319	1.340	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)NCCO)s1	1537963051	RECXJGPBGVLSEO-UHFFFAOYSA-N	226.261	1.281	10	20	BDCD	
CCN(CC(N)=O)Cc1cc(C)ccc1O	188466423	CUBXGPVYDJAUHO-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
C[C@@H](NC[C@@H]1CCCN1)c1cc(F)ccc1O	817951620	HOSVXMSNMAKAKG-KOLCDFICSA-N	238.306	1.934	10	20	BDCD	
Oc1ccccc1CN1CCc2nn[nH]c2C1	827884417	BFNGPFKKPUNUFV-UHFFFAOYSA-N	230.271	1.069	10	20	BDCD	
O=C(NCCSc1nccs1)C1CC1	901478881	XINZWAMUPPQFIS-UHFFFAOYSA-N	228.342	1.761	10	20	BDCD	
O=C(NCc1ccco1)c1cc(O)cs1	731861762	MZADFNOPXYHFGD-UHFFFAOYSA-N	223.253	1.977	10	20	BDCD	
CC(C)C1(O)CN(Cc2ccccc2O)C1	839132786	LRCLUAUDLHAOJA-UHFFFAOYSA-N	221.300	1.595	10	20	BDCD	
Cc1cccc(CN2CC[C@@H]3NCC[C@@H]3C2)c1O	843127260	PCQWBTMSVVHONB-OCCSQVGLSA-N	246.354	1.884	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC1(C(N)=O)CC1	840939695	OLQSYEYZLCWGET-UHFFFAOYSA-N	247.342	1.169	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](C)C[C@H](C)N	843126780	ADLVKWBAOSNCEB-UWVGGRQHSA-N	238.331	1.616	10	20	BDCD	
Cc1cccc(CN2C[C@H](O)C[C@H]2C)c1O	788266744	BIEMVSZAHQVWEI-ZYHUDNBSSA-N	221.300	1.656	10	20	BDCD	
C[C@H](C(=O)NCc1ccccc1O)n1ccnc1	1177926569	GKPRPZZNWJEDOI-SNVBAGLBSA-N	245.282	1.466	10	20	BDCD	
C[C@H](CO)N[C@H](C)c1cc(C(=O)O)ccc1O	1609747858	YEBWLOHBIWUVIV-HTQZYQBOSA-N	239.271	1.122	10	20	BDCD	
CCn1cnc(C(=O)NCc2ccccc2O)c1	857472104	ODNIFYPYSFFLAQ-UHFFFAOYSA-N	245.282	1.539	10	20	BDCD	
C[C@@H](O)CN[C@H](C)c1ccc(F)cc1O	62745811	XANCXORUHDNVIG-HTQZYQBOSA-N	213.252	1.563	10	20	BDCD	
CS[C@@H](C)CNC(=O)Cc1ccc(N)cc1	136160482	XZTKPGZBAMDEFX-VIFPVBQESA-N	238.356	1.679	10	20	BDCD	
OCCNCc1c(O)cccc1Cl	83662417	ZHENAFXVIYBBDH-UHFFFAOYSA-N	201.653	1.128	10	20	BDCD	
CN(C)C/C=C/C(=O)N(C)Cc1ccccc1O	265882953	JIKVDQJCEPWMIT-RMKNXTFCSA-N	248.326	1.468	10	20	BDCD	
CCOc1cccc(CNC/C=C\CO)c1O	717547437	LTMQYERIIJFROU-ARJAWSKDSA-N	237.299	1.429	10	20	BDCD	
NCC[C@H]1CCN(Cc2ccccc2O)C1	723712724	RNROPVYEDNSJPK-NSHDSACASA-N	220.316	1.563	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCC[N+](=O)[O-])c1	930217687	ZDDAEWXPEBKUFJ-QMMMGPOBSA-N	240.259	1.328	10	20	BDCD	
CN(C(=O)C1(CN)CCCC1)c1ccc(N)cc1	877078716	BIIJCSSPGLICAA-UHFFFAOYSA-N	247.342	1.751	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)C[C@@H](C)O	877195268	FWVZDSPZDRFHBD-GHMZBOCLSA-N	223.316	1.950	10	20	BDCD	
C[C@]1(CNCc2ccc(N)cc2)CCCNC1	1120268493	GFLFVYHTSNSLSR-AWEZNQCLSA-N	233.359	1.748	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](CO)C1CC1	894274111	SHNXVVVXTFWTKD-GFCCVEGCSA-N	221.300	1.561	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@@H]1CC[C@H]1O	393521445	PJJVQSDZDCYTAK-NXEZZACHSA-N	227.691	1.659	10	20	BDCD	
C[C@@H](CCO)NCc1cc(F)cc(F)c1O	708394181	RCNQAADKFGWHGR-ZETCQYMHSA-N	231.242	1.531	10	20	BDCD	
CN(C(=O)COC(F)(F)F)c1ccc(N)cc1	1342238472	DPWALFVYNRILGI-UHFFFAOYSA-N	248.204	1.768	10	20	BDCD	
C[C@@]1(O)CCN(Cc2cc(F)ccc2O)C1	180244727	YXVWMSDCOKTGFJ-GFCCVEGCSA-N	225.263	1.488	10	20	BDCD	
O=C1NCCCC[C@@H]1Sc1nccs1	48875572	MABZBMPEARVQQI-ZETCQYMHSA-N	228.342	1.904	10	20	BDCD	
Nc1nc(-c2ccc(O)c(O)c2O)cs1	32501312	NMGHLNVCVLGBNC-UHFFFAOYSA-N	224.241	1.509	10	20	BDCD	
Nc1ccc2c(ccn2CCCCO)c1	43445727	LKGLXKOBKFMOKZ-UHFFFAOYSA-N	204.273	1.996	10	20	BDCD	
CN(C)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1	814740375	SJYJFEICXDIYPZ-UHFFFAOYSA-N	246.270	1.906	10	20	BDCD	
C[C@@H](NC[C@@H]1C[C@H](F)CN1)c1ccccc1O	817976848	VLXBKAZERBGAKS-VWYCJHECSA-N	238.306	1.743	10	20	BDCD	
Cc1cc(C)c(O)c(CN(C)[C@H](C)C(=O)O)c1	820967999	CJJXBSMSQBGEDA-SNVBAGLBSA-N	237.299	1.914	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)[C@H]1CCNC1	843049220	HJLGYMATNJHXTE-HNNXBMFYSA-N	247.386	1.855	10	20	BDCD	
CCOC1CN(Cc2cc(F)cc(F)c2O)C1	894970895	OYVUUMPSCXAYBI-UHFFFAOYSA-N	243.253	1.891	10	20	BDCD	
COc1ccc(CNC(=O)C(F)F)c(O)c1	794382628	ZLHULOPFLNYWNT-UHFFFAOYSA-N	231.198	1.282	10	20	BDCD	
CN(Cc1ccccc1O)[C@@H]1CCOC1=O	109769942	GTTAUPDDVZXOKF-SNVBAGLBSA-N	221.256	1.140	10	20	BDCD	
CC1(CNCc2cc(F)cc(F)c2O)COC1	708444639	STFSGHBDQCBIDA-UHFFFAOYSA-N	243.253	1.797	10	20	BDCD	
OCCCCNCc1cccc(Cl)c1O	193281621	ZSQIXUJGZJBUMK-UHFFFAOYSA-N	229.707	1.908	10	20	BDCD	
Nc1ccc(CN2C[C@@H]3CCNC[C@@H]3C2)cc1	1352788074	AXBHXUUHIDHWQI-QWHCGFSZSA-N	231.343	1.310	10	20	BDCD	
CCC(CC)(CN)C(=O)NCc1ccc(N)cc1	1524009419	QUOBPNUKDRZVNO-UHFFFAOYSA-N	249.358	1.650	10	20	BDCD	
c1cc2c(cc1CN[C@H]1CCNC1)CCCO2	259221132	XNDJKYSNVMIKRJ-ZDUSSCGKSA-N	232.327	1.463	10	20	BDCD	
CCN(C)C(=O)CN(C)c1ccc(OC)cc1	844353646	SWQBOAOUIGYTDV-UHFFFAOYSA-N	236.315	1.610	10	20	BDCD	
CN1CCCc2cc(CNCCC(N)=O)ccc21	50286510	OJRQEPXCXRZZHU-UHFFFAOYSA-N	247.342	1.034	10	20	BDCD	
O=C(O)c1cnc(Sc2nccs2)cn1	70582594	MDRQCZOGEFTESI-UHFFFAOYSA-N	239.281	1.783	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCCCCN1	228420895	JHLBFFKNJANTGW-GFCCVEGCSA-N	248.326	1.541	10	20	BDCD	
CC[C@H](CCO)NCc1cc(F)ccc1O	226611016	MSFYBZIGSWIZRT-LLVKDONJSA-N	227.279	1.782	10	20	BDCD	
COC[C@H](C)CNCc1cc(OC)ccc1O	45656952	QROXKVOFYJUQFG-SNVBAGLBSA-N	239.315	1.773	10	20	BDCD	
CO[C@H]1CC[C@@H](NC(=O)Nc2ccc(N)cc2)C1	235017779	KFCDGYVSDBYNKV-NEPJUHHUSA-N	249.314	1.958	10	20	BDCD	
CN(C)c1ccc(OCC(=O)N2CCCC2)cc1	277983864	YSUGXKDLGJKFFT-UHFFFAOYSA-N	248.326	1.754	10	20	BDCD	
Cc1cccc(CN(C)CC(=O)O)c1O	821112031	GLSLEWMJZBNVEA-UHFFFAOYSA-N	209.245	1.217	10	20	BDCD	
CN(C)CCN(C)C(=O)c1cc(O)cs1	748407380	PRWCGEJLWZVIAV-UHFFFAOYSA-N	228.317	1.087	10	20	BDCD	
C[C@H]1[C@@H](CO)CCCN1Cc1ccccc1O	840979168	RXQNGRDCNFIACW-WCQYABFASA-N	235.327	1.985	10	20	BDCD	
COC[C@@H](CCO)NCc1c(C)cccc1O	877048316	KSAHLSMDHNTZNA-LLVKDONJSA-N	239.315	1.188	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC(OC(F)F)C1	782015063	ZEANKMJTBDUFPU-UHFFFAOYSA-N	249.238	1.517	10	20	BDCD	
COc1ccc(CN2C[C@@H]3C[C@H]3C2)c(O)c1OC	895558959	MOASIBAAAWOHQR-QWRGUYRKSA-N	249.310	1.861	10	20	BDCD	
Nc1ccc(CNC[C@H]2CCCN2)cc1	1335287763	AXLXCSKYBFUZCJ-GFCCVEGCSA-N	205.305	1.110	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCC[C@@H]1O	125265886	PYBCVWXVNMKILQ-JQWIXIFHSA-N	207.273	1.395	10	20	BDCD	
CC[C@@H](N[C@@H]1CC[C@H]1O)c1ccccc1O	378804940	WJKTZJGHHNNSDC-NQBHXWOUSA-N	221.300	1.956	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H]2CCCOC2)cc1	62192955	BOFNXRJWDKIWHN-GFCCVEGCSA-N	248.326	1.354	10	20	BDCD	
Cn1cnc([N+](=O)[O-])c1NCc1ccccc1O	133738321	PCRHPQMWPMCTPU-UHFFFAOYSA-N	248.242	1.646	10	20	BDCD	
CC[C@H](NCc1ccc2c(c1)CCO2)C(=O)OC	83380929	GRYCWRHWXXADKV-LBPRGKRZSA-N	249.310	1.663	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@H]1CCOC1)CC2	381496010	BFMOYAIFBIECIT-QWRGUYRKSA-N	219.284	1.758	10	20	BDCD	
CNC(=O)[C@H](C)N[C@@H]1CCc2cccc(O)c21	297326836	NRWYJKSUEHFPML-WCBMZHEXSA-N	234.299	1.104	10	20	BDCD	
CCCN(C)C(=O)c1c(F)ccc(O)c1O	295297133	QRLLOGCJOARSGC-UHFFFAOYSA-N	227.235	1.719	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](CO)CCF)c1	846097065	MRMPUDYGFGJBLT-NSHDSACASA-N	227.279	1.511	10	20	BDCD	
CCc1cccc(CN2CCN(C)C(=O)C2)c1O	848887602	ZUQZICGNVZCODT-UHFFFAOYSA-N	248.326	1.229	10	20	BDCD	
O=C1CCCN1C1CN(Cc2ccccc2O)C1	897785901	BBLIRSGHJQARPX-UHFFFAOYSA-N	246.310	1.199	10	20	BDCD	
COc1ccc(CNC(=O)c2cc[nH]c2)c(O)c1	794379534	PADAPHDDBFSNDN-UHFFFAOYSA-N	246.266	1.659	10	20	BDCD	
C[C@H](O)[C@H]1CCCCN1C(=O)CN=[N+]=[N-]	409424652	CNFSTFGEOAEKIY-JGVFFNPUSA-N	212.253	1.059	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@]2(CCCCO2)C1	409428702	MVJLYDHEWCDXIO-SNVBAGLBSA-N	210.281	1.942	10	20	BDCD	
C[C@H]1[C@H](C)N(Cc2ccc(N)cc2)CCN1C	1334754801	RQPQKKMVWMTCRB-RYUDHWBXSA-N	233.359	1.793	10	20	BDCD	
O=C(O)[C@H](CF)NCc1c(O)cccc1Cl	1601648564	CUUQCBDGYSILCB-QMMMGPOBSA-N	247.653	1.558	10	20	BDCD	
CN(Cc1ccccc1O)c1ncnn1C	853462572	ZJVQCYFNYKNBKS-UHFFFAOYSA-N	218.260	1.157	10	20	BDCD	
COC[C@H](CCO)NCc1cc(F)ccc1O	226610317	XYNOWUGMXRZYGU-NSHDSACASA-N	243.278	1.018	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@H]3CC[C@H]2NC3)c1O	530245960	IRBWCKGDJFIJOB-BNOWGMLFSA-N	246.354	1.931	10	20	BDCD	
C[C@H](CN)C(=O)N[C@H](C)c1ccccc1O	870988428	PBKVOIUTUIXQBN-RKDXNWHRSA-N	222.288	1.164	10	20	BDCD	
O=C(O)[C@@H]1CCCCN1Cc1ccccc1O	86729590	CPLUGEMCYWPPAX-NSHDSACASA-N	235.283	1.831	10	20	BDCD	
CN(Cc1cn(C)nn1)c1ccc(N)cc1	234303401	DVSPMDUOXRQKGR-UHFFFAOYSA-N	217.276	1.034	10	20	BDCD	
CCCN(C)C(=O)c1cccc(O)c1O	163269993	IKWPZIKOFPFIMV-UHFFFAOYSA-N	209.245	1.580	10	20	BDCD	
Cc1cccc(CNCc2nonc2C)c1O	809742507	AJQWDRQBDKXFKL-UHFFFAOYSA-N	233.271	1.682	10	20	BDCD	
CC(=O)C(=O)COC(=O)C1CCCCC1	808487668	PSBOCVXQZSVAAC-UHFFFAOYSA-N	212.245	1.268	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@@H](C)CN)c1	817970511	YBJFFPQBBAMXQT-UWVGGRQHSA-N	208.305	1.698	10	20	BDCD	
CON(C)Cc1cc2c(cc1O)CCC2	917064917	VANXGTULUKKYND-UHFFFAOYSA-N	207.273	1.874	10	20	BDCD	
COc1cccc(O)c1CN[C@H](C)C[C@@H](C)N	843126779	ADLVKWBAOSNCEB-NXEZZACHSA-N	238.331	1.616	10	20	BDCD	
C[C@@H](NC(=O)c1cc(O)cs1)C1(CO)CC1	855478780	YPOYSRJVHDEMQM-SSDOTTSWSA-N	241.312	1.345	10	20	BDCD	
Cc1cccc(O)c1CNCCc1ccn(C)n1	877352821	DXMHBKXCGOLNLH-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C)O	786989447	RUCVGIQKMNDAFM-SNVBAGLBSA-N	236.315	1.058	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@H]1O	897681472	VRPWTDDILCOTIQ-LDYMZIIASA-N	241.718	1.858	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@H]1CCC[C@H]1O	689861251	JJKUXYAEPRIDKJ-TZMCWYRMSA-N	234.343	1.862	10	20	BDCD	
CC(C)N(C)CC(=O)NCc1ccc(N)cc1	1515331534	FMONNPPYKSXWQH-UHFFFAOYSA-N	235.331	1.225	10	20	BDCD	
COc1cccc(O)c1CN(C)C[C@@H](C)OC	809717038	CCTXCWNQQDZBCN-SNVBAGLBSA-N	239.315	1.868	10	20	BDCD	
N[C@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2	259024271	OGXBHZJNOYARLE-STQMWFEESA-N	232.327	1.591	10	20	BDCD	
C[C@@H](CCN)NCc1cc(F)c(F)cc1O	1575962377	QQPLOQBCXJLKPY-ZETCQYMHSA-N	230.258	1.497	10	20	BDCD	
COc1cccc(CNCc2cncn2C)c1O	289449928	NBCJTDHMBJDDPC-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
C[C@@H]1C[C@H](NC(=O)c2cccc(O)c2O)CO1	401487455	XZWHEORVCJOKKG-SFYZADRCSA-N	237.255	1.005	10	20	BDCD	
CC(C)(CO)CCNCc1ccccc1O	294777178	KSQAFMLQXZNSSQ-UHFFFAOYSA-N	223.316	1.890	10	20	BDCD	
C[C@@H](Cn1cncn1)N[C@H](C)c1ccccc1O	272864236	NLFPUZFQVHALLO-WDEREUQCSA-N	246.314	1.723	10	20	BDCD	
C[C@H](CO)N(C)Cc1cc(Cl)ccc1O	809746295	SPONGWQQSFEFGS-MRVPVSSYSA-N	229.707	1.858	10	20	BDCD	
C[C@@H](N[C@@H](CO)CCF)c1cc(F)ccc1O	846208309	IGFCZLBSEFVSLV-PSASIEDQSA-N	245.269	1.902	10	20	BDCD	
COc1cccc([C@H](C)N[C@H](C)CO)c1O	846145173	OZECMJFTQYRFQV-BDAKNGLRSA-N	225.288	1.432	10	20	BDCD	
OC[C@@H](CCF)N[C@H]1CCc2cccc(O)c21	846210319	XZNCRZMAPNEVPG-MNOVXSKESA-N	239.290	1.690	10	20	BDCD	
N[C@]12CCC[C@H]1CN(Cc1ccccc1O)C2	857226541	QUCPGBJOYHLZPH-JSGCOSHPSA-N	232.327	1.705	10	20	BDCD	
COc1cccc(O)c1CN1CCSCC1	768237354	PLIZGBVOVUIYFZ-UHFFFAOYSA-N	239.340	1.950	10	20	BDCD	
CC(C)CC[C@@H](N)C(=O)Nc1ccc(N)cc1	876504065	ITHRCOVQVQZMKI-GFCCVEGCSA-N	235.331	1.971	10	20	BDCD	
COc1cc(C)cc(CNCCF)c1O	894648798	LNYIUTMIBTVXOH-UHFFFAOYSA-N	213.252	1.768	10	20	BDCD	
O=C1CC[C@H]2CN(Cc3ccccc3O)CCN12	211633382	IHCNKIPXRWHITO-LBPRGKRZSA-N	246.310	1.199	10	20	BDCD	
C=CC(=O)NCc1ccc(N(C)C)cc1C	1335286649	AWXMQNCYTHNILA-UHFFFAOYSA-N	218.300	1.863	10	20	BDCD	
C[C@H](NC[C@H]1C[C@@H](O)C1)c1ccc(F)cc1O	720907389	LHYPEMZTFMPBCY-ATZCPNFKSA-N	239.290	1.953	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)c1ccoc1	768898945	CMGYVGCKCWMZHD-UHFFFAOYSA-N	247.250	1.663	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@@H]1CCCNC1	699704007	YUORTUJPCBFGQL-NWDGAFQWSA-N	234.343	1.870	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCCN1	1579616789	GDJMQIRWOZGJSY-UHFFFAOYSA-N	219.332	1.771	10	20	BDCD	
N[C@@H]1CCN(Cc2cccc(Cl)c2O)C1	309379692	RISQPMGNWVLGIX-SECBINFHSA-N	226.707	1.579	10	20	BDCD	
Oc1ccccc1CNCc1ncc[nH]1	67667708	CVEIAPQOHZKWAM-UHFFFAOYSA-N	203.245	1.405	10	20	BDCD	
C[C@@H](N)CC(=O)N(C)Cc1ccccc1O	37823783	XZUQYBUERGDVHS-SECBINFHSA-N	222.288	1.088	10	20	BDCD	
CC1(C)C[C@H]1CNC(=O)c1cccc(O)c1O	229315618	MUGUPMMFVDZYDY-QMMMGPOBSA-N	235.283	1.874	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](CN)C[C@H]2C)c1	228065278	XTAJWQDQEKRHGU-NEPJUHHUSA-N	234.343	1.870	10	20	BDCD	
C[C@H](O)CN(Cc1ccc(N)cc1)C1CC1	83677025	PVRFOJNHMASSRE-JTQLQIEISA-N	220.316	1.614	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C2(N)CCC2)cc1	148096656	JVJAAHSWGSFLJQ-UHFFFAOYSA-N	247.342	1.250	10	20	BDCD	
COC[C@H](CO)NCc1cccc(Cl)c1O	234794969	QOXVBVJDRYCFNF-VIFPVBQESA-N	245.706	1.143	10	20	BDCD	
CC(=O)CCC(=O)NCc1ccccc1O	162971771	DPLZGKKBJOFSRE-UHFFFAOYSA-N	221.256	1.378	10	20	BDCD	
COC[C@H](CO)NCc1cc(Cl)ccc1O	234787067	YZOPTCRMNPQCSM-JTQLQIEISA-N	245.706	1.143	10	20	BDCD	
Cc1cc(O)c(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1C	367787053	ZEGKQUJIBDYPFZ-WDNDVIMCSA-N	247.338	1.679	10	20	BDCD	
Oc1ccccc1CN1CC[C@](O)(C2CC2)C1	369677028	UXTNDGUCSCVWOD-CQSZACIVSA-N	233.311	1.739	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCC(F)(F)CN)c1	817966147	HFHYEVWQFBZVJA-SECBINFHSA-N	244.285	1.945	10	20	BDCD	
CCn1ccnc1CNCCc1ccc(N)cc1	841033964	DDMSMYPQBXUSPN-UHFFFAOYSA-N	244.342	1.818	10	20	BDCD	
COc1cccc(O)c1CN[C@H](CO)CCF	846098153	ZTMRUMLJKLHFHR-VIFPVBQESA-N	243.278	1.211	10	20	BDCD	
Cc1ccc(O)c(CN(C)C2CCNCC2)c1	843046444	WFIXMXGFNUPYPJ-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
Cc1noc(C)c1NC(=O)c1cccc(O)c1O	790626724	AAHMKCCFUQONCE-UHFFFAOYSA-N	248.238	1.955	10	20	BDCD	
Nc1ccc(CN[C@H]2CCNC(=O)CC2)cc1	1580445717	RFIKSSJCFYPSBK-GFCCVEGCSA-N	233.315	1.027	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CO[C@H](C)C2)c1	402034283	CHRMXFAJHIHYHB-ZYHUDNBSSA-N	221.300	1.968	10	20	BDCD	
COCC(COC)NCc1cc(F)ccc1O	388483043	WMYFBLCCZUWNFA-UHFFFAOYSA-N	243.278	1.282	10	20	BDCD	
C[C@@H](C(=O)N(C)C)N(C)Cc1ccccc1O	121144808	IAXFCPAQNYBALF-JTQLQIEISA-N	236.315	1.301	10	20	BDCD	
CNC(=O)CCN(C)Cc1cc(F)ccc1O	180065405	MBUDOYQQTSYECH-UHFFFAOYSA-N	240.278	1.099	10	20	BDCD	
C[C@@H]1C[C@@H](C)[C@H](C(=O)NCc2ccccc2O)O1	282244511	BTLSNFBXIRCNCJ-GIPNMCIBSA-N	249.310	1.822	10	20	BDCD	
C/C=C(\C)C(=O)NCc1ccc(N)cc1	297237630	PLEOVZDQFVCDJA-YCRREMRBSA-N	204.273	1.851	10	20	BDCD	
C[C@H](NC1CNC1)c1cc(F)ccc1O	817955872	JXJUSBWVJHJGQG-ZETCQYMHSA-N	210.252	1.154	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC[C@H](C)CN)c1	817961609	ANJGINWLVUVUOV-ZJUUUORDSA-N	238.331	1.646	10	20	BDCD	
CCC[C@H](CNC(=O)c1cc(O)cs1)OC	833372276	PFPIUFOTFXXLKM-SECBINFHSA-N	243.328	1.999	10	20	BDCD	
Nc1ccc(CCNC(=O)NCC(F)F)cc1	841959550	YIXWVYZDNKIEQE-UHFFFAOYSA-N	243.257	1.376	10	20	BDCD	
CC(C)[C@H](N)CNCc1cc(F)ccc1O	841031763	WQXUMVLMIUDZKZ-LLVKDONJSA-N	226.295	1.604	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@@H]1CCCN1	841036319	RKJKIDGAVQQTFJ-AWEZNQCLSA-N	247.386	1.903	10	20	BDCD	
C[C@@H](N)[C@@H]1CCN(Cc2cccc(F)c2O)C1	843058754	XNTFKSGCMNVVJB-NXEZZACHSA-N	238.306	1.700	10	20	BDCD	
CN[C@H]1CCN(Cc2cccc(F)c2O)C1	843044767	IMSPVWDWYOWXCH-JTQLQIEISA-N	224.279	1.325	10	20	BDCD	
COc1cccc(O)c1CN1CCC(O)CC1	768181894	AJGOJMJYCKJKRT-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
CC[C@H]1NCC[C@@H]1C(=O)N(C)c1ccc(N)cc1	877076929	XHOHEXKVNJZYNP-QWHCGFSZSA-N	247.342	1.620	10	20	BDCD	
Cc1ccc(CN2CCC[C@@H](O)C2)c(O)c1	876528125	PXCUDPZUZNUCQR-GFCCVEGCSA-N	221.300	1.657	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C(=O)C1(N)CC1	88130354	RZNSQHLRRRRGRE-UHFFFAOYSA-N	247.342	1.202	10	20	BDCD	
CN(Cc1ccccc1O)c1cnccn1	302616182	FYXDNWYHDBIKBY-UHFFFAOYSA-N	215.256	1.819	10	20	BDCD	
CCc1cccc(CNC(C)(C)CO)c1O	709405090	GBRPWHJKENKJOM-UHFFFAOYSA-N	223.316	1.815	10	20	BDCD	
O=C(O)[C@@H](CC1CC1)NCc1ccccc1O	1334776627	HGFMEIRSAOCMAV-LLVKDONJSA-N	235.283	1.735	10	20	BDCD	
Cc1ccc(CN[C@@H]2CCCN[C@@H]2C)c(O)c1	1579697142	YWUGELWOHCTIQD-DGCLKSJQSA-N	234.343	1.931	10	20	BDCD	
CCn1ccnc(NCc2ccccc2O)c1=O	163649595	JLWLCASMCXDYAC-UHFFFAOYSA-N	245.282	1.581	10	20	BDCD	
CC(C)CC(=O)NCc1ccc(N)cc1	32011618	AXFYDVDVKOLZKD-UHFFFAOYSA-N	206.289	1.931	10	20	BDCD	
COC[C@H](NC(=O)Cc1ccc(N)cc1)C1CC1	125360756	JSMFYPBFHLTHME-ZDUSSCGKSA-N	248.326	1.353	10	20	BDCD	
Cc1cccc(CNC[C@H](O)C2CCC2)c1O	316683494	ZIYJOSYYTDIJDB-ZDUSSCGKSA-N	235.327	1.951	10	20	BDCD	
C[C@@H]1C[C@@H](C(=O)O)CN(Cc2ccccc2O)C1	399049896	KPTNWSISZYHDPU-ZYHUDNBSSA-N	249.310	1.935	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@H]1C[C@@H](O)C1	825256990	PWMFBZJZGQOEMI-AOOOYVTPSA-N	227.691	1.659	10	20	BDCD	
CON(C)CCN[C@H]1CCc2cccc(O)c21	850476914	CMFSBEBDTQIVHI-NSHDSACASA-N	236.315	1.462	10	20	BDCD	
CCOC[C@@H](O)CNc1ccccc1OCC	69276562	XWGPVBBDZJAUIK-NSHDSACASA-N	239.315	1.895	10	20	BDCD	
CN(C)c1ccc(CNC2CCNCC2)cc1	38040727	ZDSXVCPWHCDTJY-UHFFFAOYSA-N	233.359	1.594	10	20	BDCD	
CCN1CC(=O)N[C@H]1c1cc(C)c(C)cc1O	189872678	LFWWSWBUCZYQJR-CYBMUJFWSA-N	234.299	1.459	10	20	BDCD	
Cc1oc(C(=O)O)cc1COc1cnn(C)c1	227933463	QKJKSXFWKUQCAL-UHFFFAOYSA-N	236.227	1.599	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H]([C@H](C)N)C2)c1	228150981	RIACFKIKJZPWHG-RYUDHWBXSA-N	234.343	1.870	10	20	BDCD	
OC[C@@H]1[C@H]2CN(Cc3cc(F)ccc3O)C[C@H]21	367777819	KAJKRHDWOCHXKL-GDNZZTSVSA-N	237.274	1.201	10	20	BDCD	
CCCNCCN[C@H]1CCc2cccc(O)c21	817963663	WWUYSOKIMVMJEN-LBPRGKRZSA-N	234.343	1.969	10	20	BDCD	
Cc1cc(CN2C[C@H](C)[C@@H](O)C2)ccc1N(C)C	815081057	QOCRTPYXGBSYBA-WFASDCNBSA-N	248.370	1.874	10	20	BDCD	
Cc1ccc([C@H](C)NCC2(N)CC2)c(O)c1	902405632	JMHBXZONJBZZPX-JTQLQIEISA-N	220.316	1.843	10	20	BDCD	
CC(C)[C@@H](C(=O)O)C(=O)Nc1ccc(N)cc1	849364955	UBHDZRMPQHQEAX-SNVBAGLBSA-N	236.271	1.564	10	20	BDCD	
COCCN[C@H](C)c1cccc(OC)c1O	846135645	FIRJHWQHXVWSNS-SECBINFHSA-N	225.288	1.698	10	20	BDCD	
CCOc1ccc(CN[C@H](C)CN)c(O)c1	841060336	VQNDBWZDISUWSS-SECBINFHSA-N	224.304	1.228	10	20	BDCD	
CCC1(C(=O)NCc2ccccc2O)COC1	755766492	FANSUFRZDWKYHD-UHFFFAOYSA-N	235.283	1.435	10	20	BDCD	
O=C(O)[C@H]1C[C@@H](NCc2ccc3c(c2)CCO3)C1	874047147	QSHNWYKAVXDBSR-TXEJJXNPSA-N	247.294	1.574	10	20	BDCD	
O=C(NCCc1cnccn1)c1cc(O)cs1	775617604	JMAFCIVDEOKZLO-UHFFFAOYSA-N	249.295	1.216	10	20	BDCD	
Cc1ccc(CNC2([C@@H](C)O)CC2)c(O)c1	877637480	IWDDSGWBJIZKMN-SNVBAGLBSA-N	221.300	1.704	10	20	BDCD	
C/C=C/C(=O)NCc1ccc(OC)cc1O	794387474	JFRGMNWUSFMDOS-ONEGZZNKSA-N	221.256	1.593	10	20	BDCD	
C[C@H](O)[C@H](C)NCCCSc1nccs1	1327976844	AOTJTOWCOATBFE-IUCAKERBSA-N	246.401	1.984	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)Nc1cc[nH]n1	1179683436	MBASUXFEBHUMIT-DUXPYHPUSA-N	245.238	1.473	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CCCOCC2)cc1	310893808	ZQUKHOPNHAMNFA-CYBMUJFWSA-N	248.326	1.497	10	20	BDCD	
C[C@@H](NCc1ccc2c(c1)CCO2)[C@H]1CCCN1	817902853	ZNNRTBVTYNACIH-BXUZGUMPSA-N	246.354	1.852	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)CC[C@@H]1C(=O)O	306071586	WQWCDUSQPDYHJX-PWSUYJOCSA-N	249.310	1.935	10	20	BDCD	
CCNC(=O)[C@H](C)NCc1cc(C)ccc1O	71407099	RFGHMZXROOWQOT-JTQLQIEISA-N	236.315	1.315	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@@H]2CCCOC2)cc1	38046090	JFIZKFAXWXVGSX-LBPRGKRZSA-N	248.326	1.354	10	20	BDCD	
CCOC(=O)c1cnc(S[C@@H](C)CO)s1	379794776	KDCOVDRRMPTBMX-LURJTMIESA-N	247.341	1.793	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C(=O)C(F)F	234272893	AZLVIFCYXWSTOF-UHFFFAOYSA-N	242.269	1.976	10	20	BDCD	
Cc1ccc(C(=O)N2CCO[C@H]3C[C@H]32)c(O)c1O	816901421	LQFKTCLNXCDHGP-ZJUUUORDSA-N	249.266	1.020	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)[C@@H]1CCCO1	817957878	QIRNHEGRXCKETH-RISCZKNCSA-N	234.343	1.968	10	20	BDCD	
CNC(=O)CN(C)Cc1ccc(N(C)C)cc1C	827862345	CARMFLFKFSCJAA-UHFFFAOYSA-N	249.358	1.239	10	20	BDCD	
CCn1nccc1NC(=O)c1cc(O)cs1	732266978	PMWYFUUFRASQHK-UHFFFAOYSA-N	237.284	1.922	10	20	BDCD	
Cc1ccc(O)c(CNCC[C@@H]2CCNC2)c1	841037799	XQRPCSDYQHTMAA-LBPRGKRZSA-N	234.343	1.790	10	20	BDCD	
CC(C)C[C@H](CN)NCc1cccc(F)c1O	841037550	AMIMARMOGUGEJD-LLVKDONJSA-N	240.322	1.994	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCC[C@H]2O)c1	164230797	BVQONXYUTZRNLI-DGCLKSJQSA-N	221.300	1.704	10	20	BDCD	
Cc1cccc(O)c1CN(C)C[C@@H](C)O	877320728	SMVGCDMLSBGWNO-SNVBAGLBSA-N	209.289	1.513	10	20	BDCD	
Cc1ccc(CN2CCNC(=O)C[C@H]2C)c(O)c1	877532957	XRMMGXKMOHVEOX-LLVKDONJSA-N	248.326	1.411	10	20	BDCD	
Oc1c(Cl)cccc1CNC[C@H]1C[C@@H](O)C1	720962181	IRDBTOMZYFPJIR-WAAGHKOSSA-N	241.718	1.906	10	20	BDCD	
C[C@@H](CN)NCc1ccc(N(C)C)cc1	162082847	KIPUAWUECVAZQO-JTQLQIEISA-N	207.321	1.189	10	20	BDCD	
COC[C@H](C)C(=O)NCCc1ccc(N)cc1	237232296	OAKBUPRNYMQKHG-JTQLQIEISA-N	236.315	1.210	10	20	BDCD	
C[C@@H](O)CCN(C)Cc1ccc(N(C)C)cc1	93481032	NDNYJFMWWHWMSU-GFCCVEGCSA-N	236.359	1.955	10	20	BDCD	
CCc1nc(CN(C)c2ccc(N)cc2)no1	702050447	YAKNAFYRWBIHST-UHFFFAOYSA-N	232.287	1.851	10	20	BDCD	
Oc1cccc2c1[C@H](NCCc1cn[nH]c1)CC2	379591834	YLSKMXMGZKVNLR-GFCCVEGCSA-N	243.310	1.935	10	20	BDCD	
CNC(=O)[C@H](C)N[C@@H](C)c1ccc(C)cc1O	42560942	FYXAICNZIWGREL-UWVGGRQHSA-N	236.315	1.486	10	20	BDCD	
C[C@@H](CF)NCc1cc(F)ccc1O	290264108	XAXKHBPALMUODW-ZETCQYMHSA-N	201.216	1.979	10	20	BDCD	
C[C@@H](CCO)NCc1ccc2c(c1)CCO2	96811638	KTIRRCPSZPBDNN-JTQLQIEISA-N	221.300	1.482	10	20	BDCD	
C[C@@H](NC(=O)c1c(F)ccc(O)c1O)C1CC1	276669547	NMKSGOAGOYHUTJ-ZCFIWIBFSA-N	239.246	1.765	10	20	BDCD	
CN(C)c1ccc(CN(CC(N)=O)C2CC2)cc1	298727110	QOWKVXUKFZBRNZ-UHFFFAOYSA-N	247.342	1.202	10	20	BDCD	
CC(C)[C@H](O)C(=O)N[C@H](C)c1ccccc1O	827946589	NEGBJKYOHRHDBA-SKDRFNHKSA-N	237.299	1.586	10	20	BDCD	
CC1=NNC(=O)[C@@H]1Sc1ncc(Cl)s1	918096833	YHCJCWSEFBTHTQ-RXMQYKEDSA-N	247.732	1.763	10	20	BDCD	
COc1cccc([C@@H](C)N[C@H]2C[C@@H](O)C2)c1O	846168811	LZMMZDFMZMCHJO-BBBLOLIVSA-N	237.299	1.575	10	20	BDCD	
O=C(NCc1ccccc1O)O[C@@H]1CCOC1	914141032	WSBSVVHEYUBICH-SNVBAGLBSA-N	237.255	1.407	10	20	BDCD	
COc1cccc(CNCC2(N)CCC2)c1O	841050526	ICWZSYCAUKBFNO-UHFFFAOYSA-N	236.315	1.372	10	20	BDCD	
CCOCC(=O)NCc1cc(C)ccc1O	862761374	PMIFPQGCWOZRKR-UHFFFAOYSA-N	223.272	1.353	10	20	BDCD	
CCN(CCCO)Cc1cc(OC)ccc1O	775717054	QLBDDJBZJUHSJC-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
CCN(Cc1ccc(C)cc1O)[C@@H](C)CO	877551771	BCTQZMQQJWBDIN-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
CC1(C)CN(C(=O)c2cc(O)cs2)C[C@H]1O	791083154	OSRAZUMQXOLBAP-SECBINFHSA-N	241.312	1.297	10	20	BDCD	
O[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)C1	850417891	QDZOIYIRDNUZTM-HAQNSBGRSA-N	219.284	1.234	10	20	BDCD	
C[C@@H](NCc1noc(CN)n1)c1ccccc1O	1579414670	LVTSXPAFGAZMLK-MRVPVSSYSA-N	248.286	1.085	10	20	BDCD	
O=c1[nH]nc(CSc2nccs2)s1	306505935	GCUYYZQUFYWVLT-UHFFFAOYSA-N	231.327	1.580	10	20	BDCD	
CN(Cc1ccco1)C(=O)c1cccc(O)c1O	126254963	PUNDIEYGZMWGRR-UHFFFAOYSA-N	247.250	1.963	10	20	BDCD	
CC[C@](C)(O)CNCc1ccccc1O	82506003	MXLXQOKLFZVNPN-LBPRGKRZSA-N	209.289	1.643	10	20	BDCD	
C[C@H](N[C@H](C)CCO)c1cc(F)ccc1O	132546772	AKKOQATZGVEWMQ-BDAKNGLRSA-N	227.279	1.953	10	20	BDCD	
Cc1ccc(CN2CCC[C@H]2CO)c(O)c1	196423297	IJZGPIBXDXORGG-LBPRGKRZSA-N	221.300	1.657	10	20	BDCD	
COc1ccc(O)c(CNCC(F)F)c1	147416965	QKNMTZSMCNJEDT-UHFFFAOYSA-N	217.215	1.756	10	20	BDCD	
Cc1ccc(O)c(CNCCc2ccn(C)n2)c1	230881463	DXABFBLTLZSDID-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
CNCCCN(C)Cc1cc(F)ccc1O	234369299	KCYWJKJXWIGFBY-UHFFFAOYSA-N	226.295	1.573	10	20	BDCD	
Oc1ccc(F)cc1CNC1CSC1	701973475	QHNIRUXMZKQYIL-UHFFFAOYSA-N	213.277	1.736	10	20	BDCD	
C/C=C/C=C/C(=O)NCc1ccc(O)c(O)c1	62722340	MPOFJHQZUHOLEL-MQQKCMAXSA-N	233.267	1.846	10	20	BDCD	
Oc1cccc2c1[C@H](NCC[C@@H]1CCNC1)CC2	817954819	KUFBECSPYBDVDQ-WCQYABFASA-N	246.354	1.969	10	20	BDCD	
C[C@@]1(CO)CCCN1C(=O)c1cc(O)cs1	832170306	BFQHINVJPXSTTR-NSHDSACASA-N	241.312	1.441	10	20	BDCD	
Nc1ccc(NC(=O)CC[C@@H]2CCCNC2)cc1	856995206	RKEGMXKWRNJJGP-NSHDSACASA-N	247.342	1.987	10	20	BDCD	
Cc1ccc(O)c(CNC2CCN(C)CC2)c1	71407038	BSRSRLMRZPMEHZ-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
CC1=C(C(=O)NCc2ccc(N)cc2)CCCO1	1122536368	ZVFMFVYXTKBMGO-UHFFFAOYSA-N	246.310	1.969	10	20	BDCD	
C[C@H](O)C[C@H](C)NCc1ccccc1O	164460941	HSAHIEWZJYYFIA-UWVGGRQHSA-N	209.289	1.641	10	20	BDCD	
C[C@H](O)CCCN(C)Cc1ccccc1O	789347172	DYFFXEKKYGJEKV-NSHDSACASA-N	223.316	1.985	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](O)C1)c1ccccc1O	295972591	NZAITOBZQDNQSU-LPEHRKFASA-N	207.273	1.566	10	20	BDCD	
C[C@@H](C[S@](C)=O)NCc1cc(F)ccc1O	230392608	ZPIWGRUCNZTYCG-PWJLMRLQSA-N	245.319	1.388	10	20	BDCD	
CC(=O)C(=O)CSc1nnc(C(C)(C)C)o1	808022091	IGQGTVXKMXULTQ-UHFFFAOYSA-N	242.300	1.617	10	20	BDCD	
Nc1ccc(CN2C[C@@H]3[C@H](C2)C3(F)F)cc1	715539272	MIEUFNPPMRYFFJ-PHIMTYICSA-N	224.254	1.966	10	20	BDCD	
COCCN(C)c1ccc(OCC(=O)O)cc1	846279368	ATYXGNKWIIDBRL-UHFFFAOYSA-N	239.271	1.233	10	20	BDCD	
CN(C(=O)CCNC1CC1)c1ccc(N)cc1	877075012	YHEVJFKNSQBEHW-UHFFFAOYSA-N	233.315	1.374	10	20	BDCD	
O=[N+]([O-])c1cnc(SC2COC2)s1	896959867	GJYGALGWCQSJBI-UHFFFAOYSA-N	218.259	1.542	10	20	BDCD	
C[C@@H](CO)N[C@@H](C)c1ccc(F)c(F)c1O	187737950	IMSDUUJUUBYCHQ-BQBZGAKWSA-N	231.242	1.702	10	20	BDCD	
COc1ccc(CNC[C@@H]2CCN2C)cc1C	712588738	XAFAFTYYPYRIHI-ZDUSSCGKSA-N	234.343	1.797	10	20	BDCD	
CCc1cccc(CNCc2cncn2C)c1O	691434075	LDMVNPCTNYNRJY-UHFFFAOYSA-N	245.326	1.978	10	20	BDCD	
[N-]=[N+]=NCCn1cc(Br)cn1	42416140	UUROCGHSPLZAKY-UHFFFAOYSA-N	216.042	1.956	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]1C(=O)O	37835648	OTWNDXTWODGLKE-ZJUUUORDSA-N	249.266	1.071	10	20	BDCD	
O=C(C[C@@H]1CCCCO1)NCc1ccccc1O	122674133	LCMLJSBJWLAASX-LBPRGKRZSA-N	249.310	1.968	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1cc(C)ccc1O	295074398	HSBJFKIFYCWBOK-LBPRGKRZSA-N	223.316	1.903	10	20	BDCD	
Oc1ccc(F)cc1CN1CCc2nn[nH]c2C1	827884625	DWFSZKZYNDCEHX-UHFFFAOYSA-N	248.261	1.208	10	20	BDCD	
CCC(F)(F)C(=O)NCc1ccc(O)c(O)c1	830558820	CPAMPEHPYVVGBG-UHFFFAOYSA-N	245.225	1.759	10	20	BDCD	
CNC(=O)CN(C)Cc1cc(C)c(C)cc1O	916567688	MRVXUUZQBPSMEL-UHFFFAOYSA-N	236.315	1.187	10	20	BDCD	
C/C=C/C[C@@H](CO)NC(=O)Nc1ccc(N)cc1	841296480	TYDMDWDAYMWRKU-JDGPPOGSSA-N	249.314	1.717	10	20	BDCD	
COc1cc(C)cc(CN2CC(C)(O)C2)c1O	894977810	XDRLTOAJVPZGBA-UHFFFAOYSA-N	237.299	1.276	10	20	BDCD	
Oc1nnc(CSc2nccs2)[nH]1	92870267	NSCTUBMSXZKISZ-UHFFFAOYSA-N	214.275	1.259	10	20	BDCD	
C[C@H](CCCO)NC(=O)Cc1ccc(N)cc1	94940895	LWZIOYFFASHKSW-SNVBAGLBSA-N	236.315	1.089	10	20	BDCD	
CN(C(=O)[C@H]1C[C@H]1F)c1ccc(N)cc1	1522217982	QOMTVEASCOFOHQ-VHSXEESVSA-N	208.236	1.590	10	20	BDCD	
NC[C@H]1CC[C@H](NCc2ccc3c(c2)CCO3)C1	841084148	HKDNGDCPOISSTM-FZMZJTMJSA-N	246.354	1.839	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@@H]1CCOC1	708442597	NPJWPQHEVJSVSL-QMMMGPOBSA-N	243.253	1.797	10	20	BDCD	
CCCNC(=O)CN(C)c1ccc(N)cc1	20374715	IBZHXSNWJDHIOG-UHFFFAOYSA-N	221.304	1.231	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCCN(C)C)c1	22141538	OKQWPOYVZWLUOK-JTQLQIEISA-N	238.331	1.613	10	20	BDCD	
COc1cccc(CN2CC[C@@H](OC)C2)c1O	300045703	NOLGFFDUJIMXRJ-LLVKDONJSA-N	237.299	1.622	10	20	BDCD	
CCc1cccc(CNC2(C(N)=O)CC2)c1O	848903007	WTTJCEYIMXYSHI-UHFFFAOYSA-N	234.299	1.062	10	20	BDCD	
COc1cccc(CNCC(C)(C)CO)c1O	124324054	SPNPVNWBBPDDCW-UHFFFAOYSA-N	239.315	1.509	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCCOC1	71011190	NVAMIBXXCMVUAE-LLVKDONJSA-N	207.273	1.661	10	20	BDCD	
C[C@H]1C[C@@H](C)O[C@@H]1C(=O)NCc1ccccc1O	282244507	BTLSNFBXIRCNCJ-CWSCBRNRSA-N	249.310	1.822	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@H]1CCCNC1)CC2	817945622	ICZSWODNQYKZKI-AAEUAGOBSA-N	246.354	1.969	10	20	BDCD	
O=C(O)[C@@]1(F)CCN(Cc2ccccc2O)C1	901515401	LVTJNLQQBBPOHG-GFCCVEGCSA-N	239.246	1.391	10	20	BDCD	
Cc1noc(COC(=O)c2cc(O)cs2)n1	731910398	QTMODLGTAOKYLY-UHFFFAOYSA-N	240.240	1.502	10	20	BDCD	
COc1cccc(CN[C@@H](CO)CCF)c1O	846097237	OEWUJXZGYOYTGF-SNVBAGLBSA-N	243.278	1.211	10	20	BDCD	
CCc1cccc(CN2CC[C@@](C)(O)C2)c1O	848890285	RMSDREBCBMOGIO-CQSZACIVSA-N	235.327	1.911	10	20	BDCD	
CCN[C@H](C)CNCc1cccc(OC)c1O	841066788	WJTKVHOFMKVNTN-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
CCc1cccc(CNC[C@H](C)N(C)C)c1O	691502331	BZAXLFWWEXVIOR-NSHDSACASA-N	236.359	1.994	10	20	BDCD	
C[C@@]1(CNC(=O)c2cc(O)cs2)CCCO1	755860220	NZKXODGVDANPDD-NSHDSACASA-N	241.312	1.753	10	20	BDCD	
Cc1cc(CNC(=O)c2cc(O)cs2)ncn1	757920027	NSLFTEIVIZDXGR-UHFFFAOYSA-N	249.295	1.482	10	20	BDCD	
O=C(c1cc(O)cs1)N(CCO)C1CC1	765233845	SGLSHPFTOCMAPF-UHFFFAOYSA-N	227.285	1.051	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1NC[C@@H]2C[C@@H]21)c1ccccc1O	1119006275	VGIHHVJGVQYFJO-UPBCOZELSA-N	246.310	1.177	10	20	BDCD	
CCN[C@@H](CC)c1cccc(-c2nn[nH]n2)c1O	1590745656	LOSFDXKRSYHGHU-JTQLQIEISA-N	247.302	1.633	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1CCCNC1)CCO2	258987916	LNNPDHRPPNAGCV-CYBMUJFWSA-N	246.354	1.711	10	20	BDCD	
CC(C)NC(=O)CN[C@@H]1CCc2cccc(O)c21	295877319	HKERMEBCLLAXRG-LLVKDONJSA-N	248.326	1.494	10	20	BDCD	
O[C@@H]1CC[C@H]1NCc1ccc2c(c1)CCCO2	922198181	OTRDFGQCXXBSRJ-CHWSQXEVSA-N	233.311	1.625	10	20	BDCD	
Oc1ccccc1CNC[C@@H](O)c1ccco1	135560003	NTAGSVITIXLRQH-GFCCVEGCSA-N	233.267	1.808	10	20	BDCD	
OC[C@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)C1	922297830	BXFQLLIEGCFIOR-XBXGTLAGSA-N	247.338	1.872	10	20	BDCD	
CC[C@H](NCC1CNC1)c1ccc(F)cc1O	817964945	KBSKADQNZIZHQQ-LBPRGKRZSA-N	238.306	1.791	10	20	BDCD	
C[C@H](C[S@](C)=O)NCc1ccccc1O	164253865	KGQWHRSITWNHOZ-RFAUZJTJSA-N	227.329	1.249	10	20	BDCD	
Cc1ccc(CN2C[C@@H](O)C[C@@H](C)C2)c(O)c1	877576195	JQTAYDXGFDDJLN-YPMHNXCESA-N	235.327	1.903	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)CCO	779345789	CXXURTOKDXTTRC-LBPRGKRZSA-N	236.359	1.922	10	20	BDCD	
Cc1ccc(CNC[C@@H](O)C2CCC2)c(O)c1	877574833	WWUDUOJTVLHDNG-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
CCCC(=O)NCc1ccc(OC)cc1O	794390178	ZQVSQWMMSBZDOT-UHFFFAOYSA-N	223.272	1.817	10	20	BDCD	
COc1cccc(CNCCOCCF)c1O	702643447	CXEUIXWHIVULHR-UHFFFAOYSA-N	243.278	1.477	10	20	BDCD	
CCN[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1	707980633	SMQKFBYBLLUNOH-NSHDSACASA-N	249.358	1.367	10	20	BDCD	
C[C@H](N[C@@H]1CCOC1)c1ccccc1O	87783049	SJLIJQFCALURPS-VHSXEESVSA-N	207.273	1.832	10	20	BDCD	
Nc1ccc(NC(=O)c2nsnc2O)cc1	1580449111	BMMBIECISQGSNP-UHFFFAOYSA-N	236.256	1.078	10	20	BDCD	
CC[C@@H](CCO)NCc1cc(OC)ccc1O	164723300	NGVHWCXBPSNJRQ-NSHDSACASA-N	239.315	1.651	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H]2C[C@@H](O)C2)c1	825257065	SSBAMZHCRLBOTD-LPEHRKFASA-N	237.299	1.575	10	20	BDCD	
CNCCN(C)Cc1cc(F)ccc1O	220343449	QKYRRGQLSXUSTC-UHFFFAOYSA-N	212.268	1.183	10	20	BDCD	
CC1(C)CN(Cc2ccc(N)cc2)CC[C@@H]1O	310115473	RYQXRPSYBOECIJ-ZDUSSCGKSA-N	234.343	1.862	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)CCO	877052244	UDADQXSWWMXIOQ-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
CCC(=O)NCc1ccc(N(C)C)c(F)c1	58730502	QWAGMEIUVGOBBF-UHFFFAOYSA-N	224.279	1.918	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)c1cc[nH]c1	122603798	DCJZURRTKJMTDR-UHFFFAOYSA-N	246.266	1.398	10	20	BDCD	
CS[C@@H](C)C(=O)Nc1ccc(N)cc1	38063524	DUWCBGKROFCPEB-ZETCQYMHSA-N	210.302	1.959	10	20	BDCD	
C[C@H]1C[C@@H](N)CCN1C(=O)Cc1ccc(N)cc1	237498440	QYYKDHPTONFRNY-GWCFXTLKSA-N	247.342	1.150	10	20	BDCD	
C[C@@H](CCO)N[C@@H](C)c1ccc(F)cc1O	132564281	FVXYZVVNJUXEBA-IUCAKERBSA-N	227.279	1.953	10	20	BDCD	
C[C@@]1(C(=O)Nc2ccc(N)cc2)CCNC1	237517892	BSUMEUHLPWSUQB-GFCCVEGCSA-N	219.288	1.207	10	20	BDCD	
CC[C@H](C)NC(=O)NCc1ccccc1O	299469964	CURGQHQVUIYXKB-VIFPVBQESA-N	222.288	1.990	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)[C@H](C)O	270765820	GRKWACMOFSBANR-JTQLQIEISA-N	237.299	1.512	10	20	BDCD	
C[C@H](N)CN[C@@H](C)c1cc(F)cc(F)c1O	817971845	HTTHQUSQVAMYDZ-BQBZGAKWSA-N	230.258	1.668	10	20	BDCD	
O=[N+]([O-])CCNCc1ccc(N2CC=CC2)cc1	905135973	YOOSWLDWCXFTQA-UHFFFAOYSA-N	247.298	1.429	10	20	BDCD	
C[C@H](OC(=O)c1cc(O)cs1)C(=O)N(C)C	731910475	RTLKNWQWEIYQCB-LURJTMIESA-N	243.284	1.087	10	20	BDCD	
C[C@@H]1C[C@H](NC(=O)c2cc(O)cs2)CO1	844152996	JFKIKWBZGZUTLI-RQJHMYQMSA-N	227.285	1.361	10	20	BDCD	
Cc1cccc(CN2CCC[C@@H](N)C2)c1O	843043719	FBFXYOVHQGEWQD-GFCCVEGCSA-N	220.316	1.624	10	20	BDCD	
CC(C)(C)[C@H](CN)NCc1cccc(F)c1O	841087667	POTLGYODQJDGJN-NSHDSACASA-N	240.322	1.994	10	20	BDCD	
Nc1ccc(CCNC(=O)NCCCF)cc1	841960311	LZNJRJVKYLXQQY-UHFFFAOYSA-N	239.294	1.470	10	20	BDCD	
Cc1ccc(CN2CCO[C@H](C)C2)c(O)c1	876557018	DUMPTKQLSGMIAJ-LLVKDONJSA-N	221.300	1.921	10	20	BDCD	
COC[C@@H](O)CN[C@@H](C)c1ccc(C)cc1O	71264961	YVMWENYSVJPPTL-QWRGUYRKSA-N	239.315	1.359	10	20	BDCD	
CC(C)CNC(=O)NCc1ccc(N)cc1	1339430422	CHKYPZHIVRFKFK-UHFFFAOYSA-N	221.304	1.724	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCn2ccnc2C1	778189584	RDDATNXFPLDYLF-GFCCVEGCSA-N	243.310	1.693	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CC[C@@H](N)CC2)cc1	1524007981	AQXNZYFHVSUADZ-BJHJDKERSA-N	247.342	1.403	10	20	BDCD	
O=C(CC1CCC1)NCc1cccc(O)c1O	1520508459	BVNPAMKSZBMAFA-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
O=C1CCC[C@H]([C@@H]2CCCCCN2)C1=O	164515028	FFXRYYXWSUOTDV-ZJUUUORDSA-N	209.289	1.457	10	20	BDCD	
C[C@H]1CCNC[C@H]1NCc1ccc2c(c1)CCO2	841058005	DPJGAQOAFIYNQC-SMDDNHRTSA-N	246.354	1.709	10	20	BDCD	
COc1ccc(N(C)CC(=O)NC2CC2)cc1	844353312	MIRZUMLXPITWFS-UHFFFAOYSA-N	234.299	1.410	10	20	BDCD	
Cc1ccc(O)c(CNc2nnco2)c1	309165370	ITUDBRWKMSRATL-UHFFFAOYSA-N	205.217	1.696	10	20	BDCD	
N[C@@H](CC1CC1)C(=O)NCc1ccccc1O	310268692	SCLRARBMNGRUQK-NSHDSACASA-N	234.299	1.136	10	20	BDCD	
CCc1cccc(CNC[C@H](O)COC)c1O	709414399	CDCNVNCWQAHLNW-LBPRGKRZSA-N	239.315	1.052	10	20	BDCD	
Oc1ccc(F)cc1CNCC[C@@H](O)C1CC1	898204101	OBGNLPWPBDUVMZ-CYBMUJFWSA-N	239.290	1.782	10	20	BDCD	
CN(C)C(=O)CCCNCc1ccccc1O	134229891	BRBXPBIRXKJCIN-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
COC[C@@H](NCc1ccccc1O)C1CC1	133141460	IGVWSLUFJWDLJM-GFCCVEGCSA-N	221.300	1.907	10	20	BDCD	
Cc1ccc(C(=O)NCCF)c(O)c1O	281714627	JBXJOVUABFVDOL-UHFFFAOYSA-N	213.208	1.106	10	20	BDCD	
OC/C=C/CNCc1cc(F)ccc1O	717524647	HGYJGYREWRPNIP-OWOJBTEDSA-N	211.236	1.169	10	20	BDCD	
CNCCN[C@@H](C)c1ccc(C)c(C)c1O	817951068	AWLZTZIGBHAJHS-NSHDSACASA-N	222.332	1.879	10	20	BDCD	
NCC1(CC(=O)Nc2ccc(N)cc2)CC1	818556228	BVXUOZMXBVLLFM-UHFFFAOYSA-N	219.288	1.336	10	20	BDCD	
CCONC(=O)/C=C\c1ccc(O)c(O)c1	588405372	GNEUTARLMBLJBW-XQRVVYSFSA-N	223.228	1.179	10	20	BDCD	
CN[C@H]1CCN(Cc2ccc(N(C)C)c(C)c2)C1	923278371	SFSAKVRBBOXYEP-AWEZNQCLSA-N	247.386	1.855	10	20	BDCD	
COc1cccc(O)c1CNC[C@@H]1CCCN1	841036604	SLRVWECWYWRRON-JTQLQIEISA-N	236.315	1.242	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)NCCF	798060398	NOYCKNPWLOFGTA-RQOWECAXSA-N	225.219	1.197	10	20	BDCD	
CC[C@H](NCc1cccc(Cl)c1O)C(=O)O	1326502993	QPSQJQLUCVRSOS-VIFPVBQESA-N	243.690	1.998	10	20	BDCD	
Nc1ccc(CN2CCC[C@H]3CNC[C@H]32)cc1	1345159830	NQWZSVHMNVCNOE-GXTWGEPZSA-N	231.343	1.453	10	20	BDCD	
CC1=NO[C@H](C(=O)N(C)c2ccc(N)cc2)C1	1340846298	CLSRPXYRSRLLMH-NSHDSACASA-N	233.271	1.396	10	20	BDCD	
C[C@H]1CCN(Cc2ccccc2O)C[C@@H]1CN	163405862	KFVCFYCSMTYJDP-AAEUAGOBSA-N	234.343	1.809	10	20	BDCD	
C[C@@H](CO)N[C@@H](C)c1cc(C(=O)O)ccc1O	1593353492	YEBWLOHBIWUVIV-YUMQZZPRSA-N	239.271	1.122	10	20	BDCD	
COc1ccc(CN[C@@H]2CO[C@@H](C)C2)c(O)c1	402008149	AHVRCDDEPMPJDJ-ONGXEEELSA-N	237.299	1.668	10	20	BDCD	
Oc1cccc2c1[C@H](NCc1cc[nH]n1)CC2	383663178	MFZDTGGVEKRPDA-LLVKDONJSA-N	229.283	1.892	10	20	BDCD	
CC(C)C[C@@H](N)C(=O)NCc1ccccc1O	130182121	CXMIGFCGNWRZPK-LLVKDONJSA-N	236.315	1.382	10	20	BDCD	
C[C@H]1C[C@H](N)CCN1C(=O)Cc1ccc(N)cc1	237598283	QYYKDHPTONFRNY-GXFFZTMASA-N	247.342	1.150	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@](C)(C(N)=O)C2)c1	235893593	XBARFFRNRPTQRV-CQSZACIVSA-N	248.326	1.398	10	20	BDCD	
CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1	247939110	MKBAKOLDZYQIGG-CYBMUJFWSA-N	249.310	1.920	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@](F)(CO)C2)c1	802661120	IZJRZYFEFXAIII-CYBMUJFWSA-N	239.290	1.607	10	20	BDCD	
CC[C@@H](N)CN[C@@H](C)c1cc(F)ccc1O	817979280	JMLJGCGPIZNPGV-WCBMZHEXSA-N	226.295	1.919	10	20	BDCD	
O=C(O)CCCCNCc1cc(F)ccc1O	821522335	VPFDWQRGRKFIOO-UHFFFAOYSA-N	241.262	1.876	10	20	BDCD	
CN1CCC[C@@H]1CNC(=O)c1cc(O)cs1	732277086	DXWNMJLVZKENAH-MRVPVSSYSA-N	240.328	1.278	10	20	BDCD	
C[C@H](NC1CC1)C(=O)Nc1ccc(N)cc1	832243988	CRQIOLQTTDZFAQ-QMMMGPOBSA-N	219.288	1.348	10	20	BDCD	
C/C=C\C[C@@H](CO)NC(=O)Nc1ccc(N)cc1	841296479	TYDMDWDAYMWRKU-DLGQBQFBSA-N	249.314	1.717	10	20	BDCD	
CNCCNCc1cc(Cl)ccc1O	841035652	LNICOAVXBCCQQU-UHFFFAOYSA-N	214.696	1.355	10	20	BDCD	
C[C@@H]1CCN(C(=O)NCCc2ccc(N)cc2)C1	841956485	FTDIDEVLDZUFIO-LLVKDONJSA-N	247.342	1.863	10	20	BDCD	
COCC(C)(C)NC(=O)c1cc(O)cs1	846656559	WZSVNHQNGHQUNH-UHFFFAOYSA-N	229.301	1.609	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C(F)F)c1	862761318	NQSBSTOIPAHUEV-UHFFFAOYSA-N	215.199	1.582	10	20	BDCD	
COc1ccc2c(c1)CCCN2CCCO	796329894	YNCXYGQBZSQVFW-UHFFFAOYSA-N	221.300	1.830	10	20	BDCD	
C[C@@H]1C[C@H]1C(=O)NCc1ccc(N)cc1	37666214	FVFXTUYJYHSRIN-LDYMZIIASA-N	204.273	1.541	10	20	BDCD	
C[C@@H](N[C@@H]1CCOC1)c1ccccc1O	87783051	SJLIJQFCALURPS-NXEZZACHSA-N	207.273	1.832	10	20	BDCD	
Nc1ccc(CN2CCO[C@@H](C(F)F)C2)cc1	1352790032	NIEABVOOHAYTNE-LLVKDONJSA-N	242.269	1.735	10	20	BDCD	
Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)c(O)c1	1607781267	MRLWRMXTJDRWIV-PJXYFTJBSA-N	247.294	1.463	10	20	BDCD	
Nc1ccc(NC(=O)CCN2CCOC2=O)cc1	19841112	MCXCBGVBEVOESG-UHFFFAOYSA-N	249.270	1.050	10	20	BDCD	
C[C@@H](CC(N)=O)NCc1cc(Cl)ccc1O	160800735	NOIHHLLVZRFTGE-ZETCQYMHSA-N	242.706	1.399	10	20	BDCD	
CC[C@H](NCCO)c1ccc(N(C)C)cc1	166486767	BSXAWMBYRQRURF-ZDUSSCGKSA-N	222.332	1.786	10	20	BDCD	
C[C@@H](O)[C@@H](C)NCc1ccc2c(c1)CCCN2C	395765776	YEMBGUKDUGOVLH-VXGBXAGGSA-N	248.370	1.928	10	20	BDCD	
COc1ccc(CN[C@@H]2CCSC2)c(O)c1	230705307	ZKLMXEFEIIJXCA-SNVBAGLBSA-N	239.340	1.996	10	20	BDCD	
COC[C@H](CO)N[C@H](C)c1cc(C)ccc1O	234837642	PPNDVANZNWUBSY-MNOVXSKESA-N	239.315	1.359	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC[C@@H](C)CN)c1	817963214	SJBPULAKGSWPIS-WDEREUQCSA-N	222.332	1.946	10	20	BDCD	
CN(Cc1cnc[nH]1)Cc1cc(F)ccc1O	826768525	BMFJVVOSZOQHNZ-UHFFFAOYSA-N	235.262	1.886	10	20	BDCD	
COC(=O)CCCNC(=O)c1cc(O)cs1	732257199	GCQRIXJUKTXVNQ-UHFFFAOYSA-N	243.284	1.137	10	20	BDCD	
O=C(NCc1ccccn1)c1cc(O)cs1	731866945	VDGKOPQTSKRXDB-UHFFFAOYSA-N	234.280	1.779	10	20	BDCD	
C[C@@]1(CNCc2ccccc2O)CCCNC1	841057451	NHLMTAHCHLUCEA-CQSZACIVSA-N	234.343	1.872	10	20	BDCD	
Cn1ccc(CNCCc2ccc(N)cc2)c1	863641934	MPOCBXAYYMYSEN-UHFFFAOYSA-N	229.327	1.940	10	20	BDCD	
Cc1cccc(O)c1CNCc1ccno1	877321656	NYTFMTRCHZHKSM-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
COC(=O)[C@H]1CCC[C@H]1NCc1ccccc1O	1116771990	XUMFJJQFVQDQKZ-NWDGAFQWSA-N	249.310	1.824	10	20	BDCD	
CC(C)[C@H](CN)CNCCc1ccc(N)cc1	873211128	WDLVMGKZFIELLC-CYBMUJFWSA-N	235.375	1.632	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](C(=O)O)C2)c1	86790163	ICSHEPYACGRASV-SNVBAGLBSA-N	235.283	1.607	10	20	BDCD	
CCc1cccc(CN[C@H]2CC(=O)N(C)C2)c1O	691453178	MWZJKVLQZAWUPS-LBPRGKRZSA-N	248.326	1.275	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@@]1(O)CCOC1)CC2	297092000	XHHOBYKQPULUJF-FZMZJTMJSA-N	249.310	1.121	10	20	BDCD	
Oc1c(F)cccc1CNCC12CC(CO1)C2	529663274	QRLBYOIKKHXHAS-UHFFFAOYSA-N	237.274	1.800	10	20	BDCD	
C[C@@H](NCC1(CO)CC1)c1ccc(F)cc1O	122315041	ZHGYSMUBAVMVGD-SECBINFHSA-N	239.290	1.954	10	20	BDCD	
O=C(CCNC1CC1)NCc1ccccc1O	228421621	RHYIGXQDLTYZSC-UHFFFAOYSA-N	234.299	1.151	10	20	BDCD	
C[C@H]1C[C@@H](CN)CN1Cc1cc(F)ccc1O	220338152	XHYBWYSVKBHVCD-UWVGGRQHSA-N	238.306	1.700	10	20	BDCD	
COc1ccc(CN[C@H]2CCSC2)c(O)c1	230705311	ZKLMXEFEIIJXCA-JTQLQIEISA-N	239.340	1.996	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@@H](CO)C2)c1	271732850	NMWQQESXPPMKTA-SNVBAGLBSA-N	237.299	1.215	10	20	BDCD	
Cc1cccc(CNC/C=C\CO)c1O	717525632	PNACWTUMTDJRCE-IHWYPQMZSA-N	207.273	1.339	10	20	BDCD	
COc1ccc(N2CC[C@@H](CNC(N)=O)C2)cc1	818048163	MYMWDLJFHVKTTI-JTQLQIEISA-N	249.314	1.190	10	20	BDCD	
C[C@H](NCCNC1CC1)c1ccc(F)cc1O	817954137	VGBWOEQFDQRIMN-VIFPVBQESA-N	238.306	1.934	10	20	BDCD	
Oc1cccc2c1[C@@H](NCC1=CCNCC1)CC2	817968140	PWYYSESCRAPVMM-ZDUSSCGKSA-N	244.338	1.889	10	20	BDCD	
CNC1CCN(Cc2cccc(F)c2O)CC1	843049728	UUDAFHGRPRQCAX-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
CN(C)c1ccc2c(c1)OCCN2CCCN	841011845	PJRNBCISXIEZSU-UHFFFAOYSA-N	235.331	1.300	10	20	BDCD	
O=C(N[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(O)cs1	846659288	QTEIJGUHDBWGAX-HLTSFMKQSA-N	239.296	1.503	10	20	BDCD	
Cc1cc(CN2CCC(N)CC2)ccc1N(C)C	923277201	MIJGKFVQAWUJGY-UHFFFAOYSA-N	247.386	1.984	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C2=COCC2)c1	769539202	COTNIYIFCKKJCF-UHFFFAOYSA-N	249.266	1.321	10	20	BDCD	
Cc1ccc(CN2CC[C@H](C)[C@H]2CO)c(O)c1	877464001	IETOMNYOXFVPCQ-WCQYABFASA-N	235.327	1.903	10	20	BDCD	
CC(=O)CN[C@H](C)c1ccc(N(C)C)cc1	878455045	NTIDAPQUPRREGM-LLVKDONJSA-N	220.316	1.992	10	20	BDCD	
[N-]=[N+]=NCCN1CCOC[C@H]2CCC[C@H]21	409435183	STPRRNJFHGBTRA-NXEZZACHSA-N	210.281	1.798	10	20	BDCD	
CN(Cc1ccc(N)cc1)Cc1cnc[nH]1	1356083548	SDZZHZKEWQZYQL-UHFFFAOYSA-N	216.288	1.624	10	20	BDCD	
CN1CCc2cc([C@H](CN)N3CCCC3)ccc21	34936241	JBQRHIFZTANXKI-HNNXBMFYSA-N	245.370	1.775	10	20	BDCD	
O=C(O)CCNCc1cccc(F)c1O	165148717	TUGFDHAVXQZTBN-UHFFFAOYSA-N	213.208	1.096	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccc(F)cn1	168264564	AKGYESSKYZWXLM-UHFFFAOYSA-N	246.241	1.856	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@H]2CO)cc1	11727392	TWCAYHROZDSMHW-AWEZNQCLSA-N	234.343	1.709	10	20	BDCD	
COc1ccc(CNCC2(C(=O)O)CC2)cc1C	258938455	PLJSKYNLZURXIV-UHFFFAOYSA-N	249.310	1.958	10	20	BDCD	
C[C@@H](NC1CC1)C(=O)N(C)Cc1ccccc1O	296454132	OJCGOTAPTJKRMY-SNVBAGLBSA-N	248.326	1.491	10	20	BDCD	
Cc1ccc([C@@H](C)NCc2nnn(C)n2)c(O)c1	398084872	PLRIEHDUNWDEKU-SECBINFHSA-N	247.302	1.075	10	20	BDCD	
CN(CCN(C)C1CC1)Cc1ccccc1O	290443427	LXHDXYTZVOHDAI-UHFFFAOYSA-N	234.343	1.918	10	20	BDCD	
CCNCCN[C@@H](C)c1ccccc1O	817953296	ZGIVZFLPOSXBMT-JTQLQIEISA-N	208.305	1.652	10	20	BDCD	
CCOC(=O)C1(C(=O)Nc2ccc(N)cc2)CC1	818556484	UTINCKKNFAFSRU-UHFFFAOYSA-N	248.282	1.551	10	20	BDCD	
C[C@H](C(=O)NCc1ccc(O)cc1O)C1CC1	910950540	HFDBRJYGMQHIEJ-QMMMGPOBSA-N	235.283	1.760	10	20	BDCD	
CNCCCNCc1cc(C)c(C)cc1O	841041434	GESVYKMDXLFEIQ-UHFFFAOYSA-N	222.332	1.708	10	20	BDCD	
C[C@H](N)CN(C)Cc1ccc(N(C)C)c(F)c1	863653555	NDDMIJJOBOUQCC-JTQLQIEISA-N	239.338	1.671	10	20	BDCD	
Cc1ccc(CN[C@@H](C)CN(C)C)c(O)c1	877523823	ZPKKSTYIUMAQHR-NSHDSACASA-N	222.332	1.740	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H]1CCN1C	896593950	DAJBGHDDIBVEJJ-NSHDSACASA-N	220.316	1.494	10	20	BDCD	
O=C(N[C@@H]1C=CCC1)c1cccc(O)c1O	829344346	XVBLLUOBLRKEFH-MRVPVSSYSA-N	219.240	1.546	10	20	BDCD	
c1cc2c(cc1CN[C@H]1CCNC1)CCO2	258868730	FYVWNPGPKAQOIN-LBPRGKRZSA-N	218.300	1.073	10	20	BDCD	
NC[C@@H](NCc1ccc2c(c1)CCO2)C1CC1	841028684	QSCGWDHUPPQQSD-CYBMUJFWSA-N	232.327	1.448	10	20	BDCD	
OCc1ccc(NCc2ccccc2O)nc1	686077630	HDXNFYYUBFTXAJ-UHFFFAOYSA-N	230.267	1.892	10	20	BDCD	
Nc1ccc(NC(=O)N[C@@]23COC[C@@H]2C3)cc1	718082510	QENAVMQJYZEQTA-UFBFGSQYSA-N	233.271	1.179	10	20	BDCD	
CO[C@@H](C(=O)NCc1ccccc1O)C(C)C	771416395	GHCAFLTZJRRDGY-GFCCVEGCSA-N	237.299	1.679	10	20	BDCD	
CCOc1cccc(CN[C@H](CC)CO)c1O	20195034	ISLXXYOOFICIMX-LLVKDONJSA-N	239.315	1.651	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC[C@@H](C)O)c1	35601840	UVAXSFWALKDRRH-RKDXNWHRSA-N	225.288	1.432	10	20	BDCD	
CCO[C@@H](CC)C(=O)NCc1ccc(N)cc1	837303047	RFLOZRLEWZDCHR-LBPRGKRZSA-N	236.315	1.700	10	20	BDCD	
O=C(NCc1nccs1)c1cc(O)cs1	732272628	YYUBXFRHQDPNCO-UHFFFAOYSA-N	240.309	1.840	10	20	BDCD	
O=C(OCCn1ccnc1)c1cccc(O)c1O	758556721	GIQABAQBLIIVSI-UHFFFAOYSA-N	248.238	1.151	10	20	BDCD	
CCN(Cc1cc2c(cc1O)OC[C@@H]2O)C1CC1	768440143	DIPUGXZTTGDGTK-ZDUSSCGKSA-N	249.310	1.802	10	20	BDCD	
CCN(CC(=O)OC)Cc1ccc(C)cc1O	876685931	MYBJTZFWGXPYAH-UHFFFAOYSA-N	237.299	1.696	10	20	BDCD	
C[C@@H]1CCN1C(=O)c1c(F)ccc(O)c1O	881481818	JRLFBYNEHGBPTB-ZCFIWIBFSA-N	225.219	1.471	10	20	BDCD	
COC[C@@H](C)OC(=O)c1ccc(C)c(O)c1O	783344007	KPTGRXXIHJZMHM-MRVPVSSYSA-N	240.255	1.598	10	20	BDCD	
CC[C@@H](C)[C@H](N)C(=O)Nc1ccc(N)cc1	169816528	OHOVGZVHSMDYTL-KCJUWKMLSA-N	221.304	1.581	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@@H](O)[C@@H](CC2CC2)C1	409435675	WCXFHVGHUYOPOK-WDEREUQCSA-N	224.308	1.780	10	20	BDCD	
Nc1ccc(CNC(=O)CCNC2CC2)cc1	1343568203	XOQKHUXAPZXDIA-UHFFFAOYSA-N	233.315	1.027	10	20	BDCD	
O=C(O)CC(=O)NCc1cccc(Cl)c1O	1601887856	AWTQJEFMLDICOU-UHFFFAOYSA-N	243.646	1.137	10	20	BDCD	
COc1cccc([C@H](C)NCCC(=O)O)c1O	1594123585	QJKKYPBTACZDSN-QMMMGPOBSA-N	239.271	1.526	10	20	BDCD	
Cc1nc(C(=O)N(C)Cc2ccccc2O)no1	136712325	ROJNIWGXZRAKLX-UHFFFAOYSA-N	247.254	1.356	10	20	BDCD	
CC[C@@H](CO)NCc1cc(C)c(C)cc1O	164406880	DHRCJTLIAHHZED-LBPRGKRZSA-N	223.316	1.870	10	20	BDCD	
c1cc2c(cc1CN[C@@H]1CCNC1)CCCO2	259221126	XNDJKYSNVMIKRJ-CYBMUJFWSA-N	232.327	1.463	10	20	BDCD	
CNC(=O)C[C@@H](C)N[C@@H]1CCc2cccc(O)c21	322803386	RBGVDAMXOJVPJO-MWLCHTKSSA-N	248.326	1.494	10	20	BDCD	
CCOc1cccc(CNC(C)(C)CO)c1O	20196437	OJTVHVIVLBICLX-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
OCC1CCN(Cc2cc(F)ccc2O)CC1	179915180	LPYPBZHBJRRYSM-UHFFFAOYSA-N	239.290	1.736	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@@H](C)CO)c1	35602995	DUYOAJLSKAHSLA-IUCAKERBSA-N	225.288	1.432	10	20	BDCD	
Oc1ccc(F)cc1CN[C@@H]1CC[C@H]1O	382162256	SZOLUHKUMZBSGE-MWLCHTKSSA-N	211.236	1.144	10	20	BDCD	
C[C@H](N[C@H]1CCNC1)c1ccc(N(C)C)cc1	817944411	BHAQGXOCSNXNLP-AAEUAGOBSA-N	233.359	1.765	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2CCN2C)c1	712537312	CTSVVDAIMDPOTD-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
C[C@@H](CN)N[C@H]1CCc2cccc(O)c21	817969660	GFAGOWMBBNIUMJ-WPRPVWTQSA-N	206.289	1.316	10	20	BDCD	
C[C@H](NCC1(N)CC1)c1cc(F)ccc1O	902404867	GEWMWNPMNDTBOL-QMMMGPOBSA-N	224.279	1.673	10	20	BDCD	
Cc1cccc(CN2C[C@@H](C)NC[C@H]2C)c1O	843120114	XVAXHMUNUWWCIZ-VXGBXAGGSA-N	234.343	1.883	10	20	BDCD	
COc1ccc(O)c(CNCC(C)(C)N)c1	841031047	OQPIEHGPJLKLGF-UHFFFAOYSA-N	224.304	1.228	10	20	BDCD	
Cc1cccc(CN[C@H](C)C(=O)O)c1O	165157712	VDOSDVIIBBZVTJ-MRVPVSSYSA-N	209.245	1.263	10	20	BDCD	
CCOC(=O)CN(C)Cc1c(C)cccc1O	876566035	WCAJOCWXFYTWPL-UHFFFAOYSA-N	237.299	1.696	10	20	BDCD	
CN(C(=O)C(=O)C(C)(C)C)c1ccc(N)cc1	877078208	IBADOIBZZOFJQE-UHFFFAOYSA-N	234.299	1.847	10	20	BDCD	
COc1cc(C)cc(CNC[C@H](C)OC)c1O	894534101	XTZGICAOUUWSAO-JTQLQIEISA-N	239.315	1.834	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)COc2ccccc2)C1	409425017	ZXTZXXYOHUPFFZ-UHFFFAOYSA-N	232.243	1.587	10	20	BDCD	
CC[C@H](F)C(=O)NCc1ccc(OC)cc1O	1335941511	RJJRFGHWKKWRHZ-JTQLQIEISA-N	241.262	1.765	10	20	BDCD	
C[C@H](Sc1nccs1)C(=O)C(=O)O	1609806625	OVSRZKTTZPPXFT-BYPYZUCNSA-N	217.271	1.277	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCC[C@H]1O	125266125	PYBCVWXVNMKILQ-ZYHUDNBSSA-N	207.273	1.395	10	20	BDCD	
CCO[C@H]1C[C@H]1C(=O)NCc1ccccc1O	299571644	PLTPADOKQSHFJU-PWSUYJOCSA-N	235.283	1.433	10	20	BDCD	
COc1cccc(CN[C@@H](C)C[C@H](C)O)c1O	228085215	FFGGOSLVOCDFME-UWVGGRQHSA-N	239.315	1.650	10	20	BDCD	
CC[C@H](CO)NCc1cccc(OC)c1O	20195052	VCRWLFYNVIOENQ-SNVBAGLBSA-N	225.288	1.261	10	20	BDCD	
C[C@@H](O)CCN(C)Cc1ccccc1O	128553439	LSZUNGOHHAEWRB-SNVBAGLBSA-N	209.289	1.595	10	20	BDCD	
C[C@@H](NCc1ncn(C)n1)c1ccccc1O	228802350	AAVDYKSVZNAFCS-SECBINFHSA-N	232.287	1.372	10	20	BDCD	
CCN(CC(=O)NC)Cc1cc(F)ccc1O	226562266	MTTTVJMLVWCFEQ-UHFFFAOYSA-N	240.278	1.099	10	20	BDCD	
CC(=O)C(=O)COc1ccc(C(C)=O)cc1F	289772357	WJMSBBGAMSNZGU-UHFFFAOYSA-N	238.214	1.565	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@](C)(O)C1CC1	287621367	ZDKUWICDWZNBRV-AWEZNQCLSA-N	249.310	1.512	10	20	BDCD	
CC(=O)C(=O)Cn1sc2ccccc2c1=O	808024782	PYFDMGDDPMNUAG-UHFFFAOYSA-N	235.264	1.221	10	20	BDCD	
COC1CN(Cc2cc(C)c(C)cc2O)C1	738226452	UOSXMFHNVAENFI-UHFFFAOYSA-N	221.300	1.840	10	20	BDCD	
CC(=O)[C@@H](C)OC(=O)c1cc(O)cs1	732354475	NFAMUXFBAPGALA-ZCFIWIBFSA-N	214.242	1.588	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCO[C@H]2C[C@@H]21	832634317	NHVJPIWNNXPASS-YUMQZZPRSA-N	225.269	1.067	10	20	BDCD	
Cc1cc(CN(C)[C@@H](C)CN)ccc1N(C)C	923289048	DISMOLTYOWTDFQ-LBPRGKRZSA-N	235.375	1.840	10	20	BDCD	
CCC[C@H](O)C(=O)N(C)Cc1ccccc1O	934705309	VNUAQLVUROAFSY-LBPRGKRZSA-N	237.299	1.512	10	20	BDCD	
CCN(CCCO)Cc1ccc(C)cc1O	876766267	GSBOUVPBCXHGFJ-UHFFFAOYSA-N	223.316	1.905	10	20	BDCD	
CCCN(Cc1ccc(N)cc1)[C@@H]1CCNC1	1236325080	YORSDGPKSFXHCR-CQSZACIVSA-N	233.359	1.843	10	20	BDCD	
CC[C@@H](C)[C@H](N)C(=O)NCCc1ccc(N)cc1	169816544	LOKCQGZNNVAHCR-MFKMUULPSA-N	249.358	1.301	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1=COCC1	1520508792	MOPMUYXVHKIHCB-UHFFFAOYSA-N	235.239	1.018	10	20	BDCD	
C[C@]1(NCc2cc(F)c(F)cc2O)CCNC1	1573627304	ZCEAUSTWDIWKQN-LBPRGKRZSA-N	242.269	1.512	10	20	BDCD	
O=C1NC[C@H](CSc2nccs2)O1	264634545	KXHOEOSCKUKQQX-RXMQYKEDSA-N	216.287	1.344	10	20	BDCD	
Nc1ccc(NC(=O)N2CCC[C@@H](O)CC2)cc1	378676911	QHCCYZBVYIJETI-GFCCVEGCSA-N	249.314	1.648	10	20	BDCD	
Nc1ccc(CN(CC(=O)O)C2CC2)cc1	1608273070	PSGAKWRKBGOAQK-UHFFFAOYSA-N	220.272	1.318	10	20	BDCD	
CN(C)c1ccc(CNCCCCO)cc1F	278807184	SAIUFGANSFBHEN-UHFFFAOYSA-N	240.322	1.754	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H]3CNC[C@@H]32)cc1	385403087	WROKRENBXTUVCE-HIFRSBDPSA-N	245.370	1.546	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c(O)c1C	817977073	AHVIDJZNZGOVHZ-SCUASFONSA-N	246.354	1.877	10	20	BDCD	
Cc1nonc1CNC(=O)c1cc(O)cs1	743419483	VLLMLPYIAUETTD-UHFFFAOYSA-N	239.256	1.075	10	20	BDCD	
CN(CC1(O)CCC1)C(=O)c1cc(O)cs1	760448003	BXMXARYKSLKHGF-UHFFFAOYSA-N	241.312	1.441	10	20	BDCD	
O=C(CCc1ncc[nH]1)NCc1ccccc1O	774064561	KUTBIIOTLXKARV-UHFFFAOYSA-N	245.282	1.364	10	20	BDCD	
Cc1c[nH]nc1C(=O)NCc1ccc(O)c(O)c1	799697553	FMZDOGCBMNTDBP-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
C[C@@H]1CN(C(=O)NCc2ccc(N)cc2)CCO1	1337019304	RUDQMFGRERLHTD-SNVBAGLBSA-N	249.314	1.199	10	20	BDCD	
CCC[C@H]1CNCCN1Cc1ccc(N)cc1	1262487302	QAOHMUOIJAZARY-AWEZNQCLSA-N	233.359	1.843	10	20	BDCD	
NC1CC(NCc2ccc3c(c2)CCCO3)C1	906510872	NFHBNQQPSCVWFW-UHFFFAOYSA-N	232.327	1.591	10	20	BDCD	
CC1(C)[C@@H](NCc2ccccc2O)C[C@H]1O	163421638	KOGUUWCKIQKSKL-NWDGAFQWSA-N	221.300	1.641	10	20	BDCD	
C[C@H](N)[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	834460318	GMUMQLUXXLRPIH-CMPLNLGQSA-N	247.342	1.007	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1C[C@H](OC)C1	858321839	HIBFLJVECRCDCE-MGCOHNPYSA-N	237.299	1.668	10	20	BDCD	
CCN1C[C@@H](NCc2cccc(C)c2O)CC1=O	391598510	IQJJZXCBPKBRLQ-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
CC1(C)CCN(C(=O)c2cccc(O)c2O)C1	126481678	ACMXZRJOVNHFPR-UHFFFAOYSA-N	235.283	1.970	10	20	BDCD	
CN[C@H]1CCN(Cc2cc(Cl)ccc2O)C1	150073744	RYBIBJHPPRHKAY-NSHDSACASA-N	240.734	1.839	10	20	BDCD	
COc1cccc(CNC(=O)C2CC=CC2)c1O	77613932	CKGMYSQJKRRZBB-UHFFFAOYSA-N	247.294	1.983	10	20	BDCD	
C[C@H](N[C@@H]1CCCCNC1=O)c1ccccc1O	36977393	OQROCBIXQYSZNS-CMPLNLGQSA-N	248.326	1.712	10	20	BDCD	
C[C@@H](Sc1nccs1)c1nnnn1C	188977376	PVVALTMLCVQUGJ-RXMQYKEDSA-N	227.318	1.520	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@@H](C)CCO)c1	132435257	KVZYOEUWXVLTME-VHSXEESVSA-N	239.315	1.822	10	20	BDCD	
C[C@H](N[C@H](C)C(=O)O)c1ccccc1O	49353273	APSSINNZPFUMQH-JGVFFNPUSA-N	209.245	1.516	10	20	BDCD	
COCCN(CCO)Cc1cc(C)ccc1O	93006097	SSLHOFNRKBFUNF-UHFFFAOYSA-N	239.315	1.141	10	20	BDCD	
CC[C@H]1NCC[C@@H]1C(=O)Nc1ccc(N)cc1	294779687	NORSRMMZWXAUBG-NWDGAFQWSA-N	233.315	1.595	10	20	BDCD	
CNC[C@@H](C)N[C@H]1CCc2cccc(O)c21	854232470	QUBXYVCTTFBWAG-KOLCDFICSA-N	220.316	1.577	10	20	BDCD	
C[C@@H](NC(N)=O)c1ccc(N2CCOCC2)cc1	920867167	OHVGJSGYQBBPLM-SNVBAGLBSA-N	249.314	1.253	10	20	BDCD	
C[C@@H](N)CN(C)Cc1cccc(F)c1O	863652889	XYPWNIQCKLHGEQ-MRVPVSSYSA-N	212.268	1.310	10	20	BDCD	
C[C@@H](O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1	775407786	WMPJOGAOFVULFD-NXEZZACHSA-N	236.315	1.311	10	20	BDCD	
C[C@@H](NC[C@@H]1CCN1C)c1ccc(F)cc1O	712594664	NPGBUMQSPHPECH-KOLCDFICSA-N	238.306	1.886	10	20	BDCD	
COc1cccc(O)c1CN1CCO[C@@H](C)C1	768231535	VTAIWLXNIMUJAH-JTQLQIEISA-N	237.299	1.622	10	20	BDCD	
CCN1CC[C@@H]1C(=O)NCCc1ccc(N)cc1	1577767025	GGPWFXSFZKJTHX-CYBMUJFWSA-N	247.342	1.022	10	20	BDCD	
COc1c[nH]nc1NC(=O)Cc1ccc(N)cc1	1579318858	CDMZFCBACOCWCL-UHFFFAOYSA-N	246.270	1.182	10	20	BDCD	
CC(C)(N)CNCc1ccc2c(c1)CCO2	258936124	VWUUINUWKFGCIT-UHFFFAOYSA-N	220.316	1.448	10	20	BDCD	
C[C@H](C(=O)O)N1CCCc2cc(CN)ccc21	700883831	UBPOWRMLZVKOHR-SECBINFHSA-N	234.299	1.371	10	20	BDCD	
C[C@@H](NCc1ccccc1O)c1ncn(C)n1	391853511	RUIQZOSNAAPJGP-SECBINFHSA-N	232.287	1.372	10	20	BDCD	
C[C@@H](N[C@@H]1CC[C@H]1O)c1ccc(N(C)C)cc1	818357724	JUMHREUCNPUGDH-LERXQTSPSA-N	234.343	1.927	10	20	BDCD	
NC(=O)NCc1ccc(N2CCCC2)cc1	78454453	YMOCRPNBLNIBOM-UHFFFAOYSA-N	219.288	1.455	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CCCN	37823764	GEJSKLTZZMDGGU-UHFFFAOYSA-N	222.288	1.090	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1CCCCO1	189640154	VGWDJNTUGLKTHR-GQCTYLIASA-N	249.266	1.665	10	20	BDCD	
CCCN(C)C(=O)/C=C/c1ccc(O)c(O)c1	180720560	JVMHBKGMNZFUCV-FNORWQNLSA-N	235.283	1.979	10	20	BDCD	
CCN(CCO)Cc1cccc(C)c1O	132477441	CKIWTSCFBQKCPP-UHFFFAOYSA-N	209.289	1.515	10	20	BDCD	
COc1ccc(N(C)C[C@H]2CCCN2)cc1	49969900	AAXOUYGHBSQDHQ-LLVKDONJSA-N	220.316	1.883	10	20	BDCD	
CCOc1ccc(O)c(CN[C@@H](C)COC)c1	236868669	NKGVZHOBQFZQLF-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
CC[C@H](CO)N(C)Cc1cccc(C)c1O	295021571	CHKODZXRUSDEQH-GFCCVEGCSA-N	223.316	1.903	10	20	BDCD	
O=C1CC[C@H](C(=O)NCc2ccc(O)cc2O)C1	828251213	ACJBLMMWXNSSGC-QMMMGPOBSA-N	249.266	1.083	10	20	BDCD	
Cc1nnc(NC(=O)c2cc(O)cs2)s1	731867605	NROPLMBJQINCSI-UHFFFAOYSA-N	241.297	1.866	10	20	BDCD	
CC1=NO[C@@H](C(=O)NCc2ccccc2O)C1	830526268	HNBORUQJERNMJJ-LLVKDONJSA-N	234.255	1.173	10	20	BDCD	
C[C@H](CN)N(C)Cc1ccc(N(C)C)c(F)c1	843052710	VWEJZHGSNXXFLH-SNVBAGLBSA-N	239.338	1.671	10	20	BDCD	
O=C(CCn1cccc1)NCc1ccccc1O	751061993	ZQWWRJUKKWJYMS-UHFFFAOYSA-N	244.294	1.900	10	20	BDCD	
Cc1ccc(CNCc2cc[nH]n2)c(O)c1	876914949	JJIKBVLZNPWIGP-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
Cc1cccc(O)c1CNCc1nncn1C	876929554	KDXLRCRQSQJYRH-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
CC[C@H](C)[C@H](N)C(=O)N(C)c1ccc(N)cc1	877077996	YMBCGDRHKCAELM-CABZTGNLSA-N	235.331	1.605	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@@H](O)C1)c1c(O)cccc1F	886643617	ZZHAMMLOZKIRTP-BBBLOLIVSA-N	239.290	1.953	10	20	BDCD	
C[C@H](CO)N[C@H](C)c1c(O)cccc1F	886509987	OIOYBVBETSUOGR-HTQZYQBOSA-N	213.252	1.563	10	20	BDCD	
C[C@H](O)CN(C)Cc1cc(F)cc(F)c1O	894450281	HELPOFBMFRLNBW-ZETCQYMHSA-N	231.242	1.483	10	20	BDCD	
CN1CCCc2cc(CN[C@H]3CCOC3)ccc21	75186317	WGLGTCASJKQVAR-AWEZNQCLSA-N	246.354	1.948	10	20	BDCD	
[N-]=[N+]=NCCN1CCOC[C@@H]2CCC[C@@H]21	409435184	STPRRNJFHGBTRA-UWVGGRQHSA-N	210.281	1.798	10	20	BDCD	
CC[C@]1(C(=O)NCc2ccc(N)cc2)CCNC1	1263303698	FEOPTCIEFPXNDD-AWEZNQCLSA-N	247.342	1.275	10	20	BDCD	
C[C@@H](NCCC(=O)O)c1c(O)cccc1F	1603248017	SDRGYWGDSPUBRN-SSDOTTSWSA-N	227.235	1.657	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1ccc[nH]1	159011254	CZSJTIDMLIZMSS-UHFFFAOYSA-N	232.239	1.356	10	20	BDCD	
C[C@H](NC[C@@H]1CCCN1)c1ccccc1O	817953307	ZTIDAOBFFIIORT-QWRGUYRKSA-N	220.316	1.795	10	20	BDCD	
N[C@H]1CCN(Cc2cccc(Cl)c2O)C1	309379693	RISQPMGNWVLGIX-VIFPVBQESA-N	226.707	1.579	10	20	BDCD	
CN(C)c1ccc(CNCc2ncc[nH]2)cc1F	67695113	LZTDQQJHTYJMBW-UHFFFAOYSA-N	248.305	1.905	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NCC(F)F	181146258	BNLRWGPQRSXLAW-DUXPYHPUSA-N	243.209	1.492	10	20	BDCD	
CCN(C)C(=O)CNCc1cccc(C)c1O	187676565	CFHBCAYFMHLPTG-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
OC[C@H]1CCCN(Cc2cc(F)ccc2O)C1	183244107	CGXZDIJNOKCLCH-JTQLQIEISA-N	239.290	1.736	10	20	BDCD	
COc1cccc(CN[C@H]2CCN(C)C2)c1O	42544200	UXOJSZFATRWJHK-NSHDSACASA-N	236.315	1.195	10	20	BDCD	
C[C@H](N[C@@H](CN)C1CC1)c1cc(F)ccc1O	817959297	FJIHXJJFTGQVFB-UFBFGSQYSA-N	238.306	1.919	10	20	BDCD	
C[C@@H](CCN)NCc1ccc(N(C)C)c(F)c1	841049451	DXMLRKGRWSGEKZ-JTQLQIEISA-N	239.338	1.719	10	20	BDCD	
CCC[C@@H](O)CNC(=O)c1cc(O)cs1	771064714	KRUVWDDFZIDAPN-SSDOTTSWSA-N	229.301	1.345	10	20	BDCD	
CC1(N)CCN(Cc2ccc(N)cc2)CC1	1120269722	ZZOQUDNDTUWFPI-UHFFFAOYSA-N	219.332	1.582	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1CC=CC1	1123887383	BIYHUBPNYZWXSZ-UHFFFAOYSA-N	233.267	1.680	10	20	BDCD	
CC[C@@H]1CC[C@@H](C(=O)NCc2ccc(N)cc2)O1	1343566067	DJOBKXRHCOYTQO-OLZOCXBDSA-N	248.326	1.843	10	20	BDCD	
COc1cccc(CNC[C@H](C)CO)c1O	82367471	VSASQVUFQMZYCJ-VIFPVBQESA-N	225.288	1.119	10	20	BDCD	
CCN(C[C@@H](C)N)c1ccc(OC)cc1	20239632	OUNMXRNTNMYRPX-SNVBAGLBSA-N	208.305	1.869	10	20	BDCD	
C[C@@H](NC(=O)CCCCO)c1ccccc1O	827941168	OJMNVTDCUOFFHS-SNVBAGLBSA-N	237.299	1.732	10	20	BDCD	
CC[C@H](O)CN[C@@H](C)c1ccccc1O	162197758	LYTVOLGQKZRPPR-UWVGGRQHSA-N	209.289	1.814	10	20	BDCD	
O=C(O)c1cnc(S[C@H]2CCOC2)s1	703097380	MLXAEGOQMDWFCR-YFKPBYRVSA-N	231.298	1.722	10	20	BDCD	
CC(C)C(=O)COC(=O)c1cc(O)cs1	732354534	UMMAHZWZSVBLFZ-UHFFFAOYSA-N	228.269	1.836	10	20	BDCD	
CC[C@@H](N)CNCc1ccc(N(C)C)c(F)c1	841071349	DQAJPUUGUIWSIY-LLVKDONJSA-N	239.338	1.719	10	20	BDCD	
COC(=O)[C@H]1C[C@@H](NCc2ccc(C)cc2O)C1	877634894	ZDXWIDDVYLSMPM-TXEJJXNPSA-N	249.310	1.742	10	20	BDCD	
CN(C(=O)C1(N)CCC1)c1ccc(N)cc1	877077570	NGHQXNZUMISGRX-UHFFFAOYSA-N	219.288	1.113	10	20	BDCD	
CN(CC(N)=O)Cc1c(O)ccc(Cl)c1F	792162077	BLCPNLRWMXAARY-UHFFFAOYSA-N	246.669	1.102	10	20	BDCD	
Cc1ccc(CN[C@H]2COC[C@H]2C)c(O)c1	896733137	NCEAHIMOJWIHPD-PWSUYJOCSA-N	221.300	1.825	10	20	BDCD	
C[C@@H](N[C@@H]1CCCN(C)C1=O)c1ccccc1O	707764255	ZUKHDPDGGBZLLL-ZYHUDNBSSA-N	248.326	1.664	10	20	BDCD	
NCCCNCc1ccc2c(c1)CCCO2	163295238	NARORLZXMVMOHZ-UHFFFAOYSA-N	220.316	1.450	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)C[C@H](C)N1	204050520	SKSZCTZKEAAKHM-QWRGUYRKSA-N	219.332	1.451	10	20	BDCD	
Oc1cccc(Cl)c1CN1CC[C@H](O)C1	128163453	GZXNRAUIGUCETK-QMMMGPOBSA-N	227.691	1.612	10	20	BDCD	
C[C@@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCCN1	817902855	ZNNRTBVTYNACIH-RISCZKNCSA-N	246.354	1.852	10	20	BDCD	
COc1ccc(N(C)C[C@@H](C)N)c(OC)c1	74012011	NDLIIIHXAXVGKR-SECBINFHSA-N	224.304	1.487	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C2CC(=O)C2)cc1	136146129	BCIBYQZLNFCMCN-UHFFFAOYSA-N	246.310	1.348	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC/C=C/CO)c1	717544767	CEHAJSXPMHGJDA-FSIBCCDJSA-N	237.299	1.600	10	20	BDCD	
C[C@H](C[C@H]1CCCN1)NCCc1ccc(N)cc1	841038787	QGVHRWDNFPEQEM-IUODEOHRSA-N	247.386	1.932	10	20	BDCD	
Cc1ccc(C(=O)OC(C)C)c(O)c1O	750620630	ZVZYRPFAHWALJY-UHFFFAOYSA-N	210.229	1.971	10	20	BDCD	
CC[C@@H]1CN(Cc2c(C)cccc2O)C[C@H]1O	876815173	NMDXWJLVJMEFJM-BXUZGUMPSA-N	235.327	1.903	10	20	BDCD	
C[C@@H](N[C@H](C)c1nnnn1C)c1ccccc1O	879649484	UMHUCJBMZLQTHT-RKDXNWHRSA-N	247.302	1.328	10	20	BDCD	
COC1(C)CN(Cc2ccc(C)cc2O)C1	877533741	RCAKDSSUTCXBHU-UHFFFAOYSA-N	221.300	1.921	10	20	BDCD	
COc1ccc(CNc2ncc(F)cn2)c(O)c1	795288336	BWVOBLWCOGJFFV-UHFFFAOYSA-N	249.245	1.942	10	20	BDCD	
O=C(O)[C@@H](CF)NCc1cc(F)ccc1O	1601651338	TYBDYALZCYYUBP-MRVPVSSYSA-N	231.198	1.044	10	20	BDCD	
CC[C@H](C)N(C)C(=O)c1cccc(O)c1O	163270348	AZOXSJWNLUNKBN-QMMMGPOBSA-N	223.272	1.968	10	20	BDCD	
Nc1ccc(CCNC(=O)C[C@H]2CCOC2)cc1	401519633	NKBAQMLBRRGFBP-GFCCVEGCSA-N	248.326	1.354	10	20	BDCD	
Cc1ccc(O)c(CN2CCN[C@@H](C)[C@@H]2C)c1	379473032	UKARXLNTWNJFGE-RYUDHWBXSA-N	234.343	1.883	10	20	BDCD	
CO[C@H]1CCN(Cc2c(C)cccc2O)C1	876745702	KAHQHSDLIWFDMU-NSHDSACASA-N	221.300	1.921	10	20	BDCD	
CCOc1cccc(CN2CC[C@@H](N)C2)c1O	50227657	KAUWTBDKRLVVCY-LLVKDONJSA-N	236.315	1.324	10	20	BDCD	
CC(C)N(CC(N)=O)Cc1cc(F)ccc1O	179885584	GZUTVFSACQDVHW-UHFFFAOYSA-N	240.278	1.227	10	20	BDCD	
C[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@H]1O	230210003	ZISBYCKXKBSNHG-GXFFZTMASA-N	248.326	1.041	10	20	BDCD	
C[C@H](O)CCNCc1cc([N+](=O)[O-])ccc1O	304142675	VVOLBZWMPCZCED-QMMMGPOBSA-N	240.259	1.161	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](C)N(C)C)c1	38087868	LOILEJBBTXYPPY-SNVBAGLBSA-N	238.331	1.441	10	20	BDCD	
CC(C)NCCC(=O)Nc1ccc(N)cc1	131531773	FWVCVUTYXUPPLQ-UHFFFAOYSA-N	221.304	1.595	10	20	BDCD	
COC[C@H](C)CC(=O)Nc1ccc(N)cc1	87420391	KLSYFFRDIGKJMJ-SECBINFHSA-N	222.288	1.880	10	20	BDCD	
COC[C@H](C)CNCc1cc(F)ccc1O	226587917	WNRHVQSDFNJVNP-SECBINFHSA-N	227.279	1.903	10	20	BDCD	
COc1ccc(O)c(CN(C)C[C@@H](C)OC)c1	289649718	MTLAAJYCEUUOGK-SNVBAGLBSA-N	239.315	1.868	10	20	BDCD	
CCN[C@@H](C)c1cc(C(=O)OC)ccc1O	273412759	QAVOVMQYQHJRCN-QMMMGPOBSA-N	223.272	1.849	10	20	BDCD	
CCc1cccc(CN(C)C2(CO)CC2)c1O	827898236	IABOWNREQHSFHU-UHFFFAOYSA-N	235.327	1.911	10	20	BDCD	
CC[C@@H](NCc1cc(C)ccc1O)C(=O)NC	697914115	BJFGLUIPVYHAHP-LLVKDONJSA-N	236.315	1.315	10	20	BDCD	
Cc1ccc(CN2CC(=O)N(C)C[C@H]2C)c(O)c1	877461306	DKKGRLHHCVWKEH-LLVKDONJSA-N	248.326	1.363	10	20	BDCD	
Cc1ccc(CN[C@H](C)CCO)c(O)c1	877052118	RLDYHBHHSROUQP-SNVBAGLBSA-N	209.289	1.561	10	20	BDCD	
CC[C@@H](CO)N[C@@H](C)c1c(O)cccc1F	886489735	POEJCEFRAIURLA-IUCAKERBSA-N	227.279	1.953	10	20	BDCD	
OC[C@@]12C[C@H]1CN(Cc1ccccc1O)C2	783745333	VTEDGKPWYDRFPN-AAEUAGOBSA-N	219.284	1.206	10	20	BDCD	
CCN[C@H](C)C(=O)NCc1ccccc1O	707923360	XUXRTKLJTVARJP-SECBINFHSA-N	222.288	1.006	10	20	BDCD	
CCOC(=O)[C@@H](CC)Oc1ccc(N)cc1	31896851	RDQLARSQWKWBRS-LLVKDONJSA-N	223.272	1.989	10	20	BDCD	
CN(CCO)Cc1cc(Cl)ccc1O	127916769	JTYSWXMWSCTKEG-UHFFFAOYSA-N	215.680	1.470	10	20	BDCD	
Nc1ccc(CNC(=O)CC[C@@H]2CCOC2)cc1	401378051	NPFCENXMZZTGHW-GFCCVEGCSA-N	248.326	1.702	10	20	BDCD	
C=CC(=O)NCc1ccc(N(C)C)cc1	40799126	XSKACEODHXBACR-UHFFFAOYSA-N	204.273	1.555	10	20	BDCD	
CCO[C@H](C)c1nccn1CC(=O)C(C)=O	808029901	ULLFRIWPUREYEI-SECBINFHSA-N	224.260	1.139	10	20	BDCD	
NC(=O)NCc1cc(Cl)cc(Cl)c1O	806559842	GNILCWNUFNGACN-UHFFFAOYSA-N	235.070	1.867	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)C[C@H](C)N	829764538	OFCUCJHXMLCCKJ-NSHDSACASA-N	249.358	1.415	10	20	BDCD	
CSCCCNC(=O)c1cc(O)cs1	736681851	DCVNTYOVLUJVJP-UHFFFAOYSA-N	231.342	1.937	10	20	BDCD	
COc1cc(C)cc(CN2CC[C@H]2CO)c1O	902629258	ARVGDIKOIIGDRH-NSHDSACASA-N	237.299	1.276	10	20	BDCD	
CC1(C)CN(C(=O)c2cc(O)cs2)CCO1	731868918	DXNRSKMKOPTPRL-UHFFFAOYSA-N	241.312	1.705	10	20	BDCD	
CC(=O)N1CC[C@@H](N[C@H](C)c2ccccc2O)C1	857083884	AHIMATTVFKNJIW-ZYHUDNBSSA-N	248.326	1.664	10	20	BDCD	
CN(C)CC1(C(=O)N(C)c2ccc(N)cc2)CC1	877077040	UXAGMSKNHCSQIB-UHFFFAOYSA-N	247.342	1.573	10	20	BDCD	
CC[C@H]1NCC[C@H]1C(=O)N(C)c1ccc(N)cc1	877076927	XHOHEXKVNJZYNP-CHWSQXEVSA-N	247.342	1.620	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2[C@H]3CCC(=O)[C@@H]32)cc1	1122540970	YBKFUETWJVSJHP-CYZMBNFOSA-N	244.294	1.110	10	20	BDCD	
Cc1cc(NCc2ccccc2O)nc(CO)n1	1326377382	VYPKQIDEQOUVCY-UHFFFAOYSA-N	245.282	1.595	10	20	BDCD	
CCN(CCN)Cc1c(C)cc(OC)cc1O	1577721082	SMBXFQQMSSZANB-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
CC[C@@H](NC)C(=O)N[C@H](C)c1ccccc1O	870988700	XHBZIQBCUZBUSZ-MWLCHTKSSA-N	236.315	1.567	10	20	BDCD	
CCN(C)C(=O)CN[C@H](C)c1ccccc1O	179902690	NCOHYJDHYMXRBV-SNVBAGLBSA-N	236.315	1.521	10	20	BDCD	
Nc1ccc(CNC(=O)NC2CC2)cc1	54456821	WJKWMZGAWFSWSD-UHFFFAOYSA-N	205.261	1.230	10	20	BDCD	
C[C@@]1(CN)CCN(Cc2ccccc2O)C1	309411904	IZKPWVZLCZBCAW-ZDUSSCGKSA-N	220.316	1.563	10	20	BDCD	
CC(=O)N[C@H]1CCN(Cc2cccc(C)c2O)C1	228356556	QNTWTRFGGPOYJR-ZDUSSCGKSA-N	248.326	1.411	10	20	BDCD	
Cc1ccc([C@H](C)NCc2ncn(C)n2)c(O)c1	186214555	QFLBBUNOBHICRC-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
Oc1ccccc1CN1CCCOCC1	132725853	ZDVRZPZEJWMHDJ-UHFFFAOYSA-N	207.273	1.615	10	20	BDCD	
CC(C)[C@H](O)CNCc1cc(F)ccc1O	226608798	DYADZUVHGNEEOU-GFCCVEGCSA-N	227.279	1.638	10	20	BDCD	
CC(=O)C(=O)COc1ccc2c(c1)CCCC2=O	289643176	NFNIESIUYYPZDH-UHFFFAOYSA-N	246.262	1.743	10	20	BDCD	
CCOc1ccc(O)c(CNCC2(N)CC2)c1	904449339	JFIIDPUFTNVPDR-UHFFFAOYSA-N	236.315	1.372	10	20	BDCD	
Oc1c(Cl)cccc1CN1CCCNCC1	843044756	IDWSFAZGLFJYDC-UHFFFAOYSA-N	240.734	1.841	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@@H](C)CCO	846111894	RWSUWEZFHJWZPJ-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
CN(CCO)Cc1cc(Cl)cc(F)c1O	775639490	XDAIRXGUMLVYCS-UHFFFAOYSA-N	233.670	1.609	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC[C@H](CF)C1	881669328	UDDFBHWLMKXXJX-SSDOTTSWSA-N	229.276	1.885	10	20	BDCD	
c1cc2c(cc1CN[C@@H]1CCCNC1)CCCO2	84565847	PNUUPBHXFKBHRI-CQSZACIVSA-N	246.354	1.853	10	20	BDCD	
C[C@@H](NCC1(CO)COC1)c1ccccc1O	717647174	DGZIAWUUSODKAQ-SNVBAGLBSA-N	237.299	1.052	10	20	BDCD	
C[C@@H]1C[C@@H](C)[C@H](C(=O)NCc2ccc(N)cc2)O1	1343473110	LBVINNSXBPZOPP-GIPNMCIBSA-N	248.326	1.699	10	20	BDCD	
Nc1ccc(CN[C@@H](C(=O)O)C2CC2)cc1	1608273106	ROAKHWABUALXBD-LLVKDONJSA-N	220.272	1.222	10	20	BDCD	
Cc1ccc(/C=C2/SC(=S)NC2=O)cn1	154231250	JPQOYGLWSQJLSK-XBXARRHUSA-N	236.321	1.879	10	20	BDCD	
C[C@H](NCc1ccc(Cl)cc1O)C(=O)O	1599901841	XQLIQIFXYKAYID-LURJTMIESA-N	229.663	1.608	10	20	BDCD	
CC1(C)CN(Cc2ccc(N)cc2)CCO1	36231793	LYGWMXOFCSYTAI-UHFFFAOYSA-N	220.316	1.880	10	20	BDCD	
NCCCCCCNC(=O)Cc1ccc(N)cc1	843505203	CYNCQUWUFATBKZ-UHFFFAOYSA-N	249.358	1.447	10	20	BDCD	
NC[C@H]1CC[C@@H](NC(=O)Cc2ccc(N)cc2)C1	834860625	CKRAUQBJEQKKQX-WCQYABFASA-N	247.342	1.055	10	20	BDCD	
CNC(=O)N[C@H](C)c1cc(OC)ccc1O	171409125	HVNPRSNJIZVHOX-SSDOTTSWSA-N	224.260	1.391	10	20	BDCD	
COCCOCCNCc1cc(C)ccc1O	71408665	WLZYRNQJCXJYCI-UHFFFAOYSA-N	239.315	1.453	10	20	BDCD	
COc1ccc(CNCC[S@](C)=O)cc1C	124198500	VYGVACHEHFUIOT-MRXNPFEDSA-N	241.356	1.472	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@H]1CCOC1	162872498	JLHVRUKTIBACLQ-VIFPVBQESA-N	227.691	1.924	10	20	BDCD	
COC(=O)CCSc1ncc([N+](=O)[O-])s1	281755098	BYBVLWWZTWBPJG-UHFFFAOYSA-N	248.285	1.707	10	20	BDCD	
CC[C@@H](N)CNCc1c(O)cccc1Cl	841071334	DECIXAQDMAQPMS-MRVPVSSYSA-N	228.723	1.873	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)CCN	841049666	GKVGVCUBNADOPM-LBPRGKRZSA-N	235.375	1.888	10	20	BDCD	
C[C@H](CN)NCc1c(O)ccc(Cl)c1F	841061349	YIIGYDIVIJJGJH-ZCFIWIBFSA-N	232.686	1.622	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCCCO	840928320	PGWDIEBSXZPWKV-UHFFFAOYSA-N	222.332	1.533	10	20	BDCD	
Cc1ccc(CN2C[C@H]3COC[C@H]3C2)c(O)c1	872265839	MJIOLOQDBJGKHZ-BETUJISGSA-N	233.311	1.779	10	20	BDCD	
C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@@H]1O	897681471	VRPWTDDILCOTIQ-KWQFWETISA-N	241.718	1.858	10	20	BDCD	
COC(=O)[C@H](C)NCc1ccc2c(c1)CCCO2	894027531	DBMIOTVJDOKBCU-JTQLQIEISA-N	249.310	1.663	10	20	BDCD	
COC[C@@H](O)CNCc1c(O)cccc1Cl	83748641	MYASJQAGJQEQIP-QMMMGPOBSA-N	245.706	1.143	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@H]1C	92081950	YIDMOIGAXRWJJU-PHIMTYICSA-N	232.327	1.926	10	20	BDCD	
COC(=O)N(C)CCNCc1ccccc1O	689494309	OXCRUEURXMLHQR-UHFFFAOYSA-N	238.287	1.180	10	20	BDCD	
CCOc1ccc(O)c(CNCCCCN)c1	1348515834	QIZGNNNTTUAIFP-UHFFFAOYSA-N	238.331	1.619	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H](C(=O)O)[C@@H]1C	1600543485	YWLCDJMWQJUTAY-QWRGUYRKSA-N	249.310	1.996	10	20	BDCD	
CNCCN(C)Cc1cccc(C)c1O	381857052	VBQDRNYKYMWEGC-UHFFFAOYSA-N	208.305	1.352	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@@H]2CCNC2=O)c1	770377669	BDCUJJLZVNJWAF-LLVKDONJSA-N	234.299	1.021	10	20	BDCD	
COCCCN(C)Cc1cc(F)ccc1O	179997701	CHBORTPFMAPJCW-UHFFFAOYSA-N	227.279	2.000	10	20	BDCD	
CC[C@@H](CO)NCc1cc(C)ccc1O	70955054	UGYSWHDGXQEKOV-NSHDSACASA-N	209.289	1.561	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@H]2CCCCN2)cc1	238115699	KKTXOXRPQYLPBB-CYBMUJFWSA-N	247.342	1.070	10	20	BDCD	
CCn1ncc(CNCc2cc(C)ccc2O)n1	527734129	KUSXUEVOZZLIKP-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
CONC(=O)NCc1ccc2c(c1)CCCN2C	194660822	NJMWHELFHBGLHG-UHFFFAOYSA-N	249.314	1.430	10	20	BDCD	
COCC(COC)NCc1ccccc1O	385063952	UZKWJBLZIBQIBP-UHFFFAOYSA-N	225.288	1.143	10	20	BDCD	
CNCCCN[C@@H](C)c1ccc(C)cc1O	817940391	MHLJUZLYOGWMBC-NSHDSACASA-N	222.332	1.961	10	20	BDCD	
C[C@H](Cn1cncn1)NCc1ccccc1O	725848867	AHMBCBIJUSOIBD-SNVBAGLBSA-N	232.287	1.162	10	20	BDCD	
Nc1ccc(NC(=O)C2(N)CCC2)cc1	832250187	LWFBFDJYADQLJE-UHFFFAOYSA-N	205.261	1.089	10	20	BDCD	
CC[C@](C)(O)C(=O)N(C)Cc1ccccc1O	934705300	UZLYQYSOULFDFK-ZDUSSCGKSA-N	237.299	1.512	10	20	BDCD	
Cc1ccc(CNC[C@H]2CC[C@H](O)C2)c(O)c1	877468607	KXUIHLHFVQWGLU-AAEUAGOBSA-N	235.327	1.951	10	20	BDCD	
Oc1c(Cl)cccc1CNC[C@@H]1COCO1	894875527	FRKOQJRGKPTFFA-SECBINFHSA-N	243.690	1.508	10	20	BDCD	
O=[N+]([O-])c1cnc(S[C@@H]2CCOC2)s1	799960404	UHOBDVQDHTYGBA-RXMQYKEDSA-N	232.286	1.932	10	20	BDCD	
Cc1cc(OCC(=O)Nc2ccc(N)cc2)no1	701390044	HTJWCROENHQYCY-UHFFFAOYSA-N	247.254	1.583	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@H](C)CN)c1	274697089	WXJOKTQEPLXYPK-SNVBAGLBSA-N	208.305	1.480	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](CO)C1)c1ccccc1O	707641942	YMLXWCVQSWSBQC-GARJFASQSA-N	221.300	1.814	10	20	BDCD	
Cn1ccc(/C=C2\SC(S)=NC2=O)n1	2573452	VSKDEFIKTBRPBZ-XQRVVYSFSA-N	225.298	1.320	10	20	BDCD	
C[C@]1(CN)CCN(C(=O)Cc2ccc(N)cc2)C1	834723140	RUXMQUKZXRFNRL-CQSZACIVSA-N	247.342	1.009	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@H]1C[C@@H](O)C1	294915256	SQSKGLOHNIBGBS-OCAPTIKFSA-N	227.691	1.659	10	20	BDCD	
CCO[C@@H]1C[C@@H]1C(=O)NCc1ccccc1O	299571634	PLTPADOKQSHFJU-CMPLNLGQSA-N	235.283	1.433	10	20	BDCD	
CCCN[C@@H]1CCC2=C(C1)[S@@](=O)C(=N)N2	2048531915	MZOCOESUNXMDIR-KWKYVRJSSA-N	227.333	1.037	10	20	BDCD	
CC[C@H](CO)NCc1ccc2c(c1)CCCO2	921474265	RYXUFDODUCXBEL-CYBMUJFWSA-N	235.327	1.872	10	20	BDCD	
C[C@H](O)C1(NCc2ccc(N(C)C)cc2)CC1	827579544	FWHZSSUCAGHZJP-NSHDSACASA-N	234.343	1.756	10	20	BDCD	
CO[C@@H]1COC[C@H]1N[C@H](C)c1ccccc1O	842912090	QFSQDXWWDBEWHG-IRUJWGPZSA-N	237.299	1.457	10	20	BDCD	
CC[C@@H](CO)NCc1c(C)cccc1O	877460873	YPLQFHPILULZCK-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
COc1ccc(O)c(CNC[C@H]2CCCO2)c1	20092619	FUXWXLZIMYGGHR-GFCCVEGCSA-N	237.299	1.669	10	20	BDCD	
CN(Cc1cnn(C)c1)Cc1cc(F)ccc1O	179888217	GZBZUKALYWLMSS-UHFFFAOYSA-N	249.289	1.897	10	20	BDCD	
C[C@@H]1CCCN1C(=O)Cc1ccc(N)cc1	37909589	DVXQKHUSPWDCJD-SNVBAGLBSA-N	218.300	1.822	10	20	BDCD	
N[C@H](CC(=O)NCc1ccccc1O)C1CC1	228420859	MGRQTAKDKFVERG-LLVKDONJSA-N	234.299	1.136	10	20	BDCD	
CNC(=O)[C@H](C)NCc1c(O)cccc1Cl	83552081	MJQYGDDJNGYQEV-ZETCQYMHSA-N	242.706	1.270	10	20	BDCD	
CNCCCN[C@@H](C)c1ccccc1O	238337815	HKHYDJIPMOPOGX-JTQLQIEISA-N	208.305	1.652	10	20	BDCD	
CCNC(=O)CN(CC)c1ccc(OC)cc1	269650992	VFYXRIHJMZHUMA-UHFFFAOYSA-N	236.315	1.658	10	20	BDCD	
CC[C@@H](OC)C(=O)NCc1ccc(O)c(O)c1	272262164	BUXKCSJSHRWUDT-LLVKDONJSA-N	239.271	1.139	10	20	BDCD	
COc1cccc(CN2CC[C@@H]3CNC[C@@H]32)c1O	395357518	KWXKVKKXMKYNCI-PWSUYJOCSA-N	248.326	1.195	10	20	BDCD	
CCOc1ccc(O)c(CNCCCON)c1	904458435	YUJNGZZFRNLOEH-UHFFFAOYSA-N	240.303	1.161	10	20	BDCD	
C[C@@H](CNC(=O)c1cc(O)cs1)CN(C)C	832565107	PGFXLJBKFQQFLM-QMMMGPOBSA-N	242.344	1.381	10	20	BDCD	
CC(C)(C)[C@H](CN)NC(=O)Cc1ccc(N)cc1	841854895	BRFJEMBAFOEUIL-LBPRGKRZSA-N	249.358	1.301	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](CN)C2)c1O	843048453	WPOPDEJEMZBGAX-NSHDSACASA-N	220.316	1.481	10	20	BDCD	
Cc1cccc(CN(C)C[C@H](C)N)c1O	863651447	JBBABRCXAWJANJ-JTQLQIEISA-N	208.305	1.480	10	20	BDCD	
Cc1ccc(CN[C@H](CO)CCF)c(O)c1	877614967	PVJUTIOPHMPMFY-NSHDSACASA-N	227.279	1.511	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@H]2C=CCC2)cc1	711767224	KNDSVBCWERTXCX-LBPRGKRZSA-N	230.311	1.894	10	20	BDCD	
COc1cccc(O)c1CNCC[C@@H](C)OC	726607384	OGAIDQAXGXSQCI-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
NC[C@H]1CC[C@@H](NCc2ccc3c(c2)CCO3)C1	841084150	HKDNGDCPOISSTM-SMDDNHRTSA-N	246.354	1.839	10	20	BDCD	
COc1cccc(CNC[C@@H](O)C(C)C)c1O	134698236	PAVCVHUECZDXHY-LLVKDONJSA-N	239.315	1.507	10	20	BDCD	
Cn1cncc1CNCc1ccccc1O	122238963	GRBDPJDWPPXYEQ-UHFFFAOYSA-N	217.272	1.416	10	20	BDCD	
COc1cccc(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1O	367840376	QJDGTLKYHRMNTO-GDNZZTSVSA-N	249.310	1.071	10	20	BDCD	
CC[C@@H](O)CSc1ncc(C(=O)OC)s1	296108764	KXTKHDOOWJVGIO-ZCFIWIBFSA-N	247.341	1.793	10	20	BDCD	
CCNCCNCc1cc(F)ccc1O	841037172	POWJGLDYGRYQAB-UHFFFAOYSA-N	212.268	1.230	10	20	BDCD	
CC[C@H](NCc1cc(C)ccc1O)C(=O)NC	697914116	BJFGLUIPVYHAHP-NSHDSACASA-N	236.315	1.315	10	20	BDCD	
CCC[C@H](O)C(=O)NCc1ccccc1O	934936402	UEQQRCIAKZZJDP-NSHDSACASA-N	223.272	1.169	10	20	BDCD	
COC(=O)CN(C)Cc1c(O)cccc1OC	768401446	RDEHBCVBCUGLGL-UHFFFAOYSA-N	239.271	1.006	10	20	BDCD	
CCNC(=S)N[C@H](C)c1ccccc1O	865269491	OOXHUEKFHNWJAY-MRVPVSSYSA-N	224.329	1.937	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2ccccc2O)CCN1C	90721242	ULPUYZMYDUJNPC-YPMHNXCESA-N	234.343	1.965	10	20	BDCD	
NC[C@H]1CC[C@H](NCc2ccc(N)cc2)C1	1335288127	DNZDXVMAVLVUEB-AAEUAGOBSA-N	219.332	1.486	10	20	BDCD	
Cc1cnc(CNCc2ccc3c(c2)CCO3)[nH]1	693484757	FUQCDPJWNHUMRR-UHFFFAOYSA-N	243.310	1.943	10	20	BDCD	
C[C@H]1C[C@H](NC(=O)NCc2ccc(N)cc2)CO1	1335602858	GOZYLOKPQURLSB-CABZTGNLSA-N	249.314	1.245	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@H](O)C2)cc1	850417909	QRVUPIRCLXEOJF-AULYBMBSSA-N	220.316	1.366	10	20	BDCD	
COc1cc(C)c(CNC/C=C\CN)c(O)c1	1579144346	APLLDYVUOQJJGQ-ARJAWSKDSA-N	236.315	1.314	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CC[C@@H]1N	832736871	FIQGNKIABHFZIO-MFKMUULPSA-N	247.342	1.007	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CO[C@H](C)C2)c1	402034280	CHRMXFAJHIHYHB-PWSUYJOCSA-N	221.300	1.968	10	20	BDCD	
Cc1cccc(O)c1CNCC1(C)OCCO1	877118119	NFFLPGJHMXMOLI-UHFFFAOYSA-N	237.299	1.553	10	20	BDCD	
CN(Cc1ccccc1O)[C@H]1CCCCNC1=O	119948171	ORHOMOHLUAKJJU-LBPRGKRZSA-N	248.326	1.493	10	20	BDCD	
Nc1ccc(NC(=O)NCCOCC2CC2)cc1	236355112	GNCNRXQUGMNEBA-UHFFFAOYSA-N	249.314	1.817	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)c2nncn2C)c1	71407592	WOEUHNSRBRVAGE-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
CCCC(=O)NCCc1ccc(N)cc1	32011624	ZCLYZNBWPLOHIF-UHFFFAOYSA-N	206.289	1.728	10	20	BDCD	
C[C@H]1C[C@H](C(=O)NCc2ccccc2O)CO1	132779664	OCRIOIMFYCRHFM-ONGXEEELSA-N	235.283	1.433	10	20	BDCD	
C[C@H](N[C@H]1CCNC1)c1cc(F)cc(F)c1O	817944969	QLHSIDGVMVKUSC-CBAPKCEASA-N	242.269	1.683	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](O)[C@H]2C)c1	825104009	KGLBFHFAKZWZLV-ZYHUDNBSSA-N	221.300	1.656	10	20	BDCD	
NOCCCN[C@@H]1CCc2cccc(O)c21	902415067	KIGWFXJSZVTJTO-SNVBAGLBSA-N	222.288	1.250	10	20	BDCD	
Oc1c(F)cccc1CN1CCCNCC1	843045442	QPFUCQBWDZPEKR-UHFFFAOYSA-N	224.279	1.327	10	20	BDCD	
CCNC(=N)NCc1cc(Cl)ccc1O	849049901	VPWOEWXDMVQPHA-UHFFFAOYSA-N	227.695	1.679	10	20	BDCD	
CNCCCNCc1ccc(N(C)C)cc1C	841041428	FYRQVJZMSILBAG-UHFFFAOYSA-N	235.375	1.760	10	20	BDCD	
Cc1cccc(O)c1CN1CCC[C@@H](CO)C1	876510395	UXCBGUKERKCISX-GFCCVEGCSA-N	235.327	1.905	10	20	BDCD	
COCc1nc(Sc2nccs2)n[nH]1	892928200	BKDFOEORXLJKCB-UHFFFAOYSA-N	228.302	1.559	10	20	BDCD	
O=C1NCCCC[C@@H]1NCc1ccccc1O	36976904	JYRBKNHMSUBPGE-NSHDSACASA-N	234.299	1.151	10	20	BDCD	
CN(Cc1ccnn1C)c1ccc(N)cc1	689537264	KMOFIMCDFGXLTQ-UHFFFAOYSA-N	216.288	1.639	10	20	BDCD	
C[C@H](CC(N)=O)N[C@H](C)c1ccc(N(C)C)cc1	161364645	PUUJPRYFYWJEQB-GHMZBOCLSA-N	249.358	1.667	10	20	BDCD	
CNC[C@@H](C)NCc1ccc(N(C)C)cc1	162187702	HSMYDNAVSBTCDV-LLVKDONJSA-N	221.348	1.450	10	20	BDCD	
CC[C@](C)(CO)NCc1cccc(C)c1O	163728069	LVRUOJSRFUPAPZ-CYBMUJFWSA-N	223.316	1.951	10	20	BDCD	
CC(C)NCCCNC(=O)Cc1ccc(N)cc1	841848043	RQXADTNTDGADAE-UHFFFAOYSA-N	249.358	1.316	10	20	BDCD	
C[C@@H](NCc1cc(F)ccc1O)C(=O)O	235206508	KJKCQAHHXPTGKU-ZCFIWIBFSA-N	213.208	1.094	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCOC1)c1ccccc1O	827930923	VDBFIHDLKUTRPS-NXEZZACHSA-N	235.283	1.606	10	20	BDCD	
CN(C)c1ccc(CNCC(C)(C)O)cc1F	113340746	UGCSAQKXEMCJOP-UHFFFAOYSA-N	240.322	1.752	10	20	BDCD	
NC(=O)CC1CCN(Cc2ccccc2O)CC1	179558872	KAJAEMCNZHLEBZ-UHFFFAOYSA-N	248.326	1.480	10	20	BDCD	
COc1cccc(CN[C@@H]2CCN(C)C2)c1O	42544201	UXOJSZFATRWJHK-LLVKDONJSA-N	236.315	1.195	10	20	BDCD	
Cn1cccc1C(=O)NCc1ccccc1O	133941118	BYMIGYJDOTYYTA-UHFFFAOYSA-N	230.267	1.661	10	20	BDCD	
NC1(CN[C@@H]2CCc3cccc(O)c32)CCC1	817965612	YHUSPAYQXXMOHX-LLVKDONJSA-N	232.327	1.851	10	20	BDCD	
CC(=O)C(=O)CSc1nc(C)c(C)[nH]1	814778199	VAGIFPMMFUVZAG-UHFFFAOYSA-N	212.274	1.277	10	20	BDCD	
C[C@H]1C[C@@H](NCCN)c2c(O)ccc(F)c21	817935454	WERXVXVPVNSXCG-IONNQARKSA-N	224.279	1.628	10	20	BDCD	
O=[N+]([O-])CCNCc1ccc(N2CCCC2)cc1	905035699	OPMOLFROJTUYLU-UHFFFAOYSA-N	249.314	1.653	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCNC2)cc1F	841044397	FAEWSUWSUUWZOM-NSHDSACASA-N	237.322	1.343	10	20	BDCD	
COc1cccc([C@@H](C)N[C@@H]2CCOC2)c1O	846158495	ZWTBGEHJIMZEKJ-NXEZZACHSA-N	237.299	1.840	10	20	BDCD	
CNC[C@@H](C)NCc1cc(F)ccc1O	853248703	IQOSBJIXJUPOCW-MRVPVSSYSA-N	212.268	1.229	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCCN2C)c1	862760449	RAEANDHKCCMGKH-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
C[C@H](NC[C@H]1C[C@H](N)C1)c1ccc(F)cc1O	873259038	XVIWMGVYNDIWFG-QXEWZRGKSA-N	238.306	1.919	10	20	BDCD	
CNC(=O)C[C@H](C)NCc1ccc(C)cc1O	877573635	SWNYFNRLBRKRSB-JTQLQIEISA-N	236.315	1.315	10	20	BDCD	
CCN1CC(=O)N[C@H]1c1cc(F)cc(F)c1O	887329697	MUPYZXMLCJDODM-LLVKDONJSA-N	242.225	1.121	10	20	BDCD	
CC1=NO[C@@H](C(=O)N(C)c2ccc(N)cc2)C1	1340846296	CLSRPXYRSRLLMH-LLVKDONJSA-N	233.271	1.396	10	20	BDCD	
CCN(OC)C(=O)c1cc(O)cs1	1349394357	AVANBWSMUXMAAQ-UHFFFAOYSA-N	201.247	1.477	10	20	BDCD	
O=C(O)c1cnc(SC[C@@H](O)C2CC2)s1	1608978585	HIMVAKLBTUCCKW-ZCFIWIBFSA-N	245.325	1.704	10	20	BDCD	
COc1cccc(O)c1CN(C)C1CC(N)C1	843125278	QRGLJMIGSDCOLP-UHFFFAOYSA-N	236.315	1.322	10	20	BDCD	
C[C@H]1[C@@H](C)NCCN1C(=O)Cc1ccc(N)cc1	262804361	PVBNRNAVUQPWHH-MNOVXSKESA-N	247.342	1.020	10	20	BDCD	
Cc1ncoc1CNCc1ccccc1O	894214387	XBUCDJNCAAJPMV-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
Oc1ccccc1CN1CCSCC1	142816979	XWCBLEYDANLDPN-UHFFFAOYSA-N	209.314	1.941	10	20	BDCD	
CC1(C)CN(Cc2cc(F)ccc2O)C[C@H]1O	280572524	VZJZGNHNGSFBGZ-GFCCVEGCSA-N	239.290	1.734	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cccc(C)c1C	808487487	AULWDZYMSXIVDE-UHFFFAOYSA-N	234.251	1.618	10	20	BDCD	
Cc1ccc([C@@H](C)NCC(F)(F)CN)c(O)c1	817966258	JTDKPHLMQSGJRD-SECBINFHSA-N	244.285	1.945	10	20	BDCD	
Cc1ccc([C@@H](C)NC2CNC2)c(O)c1	817956024	NXMPIXVXOFYDTE-SECBINFHSA-N	206.289	1.323	10	20	BDCD	
O=C(NCCc1ncc[nH]1)c1cc(O)cs1	746691164	BNJJQDNIKHHMRR-UHFFFAOYSA-N	237.284	1.149	10	20	BDCD	
C[C@H](O)CN(Cc1ccccc1O)C1CC1	848928620	JCEWOWOPMLVSLJ-JTQLQIEISA-N	221.300	1.737	10	20	BDCD	
CCc1cccc(CN2CCNC(=O)[C@@H]2C)c1O	848886530	WWZUXEDEEYYCMK-JTQLQIEISA-N	248.326	1.275	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C[C@@H]2CCCO2)c1	862760344	PQQZDJHXMVLHEA-LBPRGKRZSA-N	249.310	1.886	10	20	BDCD	
Cc1ccc(CN[C@H]2CCCN(C)C2=O)c(O)c1	877080478	QZXBBVFCKKVZDF-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1=COCC1	778919606	GSHKRMKRJUIZFM-UHFFFAOYSA-N	235.239	1.018	10	20	BDCD	
CNC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1	37253990	KTOWZTVAZJBOAY-JTQLQIEISA-N	235.331	1.149	10	20	BDCD	
CN(C(=O)[C@@H]1[C@@H]2CCC(=O)[C@H]21)c1ccc(N)cc1	1263168846	XZLFUYRACNEVON-KGYLQXTDSA-N	244.294	1.457	10	20	BDCD	
CC(C)[C@H](N)C(=O)NCc1c(O)cccc1F	1341012445	YNYMKPZATNJUFP-NSHDSACASA-N	240.278	1.131	10	20	BDCD	
C[C@H](CNCc1ccc(F)c(F)c1O)C(=O)O	1589066789	QDYMFBPSFQCVQV-ZCFIWIBFSA-N	245.225	1.481	10	20	BDCD	
CO[C@@H]1COC[C@H]1NCc1ccc2c(c1)CCO2	842752727	SRTOTIGARQEDNW-TZMCWYRMSA-N	249.310	1.125	10	20	BDCD	
C[C@@H](NCc1c(O)cccc1Cl)C(=O)O	127313232	IBILXFRRKAXJCW-ZCFIWIBFSA-N	229.663	1.608	10	20	BDCD	
CC[C@H](CO)NCc1ccc(OC)c(C)c1	35052482	QLYMTGCCTHJOGC-GFCCVEGCSA-N	223.316	1.864	10	20	BDCD	
COc1ccc(O)c(CN2CCO[C@@H](C)C2)c1	131950589	ADMZEWQUVKWXCD-JTQLQIEISA-N	237.299	1.622	10	20	BDCD	
C[C@H](NCCCO)c1cc(F)ccc1O	87111337	PFBZQRCQDKDGDM-QMMMGPOBSA-N	213.252	1.564	10	20	BDCD	
Cc1ccc(C(=O)NCc2ccccc2O)n1C	133767036	QNTJSBLFZVGUEX-UHFFFAOYSA-N	244.294	1.969	10	20	BDCD	
C/C=C/C(=O)NCc1cccc(OC)c1O	769499404	ZGVHACVLGVENCU-HWKANZROSA-N	221.256	1.593	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCN(C)C2)c1	862756308	VOIMTTYOYIFHHE-NSHDSACASA-N	248.326	1.269	10	20	BDCD	
CC[C@H](C)N(CCO)Cc1ccccc1O	862386735	BBNILDCQPWUILM-NSHDSACASA-N	223.316	1.985	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@H]2COC[C@H]2C1	872315805	KHLXYAXDBBGNLX-OCAPTIKFSA-N	239.296	1.172	10	20	BDCD	
Nc1ccc(CNC[C@@H]2CCCNC2)cc1	1120268503	GLTNWNCUHJYPLT-GFCCVEGCSA-N	219.332	1.358	10	20	BDCD	
CN(C)c1ccc(CN2C[C@H]3C[C@]3(CO)C2)cc1	783740116	JDLWQTDMQBYNBL-UKRRQHHQSA-N	246.354	1.567	10	20	BDCD	
COc1ccc(CNC(=O)[C@@H](C)OC)c(O)c1	794381331	KXBYSQRIAAJMLF-MRVPVSSYSA-N	239.271	1.052	10	20	BDCD	
COCCCN(C)Cc1ccc(N)cc1	37753920	WNRJRXRVEFQRQG-UHFFFAOYSA-N	208.305	1.737	10	20	BDCD	
Cc1nc[nH]c1CC(=O)Nc1ccc(N)cc1	1579514217	KJPJPXIDCGMFBI-UHFFFAOYSA-N	230.271	1.482	10	20	BDCD	
C[C@H](N)[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	834460319	GMUMQLUXXLRPIH-JQWIXIFHSA-N	247.342	1.007	10	20	BDCD	
C[C@@H](NC[C@@H]1CCN1C)c1cc(F)ccc1O	712596582	VCFOZTXVDYJMFZ-KOLCDFICSA-N	238.306	1.886	10	20	BDCD	
COc1ccc(CNCc2n[nH]cc2C)c(O)c1	716457020	MGBGAMQYZFXMAL-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
C[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	40716634	AELKDPDQQNFMMC-SNVBAGLBSA-N	218.300	1.680	10	20	BDCD	
CCOC(=O)CC(C)(C)CC(=O)C(C)=O	808095832	UZPVSRRPTFXVDR-UHFFFAOYSA-N	214.261	1.514	10	20	BDCD	
CN(C/C=C/c1ccc(N(C)C)cc1)CC(=O)O	901576754	IKQUYYNGHYPDHM-SNAWJCMRSA-N	248.326	1.782	10	20	BDCD	
CC[C@@H]1OCC[C@H]1NC(=O)c1cc(O)cs1	839797166	GMTAVKVNSIWNIF-BDAKNGLRSA-N	241.312	1.751	10	20	BDCD	
C[C@H]1CCN1C(=O)/C=C\c1ccc(O)c(O)c1	914157155	OEQZUFPAQMUVIJ-LVCFMKKZSA-N	233.267	1.732	10	20	BDCD	
C[C@@H](CCNC(=O)c1cc(O)cs1)N(C)C	855417659	MHAGKMSWWQZGSN-QMMMGPOBSA-N	242.344	1.524	10	20	BDCD	
C[C@@H](NC(=O)[C@]1(C)CCOC1)c1ccccc1O	827940494	DQKWIHIRRCQIJM-QMTHXVAHSA-N	249.310	1.996	10	20	BDCD	
C[C@H](O)[C@H]1CCCN1C(=O)c1cc(O)cs1	855869357	MQRACYDTYGWKKN-IONNQARKSA-N	241.312	1.439	10	20	BDCD	
Cc1ccc(CNCc2nncn2C)c(O)c1	876929104	GSIYYOSJVBNHHF-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
COCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1	773010596	CJECYXSIFWJFEL-JTQLQIEISA-N	236.315	1.576	10	20	BDCD	
CCCCNC(=O)c1c(F)ccc(O)c1O	789938315	AMRJNCJAZJTZPQ-UHFFFAOYSA-N	227.235	1.767	10	20	BDCD	
CC[C@](C)(O)CNCc1cc(OC)ccc1O	87011387	FKJUNFJDTYVJOW-ZDUSSCGKSA-N	239.315	1.651	10	20	BDCD	
CCc1cccc(CNCCCN(C)C)c1O	709401799	IPAVMPFWOVKDMH-UHFFFAOYSA-N	236.359	1.996	10	20	BDCD	
CN(Cc1ccccc1O)[C@H]1CCCNC1=O	766884486	AUAQCUNSNUWEAX-NSHDSACASA-N	234.299	1.103	10	20	BDCD	
CN(C(=O)C[C@H]1CCOC1)c1ccc(N)cc1	401383226	PLHOQAFEYCSAIN-SNVBAGLBSA-N	234.299	1.658	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2C[C@]2(C)OC)c1	694345382	FYUKRUDQNQYQRT-OLZOCXBDSA-N	237.299	1.668	10	20	BDCD	
C[C@H](O)C1(NCc2cc(F)ccc2O)CC1	827585166	BDHZIOKTOLIBAN-QMMMGPOBSA-N	225.263	1.534	10	20	BDCD	
CC[C@]1(C(=O)Nc2ccc(N)cc2)CCNC1	119220435	FHFCKUVRBLUXPW-ZDUSSCGKSA-N	233.315	1.597	10	20	BDCD	
CC[C@H](C(N)=O)N1CCCc2cc(CN)ccc21	62801600	VBANGFUKLLZXJX-GFCCVEGCSA-N	247.342	1.162	10	20	BDCD	
COC(=O)CCSc1nccs1	40418586	BMLRRACASRATSU-UHFFFAOYSA-N	203.288	1.798	10	20	BDCD	
COc1cc(O)c(CNCCF)cc1OC	381608636	RSBQNYJPJZTBIU-UHFFFAOYSA-N	229.251	1.469	10	20	BDCD	
COC[C@@H](CO)N[C@@H](C)c1ccccc1O	234892399	VDEGACKVQUGGBT-VHSXEESVSA-N	225.288	1.050	10	20	BDCD	
O=C(NOC1CCC1)c1cc(O)cs1	812792099	LEZOSBSUQJVBFE-UHFFFAOYSA-N	213.258	1.668	10	20	BDCD	
CCN[C@H](C)CNCc1ccccc1O	841066761	VNQQKFZWILFVSD-SNVBAGLBSA-N	208.305	1.480	10	20	BDCD	
C[C@@H](O)C[C@@H](C)NC(=O)c1cc(O)cs1	753469072	YQBULPKECJMYHW-RNFRBKRXSA-N	229.301	1.343	10	20	BDCD	
O=C(NCc1ccccc1O)c1nccs1	770320663	IIEYJBAVFGIDBR-UHFFFAOYSA-N	234.280	1.779	10	20	BDCD	
Cc1cccc(CN2CCc3c[nH]nc3C2)c1O	775712081	DGBSERZVMHKNHX-UHFFFAOYSA-N	243.310	1.982	10	20	BDCD	
CN(c1ccc(N)cc1)C(=O)[C@H]1CC[C@H](N)CC1	877074771	SERKMFQFDYTYRQ-XYPYZODXSA-N	247.342	1.749	10	20	BDCD	
Cc1ocnc1C(=O)N(C)Cc1ccccc1O	104853120	KMWSGNMZUBKWIO-UHFFFAOYSA-N	246.266	1.961	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]2F)cc1	1337079632	CVTGVIOVXORMAT-VXGBXAGGSA-N	236.290	1.727	10	20	BDCD	
C[C@@H](CCCO)NCc1ccccc1O	87358344	XDEPVGPDLNLPRS-JTQLQIEISA-N	209.289	1.643	10	20	BDCD	
CC[C@@H](Sc1ncc(C(=O)O)s1)C(N)=O	1595359038	OPHVYCOBZOFCEG-SCSAIBSYSA-N	246.313	1.197	10	20	BDCD	
Cc1cccc(CN[C@@]2(C)CCOC2)c1O	162715078	SLBMBEVPMVSCRU-ZDUSSCGKSA-N	221.300	1.969	10	20	BDCD	
OC[C@@H]1CC[C@H](NCc2cccc(F)c2O)C1	295087690	REUBNGDFELZEOU-KOLCDFICSA-N	239.290	1.782	10	20	BDCD	
CN(Cc1ccccc1O)CC1OCCO1	182652257	VJWIFPMAMJFONX-UHFFFAOYSA-N	223.272	1.197	10	20	BDCD	
Cn1nccc1CNCc1ccc2c(c1)CCO2	70141506	YLIKUDCGKMIXFZ-UHFFFAOYSA-N	243.310	1.645	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1cccc(C)c1O	295021580	CHKODZXRUSDEQH-LBPRGKRZSA-N	223.316	1.903	10	20	BDCD	
C[C@@H](NC/C=C/CO)c1ccccc1O	717533040	MAJPWVZJDWTZEC-ORAHPGNNSA-N	207.273	1.591	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)[C@@H]1CCCCN1	817957444	MENXUNLKZZBCLJ-WFASDCNBSA-N	247.386	1.932	10	20	BDCD	
CC[C@H](N)CN[C@H](C)c1ccccc1O	817979267	JFSCAKVVELTULP-ZJUUUORDSA-N	208.305	1.780	10	20	BDCD	
CCO[C@H](C)C(=O)NCc1ccc(N)cc1	1122536138	SJGBVSHLTUWAOD-SECBINFHSA-N	222.288	1.310	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](O)C1)c1c(O)cccc1F	886639538	FVEWUDVJLUXPCT-IWSPIJDZSA-N	225.263	1.705	10	20	BDCD	
CNC(=O)CN1CCCc2cc(OC)ccc21	797719947	FMEYHXWEAOBCNC-UHFFFAOYSA-N	234.299	1.194	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H]2CCCC[C@@]2(CO)C1	409435217	SZBRCKWOLJYBGI-QWRGUYRKSA-N	224.308	1.781	10	20	BDCD	
CN(Cc1ccccc1O)CC1CC(O)C1	191159483	SQBJBSFEBFIZMQ-UHFFFAOYSA-N	221.300	1.595	10	20	BDCD	
CCOC(=O)c1cnc(SCC(=O)O)s1	1610024636	GLXFREZBXYSCST-UHFFFAOYSA-N	247.297	1.497	10	20	BDCD	
CC[C@@](C)(O)CNCc1cccc(C)c1O	162826662	LIYTZXCMCSFIPX-CYBMUJFWSA-N	223.316	1.951	10	20	BDCD	
Cc1cccc(CN[C@@H](C)CCO)c1O	162866397	HJNDEJBLOWGZMT-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
CC(C)(F)C(=O)NCc1ccc(N)cc1	309050430	PKVHJXUDUBHDFM-UHFFFAOYSA-N	210.252	1.633	10	20	BDCD	
Oc1cccc(Cl)c1CN=c1cncc[nH]1	381561974	RQYOJQZJGWPQSK-UHFFFAOYSA-N	235.674	1.870	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCOC1)c1ccccc1O	827930924	VDBFIHDLKUTRPS-ZJUUUORDSA-N	235.283	1.606	10	20	BDCD	
C[C@H](O)C(=O)NCCCSc1nccs1	305739326	ZJZCIAYHOLFZHB-ZETCQYMHSA-N	246.357	1.122	10	20	BDCD	
Cc1cccc(CN2CCn3cnnc3C2)c1O	124594574	CRVSAHYTCGRTSE-UHFFFAOYSA-N	244.298	1.308	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)C[C@]1(C)CO	827700458	UKCZMKMPXNKFOI-BXUZGUMPSA-N	235.327	1.843	10	20	BDCD	
O=C(Nc1nncs1)c1cc(O)cs1	731867090	FAKQPEOPTBCJBK-UHFFFAOYSA-N	227.270	1.558	10	20	BDCD	
Oc1ccc(Cl)cc1CNC[C@@H]1CCCN1	841036716	WGRBEZAYUHWODN-NSHDSACASA-N	240.734	1.887	10	20	BDCD	
COc1ccc(O)c(CNC(=N)NC2CCC2)c1	849009067	YFKKONHXIPFOKG-UHFFFAOYSA-N	249.314	1.567	10	20	BDCD	
Cn1ccnc(Sc2nccs2)c1=O	742254663	IWOCDXKLCLLGRX-UHFFFAOYSA-N	225.298	1.388	10	20	BDCD	
CC(C)NCC(=O)Nc1ccc(N)cc1	851633689	QCUHBDXELYPHMN-UHFFFAOYSA-N	207.277	1.205	10	20	BDCD	
C[C@]1(C(=O)Nc2ccc(N)cc2)CCOC1	687360617	JBCLRUCRHOPVDS-LBPRGKRZSA-N	220.272	1.634	10	20	BDCD	
CN(CC(C)(C)CO)C(=O)c1cc(O)cs1	854746988	KOLJGBUQEZBFCM-UHFFFAOYSA-N	243.328	1.544	10	20	BDCD	
CC(C)[C@@H](O)CNC(=O)c1cc(O)cs1	771051823	BQMFTIFCMGTJCX-QMMMGPOBSA-N	229.301	1.200	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](C)[C@@H]2CO)c(O)c1	877464002	IETOMNYOXFVPCQ-YPMHNXCESA-N	235.327	1.903	10	20	BDCD	
CCOc1ccc(CN[C@@H](CC)CO)c(O)c1	780583164	MNRFDQQMCPHSEJ-NSHDSACASA-N	239.315	1.651	10	20	BDCD	
COC(CSc1ncc(C(=O)O)s1)OC	1610231814	OHKBHJGCYUXYCI-UHFFFAOYSA-N	249.313	1.552	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@@H](C(N)=O)C2)c1	155011228	SWVLMMBNWLNLHU-LLVKDONJSA-N	248.326	1.398	10	20	BDCD	
O=C(O)CCSc1ncc([N+](=O)[O-])s1	226765859	IMFNXQSAGSYMMS-UHFFFAOYSA-N	234.258	1.618	10	20	BDCD	
CC(C)[C@H]1C(=O)NCCN1Cc1ccccc1O	179569834	LVEWURSJBJWBFU-ZDUSSCGKSA-N	248.326	1.349	10	20	BDCD	
COc1cccc(CNC(=O)c2cc[nH]c2)c1O	111597777	IWWXUQSZZZQNAT-UHFFFAOYSA-N	246.266	1.659	10	20	BDCD	
C[C@H](O)CCNCc1ccc(N(C)C)cc1	78781963	CAJXPPQLMNJJOA-NSHDSACASA-N	222.332	1.613	10	20	BDCD	
C[C@H](NCC(=O)N(C)C)c1ccc(N(C)C)cc1	37254253	CFZQIFYCVROCGY-NSHDSACASA-N	249.358	1.491	10	20	BDCD	
CCNCC(=O)N(C)Cc1ccc(N(C)C)cc1	44290859	CJEQMCFWKBVUIX-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
COC(=O)CN(C)c1ccc(OC)c(Cl)c1	82713201	OGKQYMCYCUUQKW-UHFFFAOYSA-N	243.690	1.958	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CC23CCNCC3)cc1	238000167	WXRPEZBWVBXEAW-GFCCVEGCSA-N	245.326	1.597	10	20	BDCD	
CCC[C@H](N)C(=O)NCCc1ccc(N)cc1	262465460	XRJDECQNEPDFMS-LBPRGKRZSA-N	235.331	1.055	10	20	BDCD	
C[C@@H]1C[C@@H]1CNC(=O)NCc1ccccc1O	299495913	KRHDJKHXJSSWTK-MWLCHTKSSA-N	234.299	1.847	10	20	BDCD	
C[C@@H](N[C@H]1CCCNC1)c1cc(F)ccc1O	817940478	ICLBGZVTQSBFHF-KOLCDFICSA-N	238.306	1.934	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@H]2CCNC2)cc1C	843049587	RQOVUHLAWGIXCM-ZDUSSCGKSA-N	234.343	1.803	10	20	BDCD	
CCNC(=O)[C@@H](C)NCc1ccc(C)cc1O	877141573	AGVXUXTVNBZYSM-SNVBAGLBSA-N	236.315	1.315	10	20	BDCD	
N[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1	1236170306	UUJXPSPKVHJRJU-CQSZACIVSA-N	245.370	1.820	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)N(C)c2ccc(N)cc2)CCN1	1354436636	MOELXNLLIGOYLQ-GHMZBOCLSA-N	247.342	1.620	10	20	BDCD	
COC(=O)[C@H](C)Sc1ncc(C(=O)O)s1	1598693114	SHGQZXHZWNOHDF-BYPYZUCNSA-N	247.297	1.495	10	20	BDCD	
C[C@@H](NC[C@@H](O)C(F)(F)F)c1ccccc1O	228791588	MJQPSMBSCAOCDA-GMSGAONNSA-N	249.232	1.966	10	20	BDCD	
COc1ccc(N(C)C[C@H](C)N)cc1OC	20239527	MFZJCCQHUWCDMR-VIFPVBQESA-N	224.304	1.487	10	20	BDCD	
CC(=O)NCc1cccc(Br)c1O	307212389	VOEQVZKPLLQZET-UHFFFAOYSA-N	244.088	1.791	10	20	BDCD	
CC[C@@H](N[C@H](C)CC(N)=O)c1ccccc1O	136101042	XFJLXWAYNKYDFC-MWLCHTKSSA-N	236.315	1.697	10	20	BDCD	
CCO[C@H]1C[C@@H](NC(=O)c2cc(O)cs2)C1	839799280	LUPQECZFBYGEGZ-OTSSQURYSA-N	241.312	1.751	10	20	BDCD	
C[C@@H]1COCCCN1C(=O)c1cc(O)cs1	746301237	KAFYQAASYYQIDV-MRVPVSSYSA-N	241.312	1.705	10	20	BDCD	
CC1(C)CNCCN1Cc1cccc(F)c1O	843054472	NCLMVNRNHIEOOW-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
CCn1[nH]c(C)nc1=NCc1cc(C)ccc1O	840886883	BXYXCCJQRPLVGS-UHFFFAOYSA-N	246.314	1.654	10	20	BDCD	
C[C@H]1CCN[C@@H](C(=O)Nc2ccc(N)cc2)C1	841846483	OYXOIHZAAPBHGV-JOYOIKCWSA-N	233.315	1.595	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCCOC2)c1	862758566	CZEPCBKFIPNCDV-LLVKDONJSA-N	249.310	1.743	10	20	BDCD	
Cc1cccc(O)c1CNCCCOCCO	877186431	OBNAHKSIYVWYHR-UHFFFAOYSA-N	239.315	1.189	10	20	BDCD	
C/C=C(/C)C(=O)NCc1ccc(OC)cc1O	794381724	SGWBOFNGNOUERN-WTKPLQERSA-N	235.283	1.983	10	20	BDCD	
COC(CN[C@H](C)c1ccccc1O)OC	37473016	RMUVODFMUWQKCZ-SECBINFHSA-N	225.288	1.662	10	20	BDCD	
C[C@H]1[C@@H](CO)CCN1C(=O)Cc1ccc(N)cc1	385964774	ZIXICMMDTUAGQM-CMPLNLGQSA-N	248.326	1.041	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)[C@H]1CCCN1	817958524	WPLYWENEEABAMI-SMDDNHRTSA-N	233.359	1.541	10	20	BDCD	
CC[C@@H](O)CNCc1ccc(N(C)C)c(F)c1	817709290	OJXLJFPCPMIEGK-LLVKDONJSA-N	240.322	1.752	10	20	BDCD	
CC(C)OCCCNC(=O)c1cc(O)cs1	731871747	MDAWKVHZBXUPMJ-UHFFFAOYSA-N	243.328	1.999	10	20	BDCD	
C[C@@H](CCCCO)NC(=O)c1cc(O)cs1	833696485	URIBLFBIPMIOFY-QMMMGPOBSA-N	243.328	1.735	10	20	BDCD	
CNC[C@@H](C)N[C@H](C)c1ccccc1O	854230944	CDAHMAHFXOIJMU-NXEZZACHSA-N	208.305	1.651	10	20	BDCD	
C[C@@H](NCCN1CCC1)c1ccc(F)cc1O	697393452	DWSPUNVDDRSELO-SNVBAGLBSA-N	238.306	1.888	10	20	BDCD	
CC(=O)N1CCN(Cc2ccc(C)cc2O)CC1	876526352	XYCHOGCKRPBNNE-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1O	897684642	UKYCONJMBNVKLS-PRHODGIISA-N	241.718	1.858	10	20	BDCD	
CCCS(=O)(=O)N(C)Cc1ccccc1O	77898249	DWFRAQKAFLYYFA-UHFFFAOYSA-N	243.328	1.564	10	20	BDCD	
Nc1ccc(CN2CCC3(CCNCC3)C2)cc1	1334774448	HYQYEUWZVULDIL-UHFFFAOYSA-N	245.370	1.844	10	20	BDCD	
C[C@@H]1CNC[C@H]1NCc1ccc(Cl)cc1O	1579467399	CAMXUKNYMZAMQT-LDYMZIIASA-N	240.734	1.743	10	20	BDCD	
CC[C@H](O)CCNCc1cc(F)cc(F)c1O	708487590	ZEXHMHADTWTGMR-JTQLQIEISA-N	245.269	1.921	10	20	BDCD	
CCc1cccc(CNCCCC(=O)O)c1O	691508658	GQMIVFVMZXJLJR-UHFFFAOYSA-N	237.299	1.909	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](O)C1)c1ccccc1O	850578799	NZAITOBZQDNQSU-OPRDCNLKSA-N	207.273	1.566	10	20	BDCD	
O=C(c1cccc(O)c1O)N1C[C@H]2C=C[C@H]1C2	882424380	IKIHVUNRBMOWEW-IUCAKERBSA-N	231.251	1.498	10	20	BDCD	
CCN(CCCO)Cc1ccccc1O	272263878	KLPKMGIWQQCBTA-UHFFFAOYSA-N	209.289	1.597	10	20	BDCD	
C[C@@H]1C[C@H](O)CN(Cc2ccc(N(C)C)cc2)C1	825312430	SSSQVFRFYMATSD-DOMZBBRYSA-N	248.370	1.955	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1CSC1	910945779	YMEKYAARMOKKHG-UHFFFAOYSA-N	239.296	1.077	10	20	BDCD	
CNC[C@H](C)NCc1cccc(Cl)c1O	853248281	CVACAEBEKNKVHV-QMMMGPOBSA-N	228.723	1.743	10	20	BDCD	
COCCC(=O)NCc1cc(C)ccc1O	862758829	MZVMTBADMGSCBD-UHFFFAOYSA-N	223.272	1.353	10	20	BDCD	
CCCOc1ccc(CNCC(=O)O)cc1C	1119000568	GVGIGZVMENIEJT-UHFFFAOYSA-N	237.299	1.958	10	20	BDCD	
C[C@@H](O)COC(=O)/C=C/c1ccc(O)c(O)c1	792039750	GEIBBGKKKXKFEQ-RYEJSQLPSA-N	238.239	1.035	10	20	BDCD	
Cc1cc(CN(C)c2ccc(N)cc2)nn1C	688110017	GCIGDPBOHNVMRC-UHFFFAOYSA-N	230.315	1.947	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1CC[C@H](F)C1	1330677477	RATXISXVACZBES-LURJTMIESA-N	243.209	1.421	10	20	BDCD	
COc1cccc(O)c1CNCC1=CCCOC1	808429425	BTICPMDNZVWBKI-UHFFFAOYSA-N	249.310	1.837	10	20	BDCD	
O=C(NCc1ccccc1O)c1ncc[nH]1	857472752	YZJPWXSQARWCRO-UHFFFAOYSA-N	217.228	1.045	10	20	BDCD	
C[C@@H](N)[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	834460321	GMUMQLUXXLRPIH-ZYHUDNBSSA-N	247.342	1.007	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCCOC1	171295320	XMODJRCTVJBZII-GFCCVEGCSA-N	249.310	1.777	10	20	BDCD	
C[C@@H]1COC[C@H]1NCc1cc(F)cc(F)c1O	708534684	DDCHXPKUZGARAF-RDDDGLTNSA-N	243.253	1.795	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](O)C1)c1ccccc1O	850578798	NZAITOBZQDNQSU-GUBZILKMSA-N	207.273	1.566	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2cc[nH]c2)c1	114543462	WESYSOTTXVNLMC-UHFFFAOYSA-N	246.266	1.659	10	20	BDCD	
CNC(=O)COc1ccc(N2CCCC2)cc1	178192455	JTBXQTZUEYDYRV-UHFFFAOYSA-N	234.299	1.412	10	20	BDCD	
COCCOCCNCc1cccc(C)c1O	124736076	ZYJTVZSPFVEPRT-UHFFFAOYSA-N	239.315	1.453	10	20	BDCD	
CCOC(=O)CN(C)Cc1ccc(N)cc1	35360385	PKDYOKKJAIBJNK-UHFFFAOYSA-N	222.288	1.264	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](O)C2CC2)c1	70955758	LRJGPPAHFIMQHK-ZDUSSCGKSA-N	221.300	1.561	10	20	BDCD	
CCC[C@@](C)(N)C(=O)NCCc1ccc(N)cc1	262568222	AKRXHGNAMVFCBI-CQSZACIVSA-N	249.358	1.445	10	20	BDCD	
C[C@@H](CN)N[C@H](C)c1ccc(F)cc1O	817969607	FADKZQPUNAYFNI-JGVFFNPUSA-N	212.268	1.529	10	20	BDCD	
O=C1NCC[C@@H]1CCSc1nccs1	821078417	QFZNEUBRVKYKSS-SSDOTTSWSA-N	228.342	1.761	10	20	BDCD	
CC1(NCc2cccc(F)c2O)CCNCC1	841065900	UVQZBUWRHKPAST-UHFFFAOYSA-N	238.306	1.763	10	20	BDCD	
CCN(CCN)Cc1ccc(N(C)C)c(F)c1	863645402	VSHHLODOUUABNL-UHFFFAOYSA-N	239.338	1.672	10	20	BDCD	
Cc1ncsc1/C=C\C(=O)N(C)c1cn[nH]c1	777261650	JTAXPXHLPHWCON-ARJAWSKDSA-N	248.311	1.851	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1CC[C@H](O)C1	877468775	MPXKOIGQVHSBHJ-RYUDHWBXSA-N	235.327	1.951	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](N)[C@H](C)C2)c1	94338775	OAVBSIDBEVAXJY-YPMHNXCESA-N	234.343	1.870	10	20	BDCD	
N[C@@H](C(=O)O)c1cc(Br)ccc1O	96880013	OPOLGUBWDNLGTE-SSDOTTSWSA-N	246.060	1.239	10	20	BDCD	
COC(=O)[C@@H](NCc1cccc(C)c1O)C1CC1	276458868	KYZKXIGVPCPNFL-LBPRGKRZSA-N	249.310	1.742	10	20	BDCD	
CN[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1	708483048	ZILBHOGEDDHQLR-JTQLQIEISA-N	242.269	1.464	10	20	BDCD	
COc1cccc(O)c1CN[C@H](C)C[C@H](C)O	782977468	FXFSVXNQGGFYMZ-ZJUUUORDSA-N	239.315	1.650	10	20	BDCD	
CCOc1ccc(N(C)CCOCCO)cc1	304282723	KSRXQOHZHJLPNR-UHFFFAOYSA-N	239.315	1.530	10	20	BDCD	
Oc1c(Cl)cccc1CNCCN1CCC1	309544439	ZDDCASFARUDLED-UHFFFAOYSA-N	240.734	1.841	10	20	BDCD	
Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCO	20596941	HWDQENKAAFHSPS-NXEZZACHSA-N	221.300	1.831	10	20	BDCD	
O=C1NC(=S)S/C1=C/c1csnn1	306569343	KWJSSECCMFFQRW-DAFODLJHSA-N	229.311	1.027	10	20	BDCD	
COCC(C)(C)NC(=O)c1cccc(O)c1O	126544812	TZQQRNVWADSMBJ-UHFFFAOYSA-N	239.271	1.253	10	20	BDCD	
NCC1CCN(Cc2ccccc2O)CC1	44512001	VOGOVNGMBQWIQO-UHFFFAOYSA-N	220.316	1.563	10	20	BDCD	
CCn1cnnc1NC(=O)c1cc(O)cs1	807518371	HIHJVYQCGWXSMX-UHFFFAOYSA-N	238.272	1.317	10	20	BDCD	
COc1ccc(CNCCCON)cc1C	904456460	IYNQXOAUVIJIHK-UHFFFAOYSA-N	224.304	1.374	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](C)CC(N)=O)cc1C	746474459	CQUXXETXBDXTJC-JTQLQIEISA-N	236.315	1.363	10	20	BDCD	
COc1ccc(N(C)CC2OCCO2)cc1	844353390	VMXBSAWCFWGXME-UHFFFAOYSA-N	223.272	1.504	10	20	BDCD	
CC[C@@H](NCc1c(C)cccc1O)[C@@H](C)O	877569079	ZJOJPWFWQPXVHP-ZYHUDNBSSA-N	223.316	1.950	10	20	BDCD	
CCOC[C@@H]1CN(CCN=[N+]=[N-])C[C@@H]1C	409429899	HYUXHBQDFBDADH-UWVGGRQHSA-N	212.297	1.901	10	20	BDCD	
CN(Cc1ccc(N)cc1)[C@@H]1CCCCNC1=O	35063956	NVOHIIIKSSAHNG-CYBMUJFWSA-N	247.342	1.369	10	20	BDCD	
CSC[C@@](C)(O)CNCc1ccccc1O	164251477	YFHDZERKQZBVSB-LBPRGKRZSA-N	241.356	1.596	10	20	BDCD	
O=C(NCc1cccnc1)c1cccc(O)c1O	126238390	LCKIRPUDFJAYHX-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CCSC2)c1	129581187	PCTFCNKQJXZWKW-JTQLQIEISA-N	239.340	1.996	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)c1ccnn1C	817956820	DNEULFXMYJIDND-LLVKDONJSA-N	244.342	1.896	10	20	BDCD	
C[C@@H](NCC1=CCNCC1)c1ccccc1O	817968714	WKXBEEHBMVVBSQ-LLVKDONJSA-N	232.327	1.963	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)Nc1cn[nH]c1	588406275	CMMJPTBYBGRQGU-RQOWECAXSA-N	245.238	1.473	10	20	BDCD	
C[C@@H](C[C@H]1CCCN1)NCCc1ccc(N)cc1	841038788	QGVHRWDNFPEQEM-SWLSCSKDSA-N	247.386	1.932	10	20	BDCD	
C[C@H](N)CN(C)Cc1c(O)ccc(Cl)c1F	863651143	BJIUVNWWRAICPX-ZETCQYMHSA-N	246.713	1.964	10	20	BDCD	
C[C@@H]1NCC[C@H]1C(=O)N[C@H](C)c1ccccc1O	870988330	MTASIQKVRWDBFL-HOSYDEDBSA-N	248.326	1.567	10	20	BDCD	
CC[C@H](O)CCNC(=O)c1cc(O)cs1	772475200	BOFBUAHWXBUQJD-ZETCQYMHSA-N	229.301	1.345	10	20	BDCD	
CC[C@@H](O)CCNC(=O)c1cc(O)cs1	772475199	BOFBUAHWXBUQJD-SSDOTTSWSA-N	229.301	1.345	10	20	BDCD	
COc1cccc(CN[C@H](C)CCCO)c1O	94942277	FYYHIWWCFFITPV-SNVBAGLBSA-N	239.315	1.651	10	20	BDCD	
CC(C)N(C)C(=O)Cc1ccc(N)cc1	22177243	HTNLMDUSSZASFH-UHFFFAOYSA-N	206.289	1.678	10	20	BDCD	
N[C@@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2	259024263	OGXBHZJNOYARLE-OLZOCXBDSA-N	232.327	1.591	10	20	BDCD	
CN[C@H]1CCN(Cc2c(O)cccc2OC)C1	843045233	QHEBEENYHXYDPA-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC(F)CC1	689834936	DIWLMKFJKFMCLB-UHFFFAOYSA-N	239.246	1.672	10	20	BDCD	
Cc1ccc(O)c(CNCCCn2cncn2)c1	381799942	PPOOUZKLCMYMIZ-UHFFFAOYSA-N	246.314	1.472	10	20	BDCD	
Cc1cccc(CNC2([C@@H](C)O)CC2)c1O	827585747	PIWFACRTXZLLHW-SNVBAGLBSA-N	221.300	1.704	10	20	BDCD	
CO[C@H](C(=O)NCc1ccccc1O)C(C)C	771416397	GHCAFLTZJRRDGY-LBPRGKRZSA-N	237.299	1.679	10	20	BDCD	
CCCN(CCO)Cc1cc(F)ccc1O	179885275	PWUKESANNDEQHU-UHFFFAOYSA-N	227.279	1.736	10	20	BDCD	
CCOC[C@H](O)CNc1ccccc1OC	68950351	NEZPSUUUBWTHDG-SNVBAGLBSA-N	225.288	1.505	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@@H](N)C1CC1	123859912	HQYYEGYORJWPDJ-GFCCVEGCSA-N	248.326	1.478	10	20	BDCD	
O=C(O)[C@@H]1CCN(Cc2cc(F)ccc2O)C1	236433446	DJBWHEYXYXCGFM-MRVPVSSYSA-N	239.246	1.438	10	20	BDCD	
Nc1ccc(CCNC(=O)/C=C/C2CC2)cc1	269146042	FKNFXKCHRFTVQF-VMPITWQZSA-N	230.311	1.894	10	20	BDCD	
CC[C@H](C)NC(=O)c1c(F)ccc(O)c1O	276782994	ZRUNTPNMZPRFCF-LURJTMIESA-N	227.235	1.765	10	20	BDCD	
CN(C)c1ccc(CNc2ncn(C)n2)cc1F	292358414	FROCWYPKJSDYDA-UHFFFAOYSA-N	249.293	1.632	10	20	BDCD	
CCOc1cccc(CNCC2(N)CC2)c1O	904449729	KMVMTNVGXKJIEF-UHFFFAOYSA-N	236.315	1.372	10	20	BDCD	
C/C=C\C[C@@H](CO)NC(=O)c1cc(O)cs1	771742215	BJQNXRDKYYSTNT-KZUAUGPASA-N	241.312	1.511	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1C[C@@H](O)C1(C)C	877430385	HHFMRSIEBWHOAI-QWHCGFSZSA-N	235.327	1.950	10	20	BDCD	
COC(=O)[C@@H](C)N(C)Cc1c(C)cccc1O	877490820	JEEOZVBWLSUJFG-SNVBAGLBSA-N	237.299	1.694	10	20	BDCD	
CC[C@@H](CCO)NCc1ccccc1O	77453138	BKRSPJAPGICHIO-NSHDSACASA-N	209.289	1.643	10	20	BDCD	
C[C@H](CC(=O)O)NCc1ccc2c(c1)CCO2	738892960	XRYVEQUCTXCGEV-SECBINFHSA-N	235.283	1.574	10	20	BDCD	
Oc1ccc(F)cc1CNCCOCCF	702637559	GHZHCSUMMSJBCC-UHFFFAOYSA-N	231.242	1.607	10	20	BDCD	
C[C@@]1(NCc2ccc(F)c(F)c2O)CCNC1	1576545878	TYQJBYUVDUTREV-GFCCVEGCSA-N	242.269	1.512	10	20	BDCD	
Nc1ccc(CC(=O)Nc2nncs2)cc1	19811883	YZHCLNDIMUWAKQ-UHFFFAOYSA-N	234.284	1.302	10	20	BDCD	
C[C@@H](N[C@@H]1CCCNC1)c1ccccc1O	817939744	BMYSOVIDKKVCGA-GHMZBOCLSA-N	220.316	1.795	10	20	BDCD	
c1cc2c(cc1CN[C@H]1CCCNCC1)CCO2	841057764	NHCPCPPTTLVKSU-AWEZNQCLSA-N	246.354	1.853	10	20	BDCD	
C[C@H](NC[C@H]1CCN1C)c1cc(F)ccc1O	712596579	VCFOZTXVDYJMFZ-GXSJLCMTSA-N	238.306	1.886	10	20	BDCD	
CC[C@H](CO)N[C@H](C)c1ccccc1O	20194911	PFCWRTFIVYPSDM-NXEZZACHSA-N	209.289	1.814	10	20	BDCD	
C[C@@H](NCCC(=O)N(C)C)c1ccccc1O	37751512	ZCSNYMUAZPIYKV-SNVBAGLBSA-N	236.315	1.521	10	20	BDCD	
C[C@@H]1COCCN1Cc1ccccc1O	132606062	FZSHPGJTTXUXRF-SNVBAGLBSA-N	207.273	1.613	10	20	BDCD	
CO[C@@H](C)CS(=O)(=O)Nc1ccc(O)cc1	193109329	MLZBXMDSSQZKGQ-QMMMGPOBSA-N	245.300	1.169	10	20	BDCD	
CN(C)C(=O)N(C)Cc1ccc(N(C)C)cc1	194467217	XPWPFDVNHSRXFX-UHFFFAOYSA-N	235.331	1.866	10	20	BDCD	
CCc1cccc(CN2CCC[C@@H]2C(N)=O)c1O	848915615	KNJFUGRVAFCGPP-GFCCVEGCSA-N	248.326	1.404	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C(C)(C)O)c1	862757020	DFRUUVOSBUWAPD-UHFFFAOYSA-N	223.272	1.088	10	20	BDCD	
Cc1cccc(O)c1CNCCC[S@@](C)=O	877052459	XGFJEHVABHLVGG-MRXNPFEDSA-N	241.356	1.559	10	20	BDCD	
O=C(O)C1=CC[C@H](NCc2ccccc2O)C1	1332423112	KSXDXJRRAOJZEV-NSHDSACASA-N	233.267	1.655	10	20	BDCD	
CC(=O)NCCCN[C@@H]1CCc2cccc(O)c21	296143997	WJNXUPUFHKIXHL-GFCCVEGCSA-N	248.326	1.495	10	20	BDCD	
Nc1ccc(CN2CCC3(C2)OCCO3)cc1	307279612	XKZFOSKNTPOVDX-UHFFFAOYSA-N	234.299	1.218	10	20	BDCD	
CCOc1cccc(CN(C)CCO)c1O	77010017	WWVKJEWHTZFWNX-UHFFFAOYSA-N	225.288	1.215	10	20	BDCD	
COC[C@@H](C)NCc1cccc(C)c1O	83345897	NFDFIWVXUNPMLF-SNVBAGLBSA-N	209.289	1.825	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H](CO)C2)cc1	92762964	MKXNAWXBSGRZGY-CYBMUJFWSA-N	234.343	1.567	10	20	BDCD	
CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CC1	808095272	XCDBBAJQSJJQFP-UHFFFAOYSA-N	240.299	1.904	10	20	BDCD	
C[C@@H](NC1CNC1)c1ccc(F)cc1O	817956026	OBQKONCWIIOISV-SSDOTTSWSA-N	210.252	1.154	10	20	BDCD	
C[C@@H](NCCNC1CC1)c1cc(F)ccc1O	817953732	PVMPJCCFRHRYOU-SECBINFHSA-N	238.306	1.934	10	20	BDCD	
CNC(=S)N[C@H](C)c1cc(OC)ccc1O	728792926	MRDHIERWUOGPFS-SSDOTTSWSA-N	240.328	1.556	10	20	BDCD	
C[C@@H](NC[C@H]1CCN1C)c1c(O)cccc1F	903316346	OCHASULLHVTJEC-NXEZZACHSA-N	238.306	1.886	10	20	BDCD	
CC1(NCc2ccc3c(c2)CCO3)CCNCC1	841065062	MBAAPOLWJLAQHD-UHFFFAOYSA-N	246.354	1.853	10	20	BDCD	
Oc1ccccc1CN1CC[C@@]2(CCCN2)C1	841105312	KFFISEFLZSBNEY-AWEZNQCLSA-N	232.327	1.720	10	20	BDCD	
Cc1cc(CN(C)C[C@H](C)N)ccc1N(C)C	923409344	PDAREGAXOFKARK-LBPRGKRZSA-N	235.375	1.840	10	20	BDCD	
CC[C@H](O)CCNCc1c(C)cccc1O	877110678	CBEWFSCBSKIHJN-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
CCN(C)c1ccc(CN(C)C[C@@H](C)O)cc1	773751614	FWYJZVGZQNOHIQ-GFCCVEGCSA-N	236.359	1.955	10	20	BDCD	
C[C@@H](CCCO)NC(=O)Cc1ccc(N)cc1	94940894	LWZIOYFFASHKSW-JTQLQIEISA-N	236.315	1.089	10	20	BDCD	
COC[C@@]12CCC[C@@H]1CN(C(=O)CN=[N+]=[N-])C2	409431722	KCZVZWBVKXXFME-KOLCDFICSA-N	238.291	1.572	10	20	BDCD	
CC[C@H](CO)NCc1cc(F)cc(F)c1O	708394191	RNOKAFISHOBQLC-SECBINFHSA-N	231.242	1.531	10	20	BDCD	
Oc1cccc(Cl)c1CNC[C@H]1C[C@H](O)C1	720907434	NARDPSAOOKWXQY-KYZUINATSA-N	241.718	1.906	10	20	BDCD	
CCCCOCC(=O)NCc1ccc(N)cc1	837303038	RBNNMRZKTFKRIE-UHFFFAOYSA-N	236.315	1.702	10	20	BDCD	
O=C(O)CCCOC(=O)c1cccc(O)c1O	1595053008	RVQWWCPQJXOMIW-UHFFFAOYSA-N	240.211	1.119	10	20	BDCD	
CCOc1cccc(CN[C@@H](C)COC)c1O	19904643	HDZXXOYPISHPSE-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
CC(C)N(C)CCNCc1ccccc1O	54110773	AFCKYMHMRQRGTP-UHFFFAOYSA-N	222.332	1.822	10	20	BDCD	
CSCCC(=O)NCCc1ccc(N)cc1	63129868	GKBPQBGFGYIQPJ-UHFFFAOYSA-N	238.356	1.681	10	20	BDCD	
COCc1nc(CSc2nccs2)no1	182711329	SJJLXLZMOJKUAH-UHFFFAOYSA-N	243.313	1.965	10	20	BDCD	
OCCCNCc1ccc2c(c1)CCO2	37362898	DDKPUGYUTXHMST-UHFFFAOYSA-N	207.273	1.094	10	20	BDCD	
CCC1CN(C(=O)c2cc(O)cs2)C1	839790964	HPBYQGZJMXOWHZ-UHFFFAOYSA-N	211.286	1.936	10	20	BDCD	
Oc1ccccc1CN1CC(OC(F)F)C1	839145578	UMPRYHUWHDDWPY-UHFFFAOYSA-N	229.226	1.816	10	20	BDCD	
CCOC(=O)CN(C)Cc1ccc(C)cc1O	876565449	JHDPZVQTDSWADQ-UHFFFAOYSA-N	237.299	1.696	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H]1CC[C@H](O)C1	877468773	MPXKOIGQVHSBHJ-NEPJUHHUSA-N	235.327	1.951	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](CO)CCF	877614629	KCMKEEZAAMXFPB-SNVBAGLBSA-N	227.279	1.511	10	20	BDCD	
Oc1ccc(CCNc2ncc(F)cn2)cc1O	301752572	BNUMUCAVRAIONX-UHFFFAOYSA-N	249.245	1.682	10	20	BDCD	
O=C(O)CC1CC(NCc2ccccc2O)C1	1601947080	SFYFFKRPHJJNJF-UHFFFAOYSA-N	235.283	1.735	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](C)CC(=O)O)cc1C	1611157964	IKPNOKFGGUEPDV-JTQLQIEISA-N	237.299	1.962	10	20	BDCD	
N[C@@H]1CCC[C@H](C(=O)NCc2ccccc2O)C1	168403737	XELJMMZJNPWMJB-CMPLNLGQSA-N	248.326	1.526	10	20	BDCD	
CC(C)(CCO)NCc1cc(F)ccc1O	180741103	CFBGMSHGDPLJGD-UHFFFAOYSA-N	227.279	1.782	10	20	BDCD	
CN(Cc1ccccc1O)[C@H]1CCNC1	70892624	WQVZDDGVZPLPNI-NSHDSACASA-N	206.289	1.186	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NC1CCC1	272539852	XSKXETGSHUTMFM-FNORWQNLSA-N	233.267	1.780	10	20	BDCD	
Oc1cc(F)c(Cl)cc1CN1CC[C@@H](O)C1	816484229	UXMNPYLQZSJAFU-MRVPVSSYSA-N	245.681	1.751	10	20	BDCD	
CCC(F)(F)C(=O)NCc1ccc(O)cc1O	910942599	FXVPJCMUUAGQLQ-UHFFFAOYSA-N	245.225	1.759	10	20	BDCD	
Cc1ccc(O)c(CNC2CCNCC2)c1	841026551	ICTRLIMHLWPVPX-UHFFFAOYSA-N	220.316	1.542	10	20	BDCD	
Oc1cc2c(cc1CN1CC[C@H]3C[C@H]3C1)OCO2	853581668	WXJYUGCPYSAQGL-UWVGGRQHSA-N	247.294	1.963	10	20	BDCD	
CN[C@@H]1CCN(Cc2ccc(N(C)C)c(C)c2)C1	923278372	SFSAKVRBBOXYEP-CQSZACIVSA-N	247.386	1.855	10	20	BDCD	
CO[C@H]1C[C@H](NCc2c(C)cccc2O)C1	877660965	UBEXLRSQPFPGGV-XYPYZODXSA-N	221.300	1.968	10	20	BDCD	
O=C(CCCF)NCc1cccc(O)c1O	1123889918	RAICMFXMHQFAJH-UHFFFAOYSA-N	227.235	1.464	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)C[C@H]1N	1206070438	JNMXAFYMUXFCPY-BXKDBHETSA-N	205.305	1.048	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccccc2)C1	409424441	VDBWAWHDUGKNPM-UHFFFAOYSA-N	202.217	1.821	10	20	BDCD	
[N-]=[N+]=NCCn1nc(-c2ccncc2)cc1O	409436878	BVRNUYBMWAOCKD-UHFFFAOYSA-N	230.231	1.961	10	20	BDCD	
CC[C@@H](CO)NCc1cc(F)cc(F)c1O	708394192	RNOKAFISHOBQLC-VIFPVBQESA-N	231.242	1.531	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1C[C@@H](O)C1	720958342	YBLFTQAIQBTAMX-DKTWLAJQSA-N	225.263	1.392	10	20	BDCD	
C[C@@H](NCC[C@@H]1CCNC1=O)c1ccccc1O	879649582	WQGJEXYYLWNLPU-GHMZBOCLSA-N	248.326	1.569	10	20	BDCD	
CCNC(=O)CNCc1cccc(Cl)c1O	163727482	LHVUFGHVFGCOSH-UHFFFAOYSA-N	242.706	1.271	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CCCNC2=O)c1O	839196147	SBGGEMQGCIFMSM-LBPRGKRZSA-N	248.326	1.316	10	20	BDCD	
C[C@H](N[C@H](C)CO)c1cc(F)ccc1O	87111364	KYKZMGFKYQAOSP-SFYZADRCSA-N	213.252	1.563	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H]1O	271353986	QACQIIMMPJLHIZ-HIFRSBDPSA-N	248.370	1.955	10	20	BDCD	
OC/C=C\CNCc1cccc(Cl)c1O	717534704	SAJPKSZYWCQOBL-UPHRSURJSA-N	227.691	1.684	10	20	BDCD	
COCCCNCc1cc2c(cc1O)OCO2	42879509	ODXMGWSUKLTQNT-UHFFFAOYSA-N	239.271	1.247	10	20	BDCD	
Nc1ccc(CNC(=O)N2CC=CCC2)cc1	1335726391	QRMSUBXKNYGWJC-UHFFFAOYSA-N	231.299	1.740	10	20	BDCD	
CN(Cc1ccc(N)cc1)CC(F)F	37756115	WMTGNGRWRPXNMZ-UHFFFAOYSA-N	200.232	1.966	10	20	BDCD	
Nc1ccc(NC(=O)N2C[C@H]3COC[C@H]3C2)cc1	718203922	IYBKORFDTKNYCG-AOOOYVTPSA-N	247.298	1.379	10	20	BDCD	
C[C@@H]1[C@H](CO)CCCN1Cc1ccc(N)cc1	1335288431	FVEKJEDXLVGCRC-YPMHNXCESA-N	234.343	1.862	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@H](C)CO)c1	35629075	RIBKYERJTKUHEX-NXEZZACHSA-N	209.289	1.732	10	20	BDCD	
COc1cccc(O)c1CN[C@@H]1CO[C@@H](C)C1	842773588	BLKJKFCFVAMJDV-UWVGGRQHSA-N	237.299	1.668	10	20	BDCD	
COC[C@@H](C)C(=O)NCCc1ccc(N)cc1	237156228	OAKBUPRNYMQKHG-SNVBAGLBSA-N	236.315	1.210	10	20	BDCD	
C[C@H](CCCN)NCc1ccc(N(C)C)cc1	310490079	FTQCVVYOTVAVRO-GFCCVEGCSA-N	235.375	1.970	10	20	BDCD	
CN1CCN(Cc2cc(F)cc(F)c2O)CC1	708411533	AUPMNLDLWKVSMF-UHFFFAOYSA-N	242.269	1.418	10	20	BDCD	
CCNC(=O)/C=C\c1ccc(O)c(O)c1	39096614	RJWIODMCPUQQLM-XQRVVYSFSA-N	207.229	1.247	10	20	BDCD	
C[C@@H](O)[C@H]1CCN(Cc2ccccc2O)C1	134735178	AKKCRFDCTQIEJJ-MNOVXSKESA-N	221.300	1.595	10	20	BDCD	
CCCCNC(=O)CN(C)c1ccc(N)cc1	49280643	JZNMOUZFSWANGV-UHFFFAOYSA-N	235.331	1.621	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CCN(C)C2)c1	42545250	MOQWQIYSHSIMTC-NSHDSACASA-N	236.315	1.195	10	20	BDCD	
CCN1CCN(Cc2ccc(C)cc2O)CC1	205610702	PQZXVBBIOKZADX-UHFFFAOYSA-N	234.343	1.838	10	20	BDCD	
CNCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O	817953870	VOZGGIFPNRLIQY-MRVPVSSYSA-N	239.275	1.170	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC[C@H](C)N)c1	817973264	RXESBEBXFNSXGY-IUCAKERBSA-N	224.304	1.399	10	20	BDCD	
NCC(F)(F)CNCc1ccccc1O	841060118	ORMALGHOWRANPS-UHFFFAOYSA-N	216.231	1.076	10	20	BDCD	
CCN(CCN)Cc1c(O)ccc(Cl)c1F	863643881	ACXGHONGBAUMTJ-UHFFFAOYSA-N	246.713	1.965	10	20	BDCD	
O=Cc1ccc(C(=O)NCc2ccccc2O)[nH]1	769361960	CVYFYGWXFGFLQH-UHFFFAOYSA-N	244.250	1.463	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1NCC1(C)C)c1ccccc1O	870988028	DNYXHLDNZJFTSV-BXKDBHETSA-N	248.326	1.567	10	20	BDCD	
C[C@H](O)[C@H]1CCCN(c2ccc(N)cc2)C1	409434021	ZOWURHCKYJJOEL-QWRGUYRKSA-N	220.316	1.866	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@@H]2CCCN2)cc1	1346218414	AWBOYSXYKZTDPT-LBPRGKRZSA-N	233.315	1.027	10	20	BDCD	
CCN[C@H](C)c1cc(C(=O)O)ccc1O	1596491179	ORWFOEGOAOFRHC-SSDOTTSWSA-N	209.245	1.761	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@@H]2COC[C@@H]2O)c1	323580017	VGJXPMAPCXAGSA-NDMJEZRESA-N	237.299	1.111	10	20	BDCD	
C=CC(=O)NCc1ccc2c(c1)CCCN2C	1120549305	CZROJBMGSQKYSN-UHFFFAOYSA-N	230.311	1.871	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCCN(C)C)c1	35628438	WDDLFKIAWSNAIV-NSHDSACASA-N	222.332	1.913	10	20	BDCD	
CN(C)C1(CNCc2ccccc2O)CCC1	97928847	CGHUOIIVUWREPK-UHFFFAOYSA-N	234.343	1.966	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C[C@H]3CC[C@H]2NC3)c1	530245896	HBCKZIHKURNGOQ-BNOWGMLFSA-N	246.354	1.931	10	20	BDCD	
Cc1ccc(O)c(CN[C@]2(C)CCOC2=O)c1	289840667	OXQACPOZKJRCRW-CYBMUJFWSA-N	235.283	1.496	10	20	BDCD	
CC(C)ONC(=O)c1c(F)ccc(O)c1O	295526682	JCUYCYSWBVKIPI-UHFFFAOYSA-N	229.207	1.307	10	20	BDCD	
C[C@H](CN)CN[C@H](C)c1ccc(N(C)C)cc1	817962961	PSYGJIQEARGIKX-VXGBXAGGSA-N	235.375	1.998	10	20	BDCD	
C[C@@H](NC(=O)[C@@H](O)C1CC1)c1ccccc1O	827946444	ICRLTQLBYNTYCF-PELKAZGASA-N	235.283	1.340	10	20	BDCD	
CO[C@H](CNC(=O)c1cc(O)cs1)C(C)C	829415130	KLQQJEIGBXFSEY-SECBINFHSA-N	243.328	1.855	10	20	BDCD	
CN(C)c1ccc(/C=C/CN[C@@H]2CNOC2)cc1	904423842	JJSFFMXYNNPPFQ-ITDFMYJTSA-N	247.342	1.259	10	20	BDCD	
CCC1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C1	837258638	LYGHKHLSZYYWHB-XQRVVYSFSA-N	247.294	1.979	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1O	785765158	SLHXKDRMSNCWFD-SMDDNHRTSA-N	234.343	1.565	10	20	BDCD	
C[S@](=O)CCCNCc1ccccc1O	116919998	ZNNZLGYRWCQFHE-OAHLLOKOSA-N	227.329	1.250	10	20	BDCD	
COc1ccccc1C(=O)N1CC(N=[N+]=[N-])C1	409422976	KITBOGFMBQRSKU-UHFFFAOYSA-N	232.243	1.830	10	20	BDCD	
OCC1(NCc2cc(F)cc(F)c2O)CCC1	708440876	FEFSBCQWILXSLP-UHFFFAOYSA-N	243.253	1.675	10	20	BDCD	
COC(=O)Cn1ccc(-c2cccnc2)cc1=O	536960113	SCXCDEXSPWVRJL-UHFFFAOYSA-N	244.250	1.083	10	20	BDCD	
CCN(OC)C(=O)c1cccc(O)c1O	1529028624	VVVUKGXXJJIFCJ-UHFFFAOYSA-N	211.217	1.121	10	20	BDCD	
CCN(CCO)c1ccc(OC)c(OC)c1	204185878	RAJDTKRIFNTCHJ-UHFFFAOYSA-N	225.288	1.522	10	20	BDCD	
C[C@H](NCCCN(C)C)c1ccccc1O	19958455	SFHCJGWSUZQNPG-NSHDSACASA-N	222.332	1.995	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1CCC(=O)N1	844304950	AXLGQPOHELPFOH-NSHDSACASA-N	234.299	1.103	10	20	BDCD	
CC[C@@H](N)C(=O)N[C@H](C)c1ccccc1O	870988214	JCGOGVCBXZYIJT-PSASIEDQSA-N	222.288	1.307	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)[C@@H](C(=O)O)C1	1604754412	VZBPKHHLDCEGMG-GXFFZTMASA-N	248.326	1.954	10	20	BDCD	
COc1ccc(N(C)C[C@@H]2CCNC2)cc1	51890129	ANXUJOCRZIOSFQ-LLVKDONJSA-N	220.316	1.741	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2CCCO2)cc1	32013615	JXIITDSXPQGEHQ-NSHDSACASA-N	220.272	1.064	10	20	BDCD	
CN(C)c1ccc(CN2C[C@@H]3CNC[C@@H]3C2)cc1	90320319	PSEWQDCDKADKLK-OKILXGFUSA-N	245.370	1.404	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1O	271353982	QACQIIMMPJLHIZ-DZGCQCFKSA-N	248.370	1.955	10	20	BDCD	
COCC(=O)N[C@@H](C)c1cc(OC)ccc1O	728979716	KZHYMQXMBJFDSR-QMMMGPOBSA-N	239.271	1.224	10	20	BDCD	
CCOc1ccc(N(C)CC(=O)N2CCC2)cc1	739923913	NSEVLISYZGZNQB-UHFFFAOYSA-N	248.326	1.754	10	20	BDCD	
COCCNCCNCc1cccc(C)c1O	841047491	CNJHQJCHBKWSTH-UHFFFAOYSA-N	238.331	1.026	10	20	BDCD	
COc1cccc(O)c1CNCC1(N)CCC1	841050038	CYLIOFGKNGJXBS-UHFFFAOYSA-N	236.315	1.372	10	20	BDCD	
COc1cccc(O)c1CNC1CCNCC1	841026658	NXJTVRXCRSINEN-UHFFFAOYSA-N	236.315	1.242	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@@]12CCC[C@@H]1C2	934944156	OYJBKTPIBXJIBE-QMTHXVAHSA-N	247.294	1.904	10	20	BDCD	
CS[C@@H](C)C(=O)N(C)c1ccc(N)cc1	877079887	AKBACCRHNUQCHP-QMMMGPOBSA-N	224.329	1.983	10	20	BDCD	
CONC(=O)N[C@@H](C)c1ccc(N(C)C)cc1	773610043	BTNBBHVSPVXAJC-VIFPVBQESA-N	237.303	1.674	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCC[C@H](N)C2)cc1	1120370691	DMIFOOCYBKCMMR-QWHCGFSZSA-N	219.332	1.628	10	20	BDCD	
CC(C)C1(O)CN(Cc2ccc(N(C)C)cc2)C1	785833716	YLIWLWNKVYBFRY-UHFFFAOYSA-N	248.370	1.955	10	20	BDCD	
COC(=O)[C@@H](C)NCc1ccc2c(c1)CCCO2	894177929	DBMIOTVJDOKBCU-SNVBAGLBSA-N	249.310	1.663	10	20	BDCD	
CO[C@@H]1CN(CCN=[N+]=[N-])C[C@H]1n1cccn1	409432637	LMIXWTZHWZQMRA-NXEZZACHSA-N	236.279	1.065	10	20	BDCD	
Oc1c(F)cc(F)cc1CN1CCOCC1	708402095	UUSSXBPWCDVBQC-UHFFFAOYSA-N	229.226	1.503	10	20	BDCD	
C[C@H](NCCCCO)c1ccccc1O	193276898	KYQDQONWGJXDTM-JTQLQIEISA-N	209.289	1.815	10	20	BDCD	
O=C(NCCC(F)F)NCc1ccccc1O	1343360516	YHRYXUCCWUEDPK-UHFFFAOYSA-N	244.241	1.847	10	20	BDCD	
Cc1cccc(CNCC(C)(C)CO)c1O	162872626	QMOKUHCCPLZJGC-UHFFFAOYSA-N	223.316	1.809	10	20	BDCD	
Cc1cccc(CN[C@H]2CCCNC2)c1O	841041673	DIYYBWKVBKNBDE-LBPRGKRZSA-N	220.316	1.542	10	20	BDCD	
C[S@@](=O)CCCNCc1ccccc1O	116919996	ZNNZLGYRWCQFHE-HNNXBMFYSA-N	227.329	1.250	10	20	BDCD	
COc1cccc(CN2CCNC[C@@H]2C)c1O	722385043	DYRMFLDNWGGSJM-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
C[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)C1	112011580	WFGYCGFUFQWLMT-SECBINFHSA-N	235.283	1.963	10	20	BDCD	
CC(C)CS(=O)(=O)NCc1ccc(N)cc1	70711886	FGAZGWCPCIRHMK-UHFFFAOYSA-N	242.344	1.344	10	20	BDCD	
COC(=O)[C@H]1C[C@@H](NCc2cc(C)ccc2O)C1	827500834	LKGXNIVJHNYBAR-KLPPZKSPSA-N	249.310	1.742	10	20	BDCD	
Oc1c(F)cccc1CN[C@@H]1CCCNCC1	841057115	IIWGIKRDQRQXJH-LLVKDONJSA-N	238.306	1.763	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@](C)(C(N)=O)C1	877494547	YFXGHTZXHVOVFG-AWEZNQCLSA-N	248.326	1.398	10	20	BDCD	
O=C(NCc1ccccc1O)Nc1ccncn1	770761067	VZOWOPXSPLMLHO-UHFFFAOYSA-N	244.254	1.504	10	20	BDCD	
CCc1cccc(CN2CC(C)(O)C2)c1O	877580457	DBEQUFPZUMFVRU-UHFFFAOYSA-N	221.300	1.521	10	20	BDCD	
CN(Cc1cc(F)cc(F)c1O)C1CC(O)C1	894462214	QNNQXASPHBRKSP-UHFFFAOYSA-N	243.253	1.626	10	20	BDCD	
CO[C@H](C)CC(=O)NCc1cccc(O)c1O	1520508510	DDNATWZUATUZGP-MRVPVSSYSA-N	239.271	1.139	10	20	BDCD	
Cc1ccc(CN[C@H](C(=O)O)C2CC2)c(O)c1	1600418207	YLJJBHVOZHZUFH-LBPRGKRZSA-N	235.283	1.653	10	20	BDCD	
Cc1c[nH]nc1C(=O)N(C)Cc1ccccc1O	383616800	GYFXXCXZNBZQGS-UHFFFAOYSA-N	245.282	1.696	10	20	BDCD	
CCN(C)CCNCc1ccccc1O	54109789	JREQDUMSIUWJNH-UHFFFAOYSA-N	208.305	1.434	10	20	BDCD	
CC(=O)NCc1ccc2c(c1)CCCN2C	58768460	BLNXCDWAUJCUAL-UHFFFAOYSA-N	218.300	1.705	10	20	BDCD	
CN1C[C@H](NCc2ccc(N(C)C)cc2)CC1=O	263780929	VNBYKWOCJSYWBI-GFCCVEGCSA-N	247.342	1.073	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2C[C@H]3CC[C@@H]2O3)cc1	132000461	ACLAIEMJNLMQJY-UPJWGTAASA-N	246.310	1.247	10	20	BDCD	
C[C@H]1NCC[C@@H]1C(=O)N(C)Cc1ccccc1O	92954829	GJFCPOIWBQPTAI-PWSUYJOCSA-N	248.326	1.349	10	20	BDCD	
C[C@@H]1c2nncn2CCN1Cc1ccccc1O	276872862	YRDCPAGYAUAMSA-SNVBAGLBSA-N	244.298	1.561	10	20	BDCD	
CC(C)(C)NCCNC(=O)Cc1ccc(N)cc1	830171961	WQCHGDPEXUFZIG-UHFFFAOYSA-N	249.358	1.316	10	20	BDCD	
CC(C)(N)CN1CCCc2cc(CN)ccc21	843058165	MXMQYSCNBKEWIK-UHFFFAOYSA-N	233.359	1.635	10	20	BDCD	
CCOc1ccc(O)c(CN[C@H]2CCNC2)c1	841044815	IWTQEEZARWYBKW-NSHDSACASA-N	236.315	1.242	10	20	BDCD	
CCOc1ccc(CN(C)CCN)c(O)c1	841099894	QDHOFDDYZKIXGL-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1CC1	910956899	IMPQVGPYPZNJPP-UHFFFAOYSA-N	207.229	1.124	10	20	BDCD	
CCN(C)c1ccc(CN2C[C@H](C)[C@@H](O)C2)cc1	773819068	OBLFKLCHNAKRMB-WFASDCNBSA-N	248.370	1.955	10	20	BDCD	
CC[C@@H](N[C@@H]1CCCNC1=O)c1ccccc1O	50394198	QGFJNIYGQRQOOX-VXGBXAGGSA-N	248.326	1.712	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1CCOC1)CCO2	37739026	IXAHFTDHBWXIHP-LBPRGKRZSA-N	233.311	1.748	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CC1COC1	769711300	NPCBJKXRUGSZFX-UHFFFAOYSA-N	235.283	1.387	10	20	BDCD	
CNC(=O)C[C@H](C)NCc1ccccc1O	167192770	UKOBEGBESHJVHO-VIFPVBQESA-N	222.288	1.006	10	20	BDCD	
COc1ccc(CNC[C@H]2CCCN2)cc1C	258898102	LZGSRLKYKVWCOC-CYBMUJFWSA-N	234.343	1.845	10	20	BDCD	
C[C@@H](CN)N(C)Cc1cccc(Cl)c1O	309504505	VOIKYISXMGILMJ-QMMMGPOBSA-N	228.723	1.825	10	20	BDCD	
Cc1cccc(O)c1CNCC[C@H](C)O	877476901	QRIYGZXHLFUKDD-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
CCCCNC(=O)c1ccc(C)c(O)c1O	177661485	WVWAJWYLPVZZJM-UHFFFAOYSA-N	223.272	1.936	10	20	BDCD	
Cn1ccc(NC(=O)Cc2ccc(N)cc2)n1	37559976	YODJXSAFGFCRFL-UHFFFAOYSA-N	230.271	1.184	10	20	BDCD	
COCC[C@@H](C)NCc1cc(OC)ccc1O	81705329	WBQHAOYEZGOLLC-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
Cc1cccc(CN2CC[C@H](O)[C@H](C)C2)c1O	190044038	QDTPTECCMUAFOU-YPMHNXCESA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)CCO)c1	96811523	ZISTXWGGXPRHQK-SNVBAGLBSA-N	209.289	1.561	10	20	BDCD	
C[C@@H](N[C@@H](CN)C1CC1)c1cc(F)ccc1O	817959294	FJIHXJJFTGQVFB-PELKAZGASA-N	238.306	1.919	10	20	BDCD	
Nc1ccc(CCNC(=O)C[C@@H](N)C2CC2)cc1	832659304	ZJDWNCSSGRUWTG-CYBMUJFWSA-N	247.342	1.055	10	20	BDCD	
CCC(=O)OCC(=O)c1ccc(O)c(O)c1	916590309	MTGAUDZHFOKCAN-UHFFFAOYSA-N	224.212	1.234	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CC(=O)N[C@@H](C)C2)c1	840131794	CVUVXXCDIHOLBS-NSHDSACASA-N	248.326	1.329	10	20	BDCD	
CCCNCCNCc1cc(C)ccc1O	841047058	TZJUAQICNZHTLI-UHFFFAOYSA-N	222.332	1.790	10	20	BDCD	
C[C@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1	841027708	VBJBMGKTYMWSFO-VIFPVBQESA-N	247.298	1.076	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCC(C)(C)O	840934361	PJMYUTINEVCJBX-UHFFFAOYSA-N	236.359	1.922	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@]2(C)CCOC2)c1	862757617	ZYQYUYHNUWLBHA-CQSZACIVSA-N	249.310	1.743	10	20	BDCD	
C/C=C/C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1	773740171	AGNRDPXMSRUDGT-NWALNABHSA-N	235.283	1.721	10	20	BDCD	
CNC(=O)[C@H](C)N[C@@H](C)c1cc(F)ccc1O	94617865	KXPHJGDPIXJZDD-YUMQZZPRSA-N	240.278	1.316	10	20	BDCD	
COCCC1CCN(C(=O)CN=[N+]=[N-])CC1	409425187	FKEHPNIHWWPQPO-UHFFFAOYSA-N	226.280	1.572	10	20	BDCD	
CCCNCCNCc1c(O)cccc1OC	1325321316	UTXVHLPVSFWPPY-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
CC(C)ONC(=O)c1cc(O)cs1	1328383024	NBXLOIZUFMFEGL-UHFFFAOYSA-N	201.247	1.524	10	20	BDCD	
CNC[C@H](C)CNCc1cccc(OC)c1O	1327415262	JJINVHIBPHQJRX-JTQLQIEISA-N	238.331	1.346	10	20	BDCD	
O=C(O)C1=CC[C@@H](NCc2ccccc2O)C1	1332423110	KSXDXJRRAOJZEV-LLVKDONJSA-N	233.267	1.655	10	20	BDCD	
CN[C@@H](C)CCNCc1cc(C)ccc1O	1261370420	JABKTMMOERXPPL-NSHDSACASA-N	222.332	1.788	10	20	BDCD	
Cc1ccc(CNCC(C)(C)C(=O)O)c(O)c1	1600419688	XQMPPWICGPDXRA-UHFFFAOYSA-N	237.299	1.901	10	20	BDCD	
N[C@@H]1CCCC[C@H]1NCc1ccc2c(c1)CCO2	258842657	DTEXPLLBZSBCKE-ZIAGYGMSSA-N	246.354	1.981	10	20	BDCD	
COC[C@](C)(O)CNCc1cc(C)ccc1O	382544045	FILAZPZEULETSS-CYBMUJFWSA-N	239.315	1.188	10	20	BDCD	
CNC[C@H](C)NCc1ccc(OC)c(C)c1	853250716	YAJXOLHTHSUJRU-NSHDSACASA-N	222.332	1.701	10	20	BDCD	
COc1ccc(O)c(CN(C)Cc2nnc[nH]2)c1	180324781	ODJYMBJVPILCKH-UHFFFAOYSA-N	248.286	1.151	10	20	BDCD	
c1n[nH]c(CCNCc2ccc3c(c2)CCO3)n1	80574367	VDPKXOAMTRQUSF-UHFFFAOYSA-N	244.298	1.072	10	20	BDCD	
COc1cccc(O)c1CNCC(C)(C)N	841031708	ZJAAFBWGMUCVJV-UHFFFAOYSA-N	224.304	1.228	10	20	BDCD	
CNCCN(C)Cc1cc(Cl)cc(F)c1O	843057491	PHAQHKSLKBQSCY-UHFFFAOYSA-N	246.713	1.836	10	20	BDCD	
N[C@H](CNCc1cccc(F)c1O)C1CC1	841048557	FDFREPAAMTYVFJ-LLVKDONJSA-N	224.279	1.358	10	20	BDCD	
CON1CCN(Cc2ccc(N(C)C)cc2)CC1	846970292	CWRKWKFJLNJLCV-UHFFFAOYSA-N	249.358	1.432	10	20	BDCD	
C[C@@H](CCCO)NC(=O)c1cc(O)cs1	760173975	QRBXGTWMSXBZFH-ZETCQYMHSA-N	229.301	1.345	10	20	BDCD	
O=C(OCC1CC1)c1cccc(O)c1O	779466035	LTKMKIKRYUFAFF-UHFFFAOYSA-N	208.213	1.665	10	20	BDCD	
Cc1nc(C(=O)NCc2ccccc2O)no1	701152019	SNJMZQITABEULZ-UHFFFAOYSA-N	233.227	1.014	10	20	BDCD	
C[C@H](O)CCNCc1cc(F)cc(F)c1O	708436121	JJARMELXNYRQPQ-ZETCQYMHSA-N	231.242	1.531	10	20	BDCD	
CC(=O)CCC(=O)NCc1cccc(O)c1O	1347233887	KQILIAGLOGHJBL-UHFFFAOYSA-N	237.255	1.083	10	20	BDCD	
Cn1ccnc1Sc1ncc([N+](=O)[O-])s1	5116734	SVIJDDPKNUIEGC-UHFFFAOYSA-N	242.285	1.936	10	20	BDCD	
COC[C@@H](CO)N[C@@H](C)c1cc(F)ccc1O	234889667	WHBSTPBZUBAACS-WCBMZHEXSA-N	243.278	1.189	10	20	BDCD	
Oc1ccccc1CNCCO[C@H]1CCOC1	724925776	VJWMLRXNSXRDAE-LBPRGKRZSA-N	237.299	1.287	10	20	BDCD	
CC[C@@H](CO)N[C@@H](C)c1ccccc1O	20194902	PFCWRTFIVYPSDM-UWVGGRQHSA-N	209.289	1.814	10	20	BDCD	
Cc1ccc(O)c(CN[C@@]2(C)CCOC2)c1	120220124	LVDQYCYSVHYLAD-ZDUSSCGKSA-N	221.300	1.969	10	20	BDCD	
C[C@@H](CNC(=O)c1cccc(O)c1O)C1CC1	126545241	FUMLWNLMPRGMBC-QMMMGPOBSA-N	235.283	1.874	10	20	BDCD	
Nc1ccc(NC(=O)N[C@@H]2C[C@H]3CC[C@@H]2O3)cc1	132929099	GSVKNYLNBPDNED-UTUOFQBUSA-N	247.298	1.710	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CCO[C@H]2C)c1	134236720	MKZPQFMIXJHXTD-JOYOIKCWSA-N	237.299	1.668	10	20	BDCD	
CO[C@H](C)CN(C)Cc1ccccc1O	182334452	CNFQWZFFEYJTNV-SNVBAGLBSA-N	209.289	1.859	10	20	BDCD	
CC(C)CNC(=O)NCc1ccccc1O	299466034	BMFMNKUMXYQPOI-UHFFFAOYSA-N	222.288	1.847	10	20	BDCD	
Cc1ccc([C@H](C)NC/C=C/CO)c(O)c1	717531295	DPJUROGCWZQKRK-UFFNRZRYSA-N	221.300	1.900	10	20	BDCD	
CC(=O)C1(C(=O)N[C@H](C)c2ccccc2O)CC1	827952341	OKAIXBUHKKGNAL-SECBINFHSA-N	247.294	1.939	10	20	BDCD	
CCONC(=O)NCc1cc(Cl)ccc1O	845122232	NUYSGBSLNGHUSZ-UHFFFAOYSA-N	244.678	1.796	10	20	BDCD	
CCOc1ccc(CN(C)[C@@H](C)CN)c(O)c1	843051473	JCJWSNPWPBXJRQ-JTQLQIEISA-N	238.331	1.570	10	20	BDCD	
CC[C@H](N)CNCc1cccc(OC)c1O	841069479	AEFUIABQCLIUAO-JTQLQIEISA-N	224.304	1.228	10	20	BDCD	
CCC(=O)[C@@H](C)OC(=O)c1cccc(O)c1O	758548304	QZAPFYPIQCYBAZ-SSDOTTSWSA-N	238.239	1.622	10	20	BDCD	
C[C@@H]1CCCN1Cc1cc2c(cc1O)OC[C@@H]2O	768465786	LHKXTFYXLQIWMY-RNCFNFMXSA-N	249.310	1.802	10	20	BDCD	
Cc1cccc(O)c1CN1CCC(C(N)=O)CC1	876526815	GVODVRSWIVJTQC-UHFFFAOYSA-N	248.326	1.398	10	20	BDCD	
C[C@H](NC(N)=O)c1ccc(N(C)C)cc1	774019120	WCPQNXRFMMXCNE-QMMMGPOBSA-N	207.277	1.482	10	20	BDCD	
O=C(NC[C@@H]1CC[C@H](O)C1)c1cc(O)cs1	789918807	VZCAUPSGDSYKIV-SFYZADRCSA-N	241.312	1.345	10	20	BDCD	
C[C@H]1C[C@@H]1NC(=O)Cc1ccc(N)cc1	52268071	KNJSDBRWBOHMPQ-KWQFWETISA-N	204.273	1.336	10	20	BDCD	
C[C@@H](NC1CC1)C(=O)N[C@H](C)c1ccccc1O	870988614	VATPWBINCHFODC-NXEZZACHSA-N	248.326	1.710	10	20	BDCD	
CC[C@@H](O)CN(C)c1ccc(OC)c(OC)c1	743841287	RZVKIRFLEINFFP-LLVKDONJSA-N	239.315	1.911	10	20	BDCD	
C[C@H]1NCCN(Cc2ccc(N)cc2)[C@@H]1C	1334773973	BVUPSTIZVQALEL-GHMZBOCLSA-N	219.332	1.451	10	20	BDCD	
CN(Cc1ccc(N)cc1)CC(C)(C)N	1262487777	FOCDJOJSOXEBOI-UHFFFAOYSA-N	207.321	1.438	10	20	BDCD	
O=C(O)c1cnc(SCC2OCCO2)s1	1602536615	BZXRPVDEMZQWQP-UHFFFAOYSA-N	247.297	1.306	10	20	BDCD	
CC[C@@H](NCc1ccc2c(c1)CCO2)[C@H](C)O	386857608	JBHXACFPALARIC-GXFFZTMASA-N	235.327	1.871	10	20	BDCD	
COc1cccc(O)c1CN(C)CCC(=O)O	820871071	NOCKIFFFYNEACG-UHFFFAOYSA-N	239.271	1.307	10	20	BDCD	
CCN(C)C(=O)/C=C/c1ccc(O)c(O)c1	180638223	RAZAEEUDFOMXPF-FNORWQNLSA-N	221.256	1.589	10	20	BDCD	
COc1ccc(O)c(CN(C)CCCN)c1	227745211	ONDDSJZVJDOWSJ-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)CCO)c1	96811522	ZISTXWGGXPRHQK-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
CC(C)[C@@H](CO)N[C@@H]1CCc2cccc(O)c21	297527036	DJYNSFJEIMFFDT-VXGBXAGGSA-N	235.327	1.986	10	20	BDCD	
CCCN[C@@H](C)C(=O)NCc1ccccc1O	295197003	OSMPLVYVTDRDIA-JTQLQIEISA-N	236.315	1.397	10	20	BDCD	
Nc1ccc(NC(=O)CC[C@@H]2CCCN2)cc1	294649135	BSSGQRNEMDOTAL-NSHDSACASA-N	233.315	1.740	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@H](O)C2CC2)cc1	854270005	CFGUSPIAJQVUEG-CYBMUJFWSA-N	248.326	1.140	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)NCC(F)F)c1	858262668	QHKPWHNYOKKWKE-UHFFFAOYSA-N	244.241	1.765	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(C)cc2O)C[C@@H]1O	876814352	DZQCRRINBWYFHW-RISCZKNCSA-N	235.327	1.903	10	20	BDCD	
CC[C@@H](NCc1nncn1C)c1ccccc1O	38007446	DKYJEFZHQYETTA-LLVKDONJSA-N	246.314	1.762	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCc2c[nH]cn2)c1	88750720	ZNLVMEQMXSTJDY-SECBINFHSA-N	247.298	1.975	10	20	BDCD	
CNC[C@@H](C)CNCc1cccc(Cl)c1O	1328677168	KQSVZHGVWRBQCB-SECBINFHSA-N	242.750	1.991	10	20	BDCD	
CN(CCOC1CC1)c1ccc(N)cc1	711655835	AMRHOUYKSYJECU-UHFFFAOYSA-N	206.289	1.884	10	20	BDCD	
COc1ccc(O)c(CNC[C@H]2C[C@H](O)C2)c1	720947194	KWTYWTUJEDYGGG-HOMQSWHASA-N	237.299	1.261	10	20	BDCD	
COCC1(C(=O)N(C)Cc2ccccc2O)CC1	778891721	FVJLOKLZUKWMGE-UHFFFAOYSA-N	249.310	1.777	10	20	BDCD	
C[C@H](C(=O)NCc1ccc(N)cc1)C1CC1	163261602	MQHRSCAFERFVIK-VIFPVBQESA-N	218.300	1.931	10	20	BDCD	
C[C@@H](CCCN)NCc1ccc2c(c1)CCO2	841080094	NQKLOORZZCRVPY-NSHDSACASA-N	234.343	1.839	10	20	BDCD	
CN(CCn1cccn1)Cc1ccccc1O	111236168	QSZGGDZIZDQMMJ-UHFFFAOYSA-N	231.299	1.721	10	20	BDCD	
CCN1CCN(Cc2cc(C)ccc2O)CC1	131701072	QRSKAWUHUGOEMP-UHFFFAOYSA-N	234.343	1.838	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](O)[C@H](C)C2)c1O	190044056	QDTPTECCMUAFOU-DGCLKSJQSA-N	235.327	1.903	10	20	BDCD	
CNCCCNCc1cc(OC)ccc1O	83353526	HHDNLXLMJXDCTB-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
COc1cccc(CN2CCC[C@H]2CO)c1O	92455895	RWDUPKONCZCITP-NSHDSACASA-N	237.299	1.358	10	20	BDCD	
CO[C@H]1COC[C@@H]1N[C@@H]1CCc2cccc(O)c21	297441341	WEQDVSWZTPHSTD-MDZLAQPJSA-N	249.310	1.383	10	20	BDCD	
CCNCCN[C@H]1CCc2cccc(O)c21	817951316	DFHHVKYRHCWEJQ-NSHDSACASA-N	220.316	1.579	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@@H](O)C1	732258431	ABNAMFJDXBYMNF-SSDOTTSWSA-N	227.285	1.051	10	20	BDCD	
CCN1C[C@H](CNCc2ccccc2O)CC1=O	846092479	DILHDJAIROOFML-NSHDSACASA-N	248.326	1.350	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@H](C(=O)O)C2)c1O	874055404	WUFWHIQYCXXMBY-XYPYZODXSA-N	235.283	1.653	10	20	BDCD	
C[C@H](C(=O)N(C)c1ccc(N)cc1)[C@@H](C)N	877077532	LYEBGIHDDOVAMO-DTWKUNHWSA-N	221.304	1.215	10	20	BDCD	
CC(C)N1CC[C@H](NCc2ccc(N)cc2)C1=O	1337837454	BJNMPWWNQQUYDJ-ZDUSSCGKSA-N	247.342	1.368	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)[C@@H](C)CN1	841849470	WHRDXWPTDQCMCG-QWRGUYRKSA-N	247.342	1.020	10	20	BDCD	
Cc1ccc(O)c(CNCCCOCCO)c1	227335420	YHQHTQYFDARXOE-UHFFFAOYSA-N	239.315	1.189	10	20	BDCD	
COCC1(NCc2cc(F)cc(F)c2O)CC1	708494805	PUNSWFSUIIJFAE-UHFFFAOYSA-N	243.253	1.939	10	20	BDCD	
CN(C)c1ccc(CNCCC(C)(C)N)cc1	306088149	IARCAQKPAHZAHR-UHFFFAOYSA-N	235.375	1.970	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)c1cocn1	122277066	OONDOODRBGTWJR-UHFFFAOYSA-N	248.238	1.058	10	20	BDCD	
CCOCCNCc1ccc2c(c1)CCO2	37363106	OVJALQJDPBQTTJ-UHFFFAOYSA-N	221.300	1.748	10	20	BDCD	
OCCNCc1cc(Br)ccc1O	32025670	ZSQYILLRWOIHIQ-UHFFFAOYSA-N	246.104	1.237	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H](O)C2)cc1	84933961	AUOMXQXYXSTDNS-ZDUSSCGKSA-N	220.316	1.319	10	20	BDCD	
c1csc(SC[C@@H]2CCOCO2)n1	264649921	OQEOYQFFDNEOFO-ZETCQYMHSA-N	217.315	1.998	10	20	BDCD	
CO[C@@H](C)[C@@H](C)NC(=O)c1cc(O)cs1	812349774	SNAYXMMVAOVXOZ-RQJHMYQMSA-N	229.301	1.607	10	20	BDCD	
Cc1cc(O)c(CN2CCNC[C@H]2C)cc1C	843047842	YLUNOWCAHNRCLW-GFCCVEGCSA-N	234.343	1.803	10	20	BDCD	
CCc1cc(C(=O)NCc2ccccc2O)n[nH]1	748347135	XALSJABYAGIJSF-UHFFFAOYSA-N	245.282	1.608	10	20	BDCD	
Oc1cc2c(cc1CN1CCCCC1)[C@@H](O)CO2	768438706	XFIFZIAQEZZRGU-ZDUSSCGKSA-N	249.310	1.804	10	20	BDCD	
Cc1ccc(CN(CCO)CC(F)F)c(O)c1	877490667	CMJLALCATNZYCY-UHFFFAOYSA-N	245.269	1.760	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H]1O	897681306	QTPLAMHWUUHTPT-PRHODGIISA-N	225.263	1.344	10	20	BDCD	
Cc1ccc(CN[C@H](C)c2n[nH]c(C)n2)c(O)c1	894779233	XGVDRMGAABLHNE-SECBINFHSA-N	246.314	1.978	10	20	BDCD	
Oc1ccccc1CNCc1cc[nH]n1	41014071	TTXYWMVCWUSPLH-UHFFFAOYSA-N	203.245	1.405	10	20	BDCD	
CO[C@H](C)CCNC(=O)c1cccc(O)c1O	280764145	YFOJIEWYWZQGMR-MRVPVSSYSA-N	239.271	1.253	10	20	BDCD	
C[C@@H](NC(=O)C(C)(C)N)c1ccccc1O	870988638	VVJICLKYCUPWDT-MRVPVSSYSA-N	222.288	1.307	10	20	BDCD	
COC(=O)[C@H](C)NCc1ccc(N(C)C)cc1	37073782	PRSDWRZFCDQMCP-JTQLQIEISA-N	236.315	1.404	10	20	BDCD	
Oc1ccccc1CN1CCOC[C@@]12CCOC2	195009705	LKXXWLYXCOJVOG-AWEZNQCLSA-N	249.310	1.384	10	20	BDCD	
COC(=O)c1ccc(OCC(=O)C(C)=O)cc1	289590533	JJCKJMHZSFCTGH-UHFFFAOYSA-N	236.223	1.010	10	20	BDCD	
COC(=O)c1cnc(S[C@@H](C)[C@@H](C)O)s1	296375517	VYKGZKMLLNOUOV-RITPCOANSA-N	247.341	1.791	10	20	BDCD	
COc1cccc(CN(C)Cc2cnc[nH]2)c1O	826770619	YKDCVEDHEIIBFU-UHFFFAOYSA-N	247.298	1.756	10	20	BDCD	
C[C@@H](Cn1cncn1)NCc1ccccc1O	725848866	AHMBCBIJUSOIBD-JTQLQIEISA-N	232.287	1.162	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2C[C@@]23CCCNC3)cc1	848393236	WADVVWJOSWXJOS-GXTWGEPZSA-N	245.326	1.597	10	20	BDCD	
Cc1cccc(CN2C[C@@H](CN)C[C@@H]2C)c1O	843057261	HQPKZQKXOPMRLL-NWDGAFQWSA-N	234.343	1.870	10	20	BDCD	
C[C@H]1OCC[C@]1(C)NC(=O)c1cc(O)cs1	753504970	WRQYHMUYSRPBEU-HQJQHLMTSA-N	241.312	1.751	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCCNC(=O)C2)c1	877652568	KUTZFJIOQNROJL-GFCCVEGCSA-N	248.326	1.459	10	20	BDCD	
C[C@H](CCO)N[C@H](C)c1c(O)cccc1F	886530091	CUFFGJFBAVBWRI-RKDXNWHRSA-N	227.279	1.953	10	20	BDCD	
O=C(N[C@H]1C[C@H](C(=O)O)C1)c1cc(O)cs1	1605839457	AFEZFYUEDDDKGK-IZLXSQMJSA-N	241.268	1.047	10	20	BDCD	
CC[C@@H](O)CNC(=O)Nc1ccc(N)cc1	850751298	ZZLLLXJGJBWQCS-SNVBAGLBSA-N	223.276	1.161	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCCC(=O)O)c1	36891971	CSDUUGPAMMBPCS-QMMMGPOBSA-N	239.271	1.526	10	20	BDCD	
CN(CCO)Cc1ccc(N(C)C)cc1	34076770	PBOYVMOCTSNNAE-UHFFFAOYSA-N	208.305	1.177	10	20	BDCD	
CCCCN(CCO)Cc1ccc(N)cc1	49008976	CSLFPONLOAOMHT-UHFFFAOYSA-N	222.332	1.863	10	20	BDCD	
Nc1ccc(CCNC(=O)C2[C@@H]3CCC[C@@H]23)cc1	132692925	RJQILCDUHNKRHY-CHWSQXEVSA-N	244.338	1.974	10	20	BDCD	
C[C@H](NCCCCO)c1ccc(F)cc1O	193282113	MPZQROQZCWMVMS-VIFPVBQESA-N	227.279	1.954	10	20	BDCD	
C[C@@H]1OCCN(Cc2ccc(N)cc2)[C@@H]1C	380443502	SCMGSQBNQXGIAO-MNOVXSKESA-N	220.316	1.878	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCC(C)(C)O)c1	87010662	YEPNRIIUGFSTMT-SECBINFHSA-N	239.315	1.822	10	20	BDCD	
CC(C)[C@H]1NCC[C@H]1C(=O)Nc1ccc(N)cc1	294785017	OATZHPNBOJRRKX-CHWSQXEVSA-N	247.342	1.841	10	20	BDCD	
Cc1cccc(CN(C)C[C@@H](O)C2CC2)c1O	809753134	ZTMOTTLEOGNJLE-CYBMUJFWSA-N	235.327	1.903	10	20	BDCD	
CCO[C@H](CC)C(=O)NCc1ccc(N)cc1	837303046	RFLOZRLEWZDCHR-GFCCVEGCSA-N	236.315	1.700	10	20	BDCD	
COC(=O)NCc1ccc(N(C)C)cc1C	734467644	KUAAEDADNRNSFP-UHFFFAOYSA-N	222.288	1.917	10	20	BDCD	
CC1(N)CCN(Cc2cccc(F)c2O)CC1	843108014	QUYUVUKVUBXBQN-UHFFFAOYSA-N	238.306	1.845	10	20	BDCD	
CCOc1ccc(CN(C)CCOC)c(O)c1	768240771	FMHVYTDQEQJSJN-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
Oc1ccc(F)cc1CN1C[C@H]2C[C@@H]2C1	862444137	YIYXIXXHYZJRPP-RKDXNWHRSA-N	207.248	1.983	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@@H]2CCCCO2)cc1	42811293	VDXNPHKIETTZAG-ZDUSSCGKSA-N	248.326	1.497	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1ncccn1	735850030	RURFVCBWZKMRLN-UHFFFAOYSA-N	243.266	1.454	10	20	BDCD	
COc1cc(N(C)Cc2ccccc2O)ncn1	786796553	HOYCHVBVGQBFRU-UHFFFAOYSA-N	245.282	1.827	10	20	BDCD	
Oc1c(CNC[C@H]2CCN2)ccc2ccccc12	1580885482	ABRKXWJDEHOUEK-CYBMUJFWSA-N	242.322	1.997	10	20	BDCD	
CC[C@@H](OC)C(=O)NCc1ccc(N)cc1	297355871	ZOMIPMCTGYDWBK-LLVKDONJSA-N	222.288	1.310	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@@H](OC)C1	769447855	YYGNHYLFMHKRPH-SNVBAGLBSA-N	237.299	1.622	10	20	BDCD	
CC[C@@]1(C(=O)Nc2ccc(N)cc2)CCNC1	119220562	FHFCKUVRBLUXPW-CYBMUJFWSA-N	233.315	1.597	10	20	BDCD	
O=C(O)c1nccc(Sc2nccs2)n1	307423388	IMNWJHUOLWIWBH-UHFFFAOYSA-N	239.281	1.783	10	20	BDCD	
Oc1ccccc1CNC[C@@H]1CC[C@@H](O)C1	188818670	IWYRJVOFKJLDAE-ZYHUDNBSSA-N	221.300	1.643	10	20	BDCD	
C[C@H](N[C@@H]1CC[C@H]1O)c1ccccc1O	378718532	DKSPLOJTIMDIEM-MKPLZMMCSA-N	207.273	1.566	10	20	BDCD	
Oc1ccccc1CNC[C@@H]1CCN(C2CC2)C1	37649358	CCJQMMIYKDCWTQ-LBPRGKRZSA-N	246.354	1.966	10	20	BDCD	
C[C@H](C(=O)NCc1ccccc1O)n1cccn1	133758583	DGYJNFMVECTBQE-SNVBAGLBSA-N	245.282	1.466	10	20	BDCD	
Cc1cccc(CN(CCO)CC(F)F)c1O	193024873	VYYIXLGNGCFKIF-UHFFFAOYSA-N	245.269	1.760	10	20	BDCD	
O=C(C(=O)c1ccncc1)c1ccncc1	82012454	NQMXKCIJTKUBHD-UHFFFAOYSA-N	212.208	1.542	10	20	BDCD	
C[C@@H](CCO)CCNCc1ccccc1O	295149503	QZLUPBGCGRUVFY-LLVKDONJSA-N	223.316	1.890	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CCN2C)c1O	712537582	FEOMFWGMFGZNJF-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
CNCCN[C@H](C)c1cc(F)ccc1O	817952898	WJXKDRLBUOOZIN-MRVPVSSYSA-N	212.268	1.401	10	20	BDCD	
C[C@@H](N[C@@H](CN)C1CC1)c1ccc(F)cc1O	817961263	VZZJHPDNXHVHIR-PELKAZGASA-N	238.306	1.919	10	20	BDCD	
Cn1cc(CNC(=O)c2cc(O)cs2)cn1	731870261	JUKBIGJZEVKQRD-UHFFFAOYSA-N	237.284	1.117	10	20	BDCD	
CC1=NO[C@H](C(=O)Nc2ccc(N)cc2)C1	911661322	VAWCTWQLZBOKFD-JTQLQIEISA-N	219.244	1.372	10	20	BDCD	
CN(Cc1cccc(Cl)c1O)C1CC(N)C1	843125041	LZTUAFLRJYTBKH-UHFFFAOYSA-N	240.734	1.967	10	20	BDCD	
COC[C@@](C)(O)CNCc1ccc(C)cc1O	877028020	UXQXPCZKDGKHNR-ZDUSSCGKSA-N	239.315	1.188	10	20	BDCD	
Cc1ccc(CN2CC[C@@](C)(C(N)=O)C2)c(O)c1	877493069	DAESLCHYQHCJNK-CQSZACIVSA-N	248.326	1.398	10	20	BDCD	
CC1(NCc2ccc3c(c2)CCO3)COC1	877690575	BCTKDIONAUJFMM-UHFFFAOYSA-N	219.284	1.500	10	20	BDCD	
CN(C(=O)CCCF)c1ccc(N)cc1	877074447	KQZUVPOOZIUIRX-UHFFFAOYSA-N	210.252	1.981	10	20	BDCD	
C[C@@H](CCO)NCCCSc1nccs1	779349067	VKUZZDNQCCDIEN-VIFPVBQESA-N	246.401	1.986	10	20	BDCD	
CCOC1[C@H]2C[C@H]1CN(C(=O)CN=[N+]=[N-])C2	409423732	AIJCMVPREJIIOE-YUMQZZPRSA-N	224.264	1.180	10	20	BDCD	
Cc1cccc(CN[C@@H]2CO[C@H](C)C2)c1O	402145569	NKGUQNRZVJWDFQ-PWSUYJOCSA-N	221.300	1.968	10	20	BDCD	
CC[C@H](NCc1cc(F)ccc1O)C(=O)NC	697934833	GDQWIRRTSBZAJC-JTQLQIEISA-N	240.278	1.146	10	20	BDCD	
CC[C@@H](C)NC(=O)CN(C)c1ccc(N)cc1	20374451	IPGHJGBLWADPGU-SNVBAGLBSA-N	235.331	1.620	10	20	BDCD	
C[C@@H](N[C@@H]1CCCCNC1=O)c1ccccc1O	36977395	OQROCBIXQYSZNS-ZYHUDNBSSA-N	248.326	1.712	10	20	BDCD	
CN(C)c1ccc(CNCCC(=O)O)cc1	36892067	NVBBIRVHUCYUMZ-UHFFFAOYSA-N	222.288	1.317	10	20	BDCD	
COC[C@H](CN[C@@H](C)c1ccccc1O)OC	228808805	ZYXUZJVKMBQSIH-QWRGUYRKSA-N	239.315	1.704	10	20	BDCD	
CC(C)(C)C(=O)C(=O)Nc1ccc(N)cc1	269142823	WZYYQKHNQRLOLV-UHFFFAOYSA-N	220.272	1.823	10	20	BDCD	
O=C(NCc1ccccc1O)OCCCF	841492252	PZAAVWIIXSWOCF-UHFFFAOYSA-N	227.235	1.978	10	20	BDCD	
CCOCc1cn(-c2ccc(N)cc2)nn1	849134929	WXIHGCFDCFTQAH-UHFFFAOYSA-N	218.260	1.386	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2[C@@H]3CNC[C@@H]32)c1	841077278	HOLTZIDYCJRRJU-PJXYFTJBSA-N	218.300	1.008	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC[C@H](O)C1	840910826	SMTNTADMLYARKL-AWEZNQCLSA-N	234.343	1.628	10	20	BDCD	
Cc1cc(O)c(CNC[C@H](C)C(=O)O)cc1C	848637329	FTTTYPGMAVBSBG-JTQLQIEISA-N	237.299	1.819	10	20	BDCD	
CCO[C@@H](C(=O)NCc1ccc(N)cc1)C1CC1	859594110	QDPWGNQRWDGALX-CYBMUJFWSA-N	248.326	1.700	10	20	BDCD	
C[C@H](C[S@@](C)=O)NCc1ccccc1O	164254094	KGQWHRSITWNHOZ-PSLIRLAXSA-N	227.329	1.249	10	20	BDCD	
CNCCCC(=O)N(C)c1ccc(N)cc1	877079017	NVOFRRZHMFEWCZ-UHFFFAOYSA-N	221.304	1.231	10	20	BDCD	
CN(c1ccc(N)cc1)C(=O)[C@H]1CC[C@@H](N)CC1	877076855	SERKMFQFDYTYRQ-PHIMTYICSA-N	247.342	1.749	10	20	BDCD	
COC[C@@H](CO)N[C@H](C)c1c(O)cccc1F	886604923	GELUGBFLSDQFBL-RKDXNWHRSA-N	243.278	1.189	10	20	BDCD	
CCOc1cc(O)ccc1NS(C)(=O)=O	790410021	YKCQEZXNEUFBSH-UHFFFAOYSA-N	231.273	1.162	10	20	BDCD	
N[C@H](CCO)c1cccc(Br)c1O	95638631	XAIMPYPCULCQJG-MRVPVSSYSA-N	246.104	1.537	10	20	BDCD	
C[C@H]1COC[C@@H](C)N1Cc1ccc(N)cc1	91301838	HENXFLISWTXENK-PHIMTYICSA-N	220.316	1.878	10	20	BDCD	
COC(=O)[C@@H](NCc1ccc(N)cc1)C1CC1	1334774012	CDPWVGUCKFEPOP-LBPRGKRZSA-N	234.299	1.310	10	20	BDCD	
CCOCCSc1ncc(C(=O)O)s1	1605641248	WEOJCEQRJBGRRL-UHFFFAOYSA-N	233.314	1.970	10	20	BDCD	
COCCCN(C)c1ccc2c(c1)OCO2	121382427	MGHSWPDQXYNZQO-UHFFFAOYSA-N	223.272	1.888	10	20	BDCD	
COC[C@H](O)CCNCc1cc(F)ccc1O	226618241	UMQYVAZUSLPPNA-LLVKDONJSA-N	243.278	1.018	10	20	BDCD	
CN(C(=O)c1cccc(O)c1O)C1CC1	163269617	NGIFFFFVSXKAMU-UHFFFAOYSA-N	207.229	1.332	10	20	BDCD	
CCN(Cc1cc(OC)ccc1O)[C@H](C)CO	292678206	ALUABBIVVCQILI-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
N[C@H]1C[C@H](NCc2cc(Cl)ccc2O)C1	906507836	FLLLINRNVSXBRS-MGCOHNPYSA-N	226.707	1.625	10	20	BDCD	
CN(C)c1ccc(CNCC2(N)CCC2)cc1	841050507	HIBCDXFBENLUEC-UHFFFAOYSA-N	233.359	1.724	10	20	BDCD	
CNC[C@H](C)NCc1cc(F)ccc1O	853248705	IQOSBJIXJUPOCW-QMMMGPOBSA-N	212.268	1.229	10	20	BDCD	
CN(Cc1cc2c(cc1O)OC[C@@H]2O)C1CCC1	768465362	HJMXFSKNDLPILZ-ZDUSSCGKSA-N	249.310	1.802	10	20	BDCD	
C[C@H](CNCc1ccc(Cl)cc1O)C(=O)O	1589066432	GZKIHJSCBPCJER-SSDOTTSWSA-N	243.690	1.856	10	20	BDCD	
Nc1ccc(NC(=O)NCC(F)(F)CO)cc1	841295900	IZVGBOUORQXEGW-UHFFFAOYSA-N	245.229	1.018	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@H]2O)c1	818358335	WARWOVIHXGDSIW-RLCGTCKNSA-N	237.299	1.575	10	20	BDCD	
Oc1ccccc1CNCC[C@H](O)C1CC1	898205360	COBHYQPYWREMKB-ZDUSSCGKSA-N	221.300	1.643	10	20	BDCD	
COc1ccc(O)c(CNC(C)(C)CO)c1	20196989	DKWJOUPZFKGZGJ-UHFFFAOYSA-N	225.288	1.261	10	20	BDCD	
COc1cccc(CN2CC[C@H](CN)C2)c1O	50245088	HXPUGMXGIRKPQI-SNVBAGLBSA-N	236.315	1.181	10	20	BDCD	
CN(Cc1ccccc1O)C1CCNCC1	215950490	JZNMQWSVEYANAO-UHFFFAOYSA-N	220.316	1.576	10	20	BDCD	
CN1CC[C@H]2CCN(Cc3ccccc3O)[C@H]2C1	272698312	YGCJJBYKJFOWPC-JSGCOSHPSA-N	246.354	1.918	10	20	BDCD	
Cc1cc(O)c(CN(C)CCC(N)=O)cc1C	289709743	OXNRYXZEEKOXQK-UHFFFAOYSA-N	236.315	1.316	10	20	BDCD	
C[C@H](NC/C=C/CO)c1ccccc1O	717533044	MAJPWVZJDWTZEC-YEZKRMTDSA-N	207.273	1.591	10	20	BDCD	
C[C@H](N)CN[C@@H](C)c1ccc(N(C)C)cc1	817972185	UWPPINVTCIYUCL-QWRGUYRKSA-N	221.348	1.750	10	20	BDCD	
C/C(=C\COC(=O)c1cc(O)cs1)C(=O)O	825775587	VTKSNFXZERRSTQ-QHHAFSJGSA-N	242.252	1.641	10	20	BDCD	
COc1ccc(O)c(CN[C@H](CN)C2CC2)c1	841027960	HUWPCYBLNFQDCC-GFCCVEGCSA-N	236.315	1.228	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)CC(N)=O)cc1C	746474460	CQUXXETXBDXTJC-SNVBAGLBSA-N	236.315	1.363	10	20	BDCD	
CC(=O)NCCCNCc1ccc(C)cc1O	876913484	RQKVMDXXCZRUNG-UHFFFAOYSA-N	236.315	1.316	10	20	BDCD	
C[C@H](N)[C@H]1CCCN(Cc2ccccc2O)C1	70171413	GAFVFCMGSBPYQS-RYUDHWBXSA-N	234.343	1.951	10	20	BDCD	
Cc1cccc(O)c1CN1CCn2cnnc2C1	876708069	GWJSWGZYINWRCG-UHFFFAOYSA-N	244.298	1.308	10	20	BDCD	
C[C@@H]1CCC(=O)CN1C(=O)c1cc(O)cs1	885079611	ZBALNFXBTVSBNQ-SSDOTTSWSA-N	239.296	1.647	10	20	BDCD	
c1cc2c(cc1CN[C@H]1CCCOC1)CCO2	103962857	VRHFLUHSHDXODY-ZDUSSCGKSA-N	233.311	1.890	10	20	BDCD	
CCc1cccc(CNCCN2CCC2)c1O	699997710	ZPZULNKSUFWNOB-UHFFFAOYSA-N	234.343	1.750	10	20	BDCD	
CN(Cc1ccc(N)cc1)Cc1nc[nH]n1	1262488232	VISWFVBEPRUMBN-UHFFFAOYSA-N	217.276	1.019	10	20	BDCD	
Cc1cc(O)c(CN(C)CC(=O)O)c(Cl)c1	1600286569	PZESHPHOPWKNLU-UHFFFAOYSA-N	243.690	1.870	10	20	BDCD	
CN(C)c1ccc2c(c1)OCCN2CCCO	266865873	MUUACYKRFUOWBA-UHFFFAOYSA-N	236.315	1.334	10	20	BDCD	
CC[C@@H](CO)N(C)C(=O)Nc1ccc(N)cc1	379128597	ZUBSJJBDRDHOSH-NSHDSACASA-N	237.303	1.503	10	20	BDCD	
C[C@H](NCc1cn(C)cn1)c1ccccc1O	851895207	CCGWRXPANCGYTC-JTQLQIEISA-N	231.299	1.977	10	20	BDCD	
CC[C@@H](O)CN(C)c1ccc2c(c1)OCO2	305350989	WVVJXZYKABCLQK-SNVBAGLBSA-N	223.272	1.622	10	20	BDCD	
Cc1cccc(CN[C@H](CO)C2CC2)c1O	381363433	GDBBGTQSMXXMKO-GFCCVEGCSA-N	221.300	1.561	10	20	BDCD	
COC[C@H](CN[C@H](C)c1ccccc1O)OC	228808821	ZYXUZJVKMBQSIH-MNOVXSKESA-N	239.315	1.704	10	20	BDCD	
COc1cccc(CNCc2ncc(C)o2)c1O	234996361	XZARYKJLDJFCAF-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
C[C@@H]1CCC[C@@H]([C@H]2CCCC(=O)C2=O)N1	253168582	AKLOMWPYVUZNHM-BBBLOLIVSA-N	209.289	1.455	10	20	BDCD	
CC(=O)C(=O)COc1ccc([N+](=O)[O-])cc1	808013092	YNMPPRABDAERPD-UHFFFAOYSA-N	223.184	1.132	10	20	BDCD	
O=C1CC[C@@H](C(=O)NCc2ccc(O)cc2O)C1	828251212	ACJBLMMWXNSSGC-MRVPVSSYSA-N	249.266	1.083	10	20	BDCD	
C[C@H](NCCCON)c1ccccc1O	902419918	VPDVMKLIIUNXPQ-VIFPVBQESA-N	210.277	1.323	10	20	BDCD	
Oc1ccc(F)cc1CNCC[C@H]1CCNC1	841035829	IWWQVKOYQYMGNU-SNVBAGLBSA-N	238.306	1.621	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1CC=CC1	910950792	IKKRPXQKLDTDII-UHFFFAOYSA-N	233.267	1.680	10	20	BDCD	
C[C@@H](CN)NCc1ccc(N(C)C)c(F)c1	841064142	UJBGNCBHADCKJF-VIFPVBQESA-N	225.311	1.329	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H](N)C1CC1	841052137	ZVPPVJVBEIAGOK-HNNXBMFYSA-N	247.386	1.888	10	20	BDCD	
COc1cccc(CN2C[C@@H]3C[C@H]3C2)c1O	862439958	CINGKJBOMQNAFS-QWRGUYRKSA-N	219.284	1.853	10	20	BDCD	
Cc1ccc(CN2Cc3cnn(C)c3C2)c(O)c1	877632599	GULPNMPXCVLOBD-UHFFFAOYSA-N	243.310	1.950	10	20	BDCD	
Cc1cccc(O)c1CNCC[C@H](O)C1CC1	898198238	OZBMFTIOWMKYOF-ZDUSSCGKSA-N	235.327	1.951	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1CC[C@@H](O)C1	187985629	OAXBFHIXOVXFMX-JOYOIKCWSA-N	239.290	1.782	10	20	BDCD	
C[C@@H](O)C(=O)NCCCSc1nccs1	305739325	ZJZCIAYHOLFZHB-SSDOTTSWSA-N	246.357	1.122	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1CCNCC1	37823728	QSPGEMXCOFRXIE-UHFFFAOYSA-N	248.326	1.350	10	20	BDCD	
Nc1ccc(CC(=O)NCC(F)F)cc1	133074561	ADOWMSUTFFWLNY-UHFFFAOYSA-N	214.215	1.193	10	20	BDCD	
O=C(OCc1cn[nH]c1)c1cccc(O)c1O	803440726	QGZPMBADIKPIBL-UHFFFAOYSA-N	234.211	1.178	10	20	BDCD	
CN1CC[C@@H]1CNCc1cc(F)ccc1O	712554862	DGBMPTOLTCHSKK-LLVKDONJSA-N	224.279	1.325	10	20	BDCD	
CN(CCCF)C(=O)c1cccc(O)c1O	716736428	SRJLCIOWQCXORD-UHFFFAOYSA-N	227.235	1.529	10	20	BDCD	
CCNCCN[C@H](C)c1cc(F)ccc1O	817951978	MJQRQAZMDYCTIT-SECBINFHSA-N	226.295	1.791	10	20	BDCD	
CN(Cc1ncc[nH]1)C(=O)c1cc(O)cs1	734865411	RXFLHQZZHMLYNV-UHFFFAOYSA-N	237.284	1.449	10	20	BDCD	
CCCC[C@@H](CN)NCc1ccccc1O	841029812	SMTGYQLBBWKKKP-LBPRGKRZSA-N	222.332	1.999	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@@H]1O	897681305	QTPLAMHWUUHTPT-PELKAZGASA-N	225.263	1.344	10	20	BDCD	
C[C@H](N[C@H](C)c1ccccc1O)c1ncn(C)n1	275622494	AGEAIVBPEAGZBE-ZJUUUORDSA-N	246.314	1.933	10	20	BDCD	
CCOCCCNCc1cc(OC)ccc1O	20092329	DKTILHOBBMKIRA-UHFFFAOYSA-N	239.315	1.917	10	20	BDCD	
O=C(NCC1=CCCC1)c1cccc(O)c1O	702335817	DRRUKQARPDXUHZ-UHFFFAOYSA-N	233.267	1.938	10	20	BDCD	
Oc1ccccc1CN1CCC2(C1)OCCO2	179569105	FXLLMKFSAJUXOS-UHFFFAOYSA-N	235.283	1.341	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)CCO1	132475033	BYDJSZQDXJOBQO-SNVBAGLBSA-N	207.273	1.613	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CCO[C@H]2C)c1	134236758	MKZPQFMIXJHXTD-CABZTGNLSA-N	237.299	1.668	10	20	BDCD	
CC1(C)C[C@H]1CNC(=O)Cc1ccc(N)cc1	226350881	UBAANIIFKDFSNL-NSHDSACASA-N	232.327	1.974	10	20	BDCD	
Cc1ccc([C@H](C)NC[C@@H](C)CN)c(O)c1	817962049	HFEPSGURSZGYAX-QWRGUYRKSA-N	222.332	1.946	10	20	BDCD	
CC(C)[C@@H](N)CN[C@H]1CCc2cccc(O)c21	817959136	PODWISYSHDBUES-RYUDHWBXSA-N	234.343	1.952	10	20	BDCD	
C[C@@H](CN)N[C@@H]1CCc2cccc(O)c21	817969659	GFAGOWMBBNIUMJ-WCBMZHEXSA-N	206.289	1.316	10	20	BDCD	
O=C1CC[C@H](CSc2nccs2)O1	821078580	UWLSRJAQWJJLJS-ZCFIWIBFSA-N	215.299	1.941	10	20	BDCD	
CN(CC(=O)O)Cc1cc2c(cc1O)CCC2	739631436	GMCIFLDGXUGKSE-UHFFFAOYSA-N	235.283	1.397	10	20	BDCD	
COc1cccc([C@H](C)N[C@H](C)CCO)c1O	846148457	ZQIAZJMAXXYUFA-ZJUUUORDSA-N	239.315	1.822	10	20	BDCD	
Oc1cccc2c1[C@@H](NCCN1CCC1)CC2	697379981	QDCNIDVCPYOHKW-LBPRGKRZSA-N	232.327	1.675	10	20	BDCD	
Cc1ccc(CN[C@H](C)CC(N)=O)c(O)c1	877095217	PTJQIJIKDYGSPS-SECBINFHSA-N	222.288	1.054	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)CCO	779345788	CXXURTOKDXTTRC-GFCCVEGCSA-N	236.359	1.922	10	20	BDCD	
O=C(O)[C@H](CF)NCc1ccc2c(c1)CCO2	1608534149	QVZPNPGNFGKLHU-JTQLQIEISA-N	239.246	1.134	10	20	BDCD	
Cc1ccc(CNC[C@H]2CC[C@@H](N)C2)c(O)c1	1579696751	DAIOQJHSOXVDJU-WCQYABFASA-N	234.343	1.918	10	20	BDCD	
C[C@H](CN)NCc1ccc2c(c1)CCO2	162047238	YDEKOGOSGFVSJZ-SECBINFHSA-N	206.289	1.058	10	20	BDCD	
CNCCN(C)Cc1c(O)cccc1OC	843057479	OTOJQRBKIWXNLS-UHFFFAOYSA-N	224.304	1.052	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCCCO1	155440536	FNSYKGKTPRAZKL-ZDUSSCGKSA-N	249.310	1.920	10	20	BDCD	
COc1cccc(CNCCc2cn[nH]c2)c1O	379578387	DZPWRTWHDMCQCT-UHFFFAOYSA-N	247.298	1.456	10	20	BDCD	
C[C@H](O)C1CCN(c2ccc(N)cc2)CC1	235570109	TUYXPZJVVUMLKC-JTQLQIEISA-N	220.316	1.866	10	20	BDCD	
Cc1cccc(CN2CC[C@](C)(O)C2)c1O	180634017	CTPMXOPPLXSWTN-ZDUSSCGKSA-N	221.300	1.657	10	20	BDCD	
COc1cccc(CNC(=O)C2(C)CC2)c1O	131040532	BBASWIZYQVENPC-UHFFFAOYSA-N	235.283	1.817	10	20	BDCD	
CC[C@H](N[C@@H](C)C(=O)NC)c1ccccc1O	42560613	GMEZAELQMJKUES-ONGXEEELSA-N	236.315	1.567	10	20	BDCD	
CC[C@H](O)CN[C@@H](C)c1ccc(F)cc1O	229964454	FMWBNHUDXHVKFK-WPRPVWTQSA-N	227.279	1.953	10	20	BDCD	
CNCCN[C@H](C)c1ccc(F)cc1O	817952449	QAINUKMRODSFQO-MRVPVSSYSA-N	212.268	1.401	10	20	BDCD	
Cc1ccc([C@H](C)N[C@@H]2CCNC2)c(O)c1	817944587	HGRSXBNSDIXAFX-WDEREUQCSA-N	220.316	1.713	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCCN1CCC1	840937001	QFOWCPBQCJTCHA-UHFFFAOYSA-N	247.386	1.856	10	20	BDCD	
Cc1ccc(C(=O)NC2(C)CC2)c(O)c1O	1116518219	XOKNPFPLHQUDIV-UHFFFAOYSA-N	221.256	1.689	10	20	BDCD	
C[C@@H]1C[C@@H](N)CCN1Cc1ccc(N)cc1	1120268398	DHIPQJVDIYXVOU-MFKMUULPSA-N	219.332	1.580	10	20	BDCD	
CN1CCN(C(=O)c2ccc(CN=[N+]=[N-])o2)CC1	1537962262	BHOLHBPVDXQIEF-UHFFFAOYSA-N	249.274	1.478	10	20	BDCD	
Oc1ccc(F)cc1CNCCCn1ccnc1	83380706	XFQDVVNSLCCJLJ-UHFFFAOYSA-N	249.289	1.908	10	20	BDCD	
CCOC(=O)[C@H](C)NCc1ccc(C)cc1O	83364808	CGYBKLPAAKEFEC-JTQLQIEISA-N	237.299	1.742	10	20	BDCD	
Cc1cccc(CN[C@H]2CC(=O)N(C)C2)c1O	271905208	WMVLIPZLPGIOJP-NSHDSACASA-N	234.299	1.021	10	20	BDCD	
Nc1ccc(CNCC2(N)CCC2)cc1	1345160330	UKTLQGGYSIIOGI-UHFFFAOYSA-N	205.305	1.240	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1C[C@H]2CC[C@H]1O2	265000732	IMSVLRCSTZTZET-NTZNESFSSA-N	247.294	1.576	10	20	BDCD	
CC(C)[C@@H](O)CN[C@H]1CCc2cccc(O)c21	297613958	IREDGLKZDKQTQM-AAEUAGOBSA-N	235.327	1.986	10	20	BDCD	
CCOc1ccc(O)c(CN[C@@H](CC)CO)c1	186523725	ZBDBDWIWVYJSED-NSHDSACASA-N	239.315	1.651	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](C)[C@@H]2CO)c1O	191181110	NWQFSAFSAFKIFK-MFKMUULPSA-N	235.327	1.903	10	20	BDCD	
Cc1noc(C)c1/C=C1/SC(=S)NC1=O	254975478	RCXHHWZJJMCNCD-XVNBXDOJSA-N	240.309	1.780	10	20	BDCD	
CC(C)(CCO)NCc1ccc(N)cc1	1352790035	NJTCPZDUSOKTRR-UHFFFAOYSA-N	208.305	1.519	10	20	BDCD	
Cc1ccc(O)c(CN(C)CCOCCO)c1	800544825	GFDUTLLGRJEXIC-UHFFFAOYSA-N	239.315	1.141	10	20	BDCD	
COc1ccc(O)c(CNC/C=C/CO)c1	717547168	JWDISDQHUGQXGT-NSCUHMNNSA-N	223.272	1.039	10	20	BDCD	
Cc1cccc(CN2CC[C@H](C(=O)O)C2)c1O	821111942	CANWAXXWLMCYTK-NSHDSACASA-N	235.283	1.607	10	20	BDCD	
Cc1cccc(CN2CCC[C@@H](CN)C2)c1O	843047855	YXDQSABYJFGVLZ-LBPRGKRZSA-N	234.343	1.871	10	20	BDCD	
CC1=NO[C@H](CNC(=O)c2cc(O)cs2)C1	854804025	UAXHGKVFPZURQD-QMMMGPOBSA-N	240.284	1.348	10	20	BDCD	
CO[C@H](C(=O)NCc1cc(C)ccc1O)C1CC1	862756084	PKSKJTLAHUVQJC-ZDUSSCGKSA-N	249.310	1.742	10	20	BDCD	
C[C@H](NC[C@H]1C[C@@H](N)C1)c1ccccc1O	873252852	WNBKXIXRKZEJIZ-GARJFASQSA-N	220.316	1.780	10	20	BDCD	
Cc1ccc(CN(C)[C@@H](C)CCO)c(O)c1	877615533	SOWNAMNWWHHBIZ-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
[N-]=[N+]=NC1CN(Cc2cn3ccccc3n2)C1	409424559	VWVZDVPSNILHPN-UHFFFAOYSA-N	228.259	1.829	10	20	BDCD	
C[C@H](O)CN[C@@H](C)c1ccc(F)c(F)c1O	187813573	ONJAIXBLYYSIQM-BQBZGAKWSA-N	231.242	1.702	10	20	BDCD	
C[C@@H](N)[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1	126809202	IZIWIZHNIOPASS-TZMCWYRMSA-N	247.386	1.922	10	20	BDCD	
C[C@@H]1CCCN(Cc2ccccc2O)[C@@H]1CN	70175710	YSGNHAYMMQYRNB-DGCLKSJQSA-N	234.343	1.951	10	20	BDCD	
Oc1c(Cl)cccc1CN1CC[C@@H](O)C1	132489545	NRNVTRCCILYACX-SECBINFHSA-N	227.691	1.612	10	20	BDCD	
CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@H]1O	272038309	ZRIADYVQSWNTBG-DGCLKSJQSA-N	235.327	1.903	10	20	BDCD	
CC(C)NC(=O)COc1ccc(N(C)C)cc1	277705956	FSDSPXDSZQIPOJ-UHFFFAOYSA-N	236.315	1.656	10	20	BDCD	
CC(C)[C@@H](CO)CNC(=O)c1cc(O)cs1	807777358	OYYLYSUKBZAISH-MRVPVSSYSA-N	243.328	1.448	10	20	BDCD	
O=C(O)/C=C\c1ccc(N2CCC2)c([N+](=O)[O-])c1	384977656	MLPVJAGODSEREL-HYXAFXHYSA-N	248.238	1.903	10	20	BDCD	
CCC[C@H](CCO)NC(=O)c1cc(O)cs1	869869410	ZWSOZWVICMONQV-MRVPVSSYSA-N	243.328	1.735	10	20	BDCD	
Cc1ccc(CNCC2(CO)CC2)c(O)c1	877078546	UGBNBYLNKQJUJK-UHFFFAOYSA-N	221.300	1.563	10	20	BDCD	
Cc1ccc(CN2CCn3ncnc3C2)c(O)c1	877402775	IJOMKFXDHIIIMG-UHFFFAOYSA-N	244.298	1.308	10	20	BDCD	
COC(=O)C1(CNCc2ccc(C)cc2O)CC1	877425007	WLPOMYBDGFCOCW-UHFFFAOYSA-N	249.310	1.743	10	20	BDCD	
C[C@H](NC[C@H]1C[C@@H](O)C1)c1c(O)cccc1F	886643619	ZZHAMMLOZKIRTP-LPEHRKFASA-N	239.290	1.953	10	20	BDCD	
COc1cccc(CN(C)[C@@H](C)C(=O)O)c1O	86756460	ZIABDUVRLVYGDJ-QMMMGPOBSA-N	239.271	1.306	10	20	BDCD	
CC[C@@H](NCc1c(O)cccc1OC)[C@H](C)O	1325133329	PIVRNMDTXAPWHX-GXSJLCMTSA-N	239.315	1.650	10	20	BDCD	
C[C@H](CCO)NCc1cc(F)ccc1O	226610783	HIZCABKDXDERCD-MRVPVSSYSA-N	213.252	1.392	10	20	BDCD	
CO[C@H](C)CC(=O)N[C@H](C)c1ccccc1O	827930146	CUBFWMXOGNKDNW-NXEZZACHSA-N	237.299	1.994	10	20	BDCD	
COCCCN(CCO)Cc1ccccc1O	188934779	OJLWWLNESWHUEG-UHFFFAOYSA-N	239.315	1.223	10	20	BDCD	
COCCCNC(=O)c1ccc(C)c(O)c1O	177660657	VKQGEUIIYYXLOO-UHFFFAOYSA-N	239.271	1.173	10	20	BDCD	
COc1cccc(CN2CC[C@](C)(O)C2)c1O	180194990	DFIZANLURKSGNK-ZDUSSCGKSA-N	237.299	1.358	10	20	BDCD	
C[C@@H](CO)NCc1ccc(N(C)C)cc1	35603827	QYOVVUOICGPJHS-JTQLQIEISA-N	208.305	1.223	10	20	BDCD	
CCOC(=O)[C@@H](C)NCc1ccc2c(c1)CCO2	49371145	DTQPWKGTFMNQNM-SNVBAGLBSA-N	249.310	1.663	10	20	BDCD	
CCOc1ccc(O)c(CNC[C@@H](C)OC)c1	191146042	GESCZHJNVUUZIG-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
CCCCNC(=O)c1cccc(O)c1O	163268323	AGDDLDXGBPFMEJ-UHFFFAOYSA-N	209.245	1.628	10	20	BDCD	
C[C@@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1	841027707	VBJBMGKTYMWSFO-SECBINFHSA-N	247.298	1.076	10	20	BDCD	
Cc1ccc(C(=O)N2C[C@H]3C=C[C@H]2C3)c(O)c1O	922054250	ZLPJJJDJLLHGDG-UWVGGRQHSA-N	245.278	1.807	10	20	BDCD	
CNC[C@@H](C)NCc1cccc(OC)c1O	853248721	JDYRWGSAIPTUNW-SECBINFHSA-N	224.304	1.098	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C[C@@H](C(=O)O)C2)c1	874046526	BOTAWJIZEFLHNX-JGZJWPJOSA-N	235.283	1.653	10	20	BDCD	
COCC1CN(Cc2c(O)cccc2OC)C1	895971961	ZANGIXCWWKXFPX-UHFFFAOYSA-N	237.299	1.479	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H]2CCC[C@@]2(CO)C1	409426030	BUNABGWWLQANAR-UWVGGRQHSA-N	210.281	1.391	10	20	BDCD	
COc1cccc(O)c1CNC[C@H]1C[C@@H](O)C1	858295511	CFTQDZAOOHDEPX-AOOOYVTPSA-N	237.299	1.261	10	20	BDCD	
NC[C@@H](NCc1ccccc1O)C1CC1	841028765	REWWOTUJCLFAAY-LLVKDONJSA-N	206.289	1.219	10	20	BDCD	
C[C@H](NCc1ccccc1O)c1ncnn1C	788971523	KKPGNEZLROVCFV-VIFPVBQESA-N	232.287	1.372	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CCCC[C@H]2N)cc1	295112427	LTXGEMGHKKWKKU-CHWSQXEVSA-N	247.342	1.197	10	20	BDCD	
Cc1[nH]ncc1C(=O)NCc1ccccc1O	134789839	JGTAQNQZIDNYPU-UHFFFAOYSA-N	231.255	1.354	10	20	BDCD	
O=C(Cc1ccoc1)NCc1ccc(O)c(O)c1	184991382	YCRRJTZMDUVNQR-UHFFFAOYSA-N	247.250	1.550	10	20	BDCD	
COCCCCNC(=O)Cc1ccc(N)cc1	44654877	MFGXFWJMUPXNQB-UHFFFAOYSA-N	236.315	1.354	10	20	BDCD	
CCN1CCN(c2ccc(OC)c(F)c2)CC1	84866559	MKTNPJJOGDWQBV-UHFFFAOYSA-N	238.306	1.976	10	20	BDCD	
C[C@H]1NCC[C@@H]1C(=O)NCc1ccccc1O	228421975	SNSDKJUIOKJBOE-KOLCDFICSA-N	234.299	1.006	10	20	BDCD	
CN(Cc1ccn(C)n1)c1ccc2c(c1)OCO2	271891070	DWDYYMWDGVQQKS-UHFFFAOYSA-N	245.282	1.785	10	20	BDCD	
Cc1cccc(CN(C)CCC(=O)O)c1O	821112257	MTCRFFSDPNUHFR-UHFFFAOYSA-N	223.272	1.607	10	20	BDCD	
CCC(=O)N(CC(=O)O)Cc1ccccc1O	911483758	DDPPFFVYWBERTE-UHFFFAOYSA-N	237.255	1.215	10	20	BDCD	
Cc1cc(O)c(CN2CCC[C@H](N)C2)cc1C	843043844	KYSYDQWGRCJGLV-ZDUSSCGKSA-N	234.343	1.932	10	20	BDCD	
COC[C@@H](NC(=O)c1cc(O)cs1)C(C)C	743623054	VIWCVHPICCSUNG-SECBINFHSA-N	243.328	1.855	10	20	BDCD	
CC[C@@H](CO)N[C@H](C)c1c(O)cccc1F	886489733	POEJCEFRAIURLA-BDAKNGLRSA-N	227.279	1.953	10	20	BDCD	
C[C@@H](NC(=O)C[C@@H]1CCCN1)c1ccccc1O	870988073	FWQVTYRFTXPGIY-MNOVXSKESA-N	248.326	1.712	10	20	BDCD	
C[C@@]1(C(=O)Nc2ccc(N)cc2)CCOC1	687360616	JBCLRUCRHOPVDS-GFCCVEGCSA-N	220.272	1.634	10	20	BDCD	
COc1cccc(CNC[C@H]2C[C@H](O)C2)c1O	720947370	NVLJHVVCVVCAMS-HOMQSWHASA-N	237.299	1.261	10	20	BDCD	
COc1ccc(CNCC2=CCCOC2)c(O)c1	379743947	YRKCLMNNDVHDHX-UHFFFAOYSA-N	249.310	1.837	10	20	BDCD	
COC1(C(=O)NCc2ccc(N)cc2)CCC1	297120608	GMZSCGYWADEXLU-UHFFFAOYSA-N	234.299	1.454	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@H]1N	251658209	GTFRCGNUOGDCCG-SWLSCSKDSA-N	247.386	1.922	10	20	BDCD	
C[C@H](Cn1cncn1)N[C@H](C)c1ccccc1O	272864230	NLFPUZFQVHALLO-GHMZBOCLSA-N	246.314	1.723	10	20	BDCD	
CCCN(Cc1c[nH]nn1)Cc1ccccc1O	295142132	ZSCSCFPCTMJGFA-UHFFFAOYSA-N	246.314	1.923	10	20	BDCD	
CN(C)c1ccc(CNCCCON)cc1	904456776	LFEXWCURKGUEPQ-UHFFFAOYSA-N	223.320	1.123	10	20	BDCD	
Cc1cccc(CNCC(F)(F)CN)c1O	841060377	XHJIJXDZBJHXBT-UHFFFAOYSA-N	230.258	1.384	10	20	BDCD	
Cc1cccc(CNCCCC(=O)O)c1O	165152085	QPZGZKFMLVBINF-UHFFFAOYSA-N	223.272	1.655	10	20	BDCD	
Cc1ccc(CNC[C@@H]2CCOC2)c(O)c1	876930128	LVUHOSLKDNYDNH-NSHDSACASA-N	221.300	1.827	10	20	BDCD	
CC[C@H]1C(=O)NCCN1Cc1ccc(C)cc1O	876686041	NRPMTUJUZYKKJV-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CNC1CC1	37823779	RFXSRQHRGRHXBM-UHFFFAOYSA-N	234.299	1.103	10	20	BDCD	
CN(Cc1cn(C)cn1)Cc1ccccc1O	788018966	IFCJPCJPRXYPPV-UHFFFAOYSA-N	231.299	1.758	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2C[C@H](OC)C2)c1	706508870	XZUTZPOAOYIWRU-UMSPYCQHSA-N	237.299	1.668	10	20	BDCD	
CO[C@@H]1COC[C@@H]1NCc1cccc(C)c1O	839193118	PKIGNLWPLWGNRP-NWDGAFQWSA-N	237.299	1.204	10	20	BDCD	
COC[C@H]1CN(C(=O)CN=[N+]=[N-])CC1(C)C	409433313	MNIIXJXMIFEFCR-MRVPVSSYSA-N	226.280	1.428	10	20	BDCD	
C[C@H](O)CCN(C)Cc1ccc(N)cc1	130957212	SJVDMPHYXXSQHV-JTQLQIEISA-N	208.305	1.472	10	20	BDCD	
CCCN(Cc1ccccc1O)C[C@H](C)N	843358439	QHVPDIINLWLDOE-NSHDSACASA-N	222.332	1.951	10	20	BDCD	
CC[C@H](N)CNCc1cc(C)c(C)cc1O	841073577	ZZFNVUUHVMCYRV-LBPRGKRZSA-N	222.332	1.836	10	20	BDCD	
COc1ccc(CNC(=N)NC(C)C)c(O)c1	849024821	BFIOYJVDHPDODV-UHFFFAOYSA-N	237.303	1.423	10	20	BDCD	
CC(=O)N[C@@H]1CCN(Cc2c(C)cccc2O)C1	877594987	PADZZHIBWSENRI-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H](O)C1CC1	877526505	SAZGLVUEWSUZTL-ZDUSSCGKSA-N	221.300	1.561	10	20	BDCD	
CC[C@@H](O)CN[C@H](C)c1c(O)cccc1F	886637607	ARFGLWKKSSLAET-RKDXNWHRSA-N	227.279	1.953	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2CCOC2=O)cc1C	895801842	UCQJLNDXROQORG-NSHDSACASA-N	235.283	1.414	10	20	BDCD	
CCOC[C@H]1CCCN(C(=O)CN=[N+]=[N-])C1	409431582	SQHDCKXWPMHTLA-VIFPVBQESA-N	226.280	1.572	10	20	BDCD	
CC(C)C[C@@H](CN)NCc1ccc(N)cc1	1334754244	MSOWUDXMPLRXJC-ZDUSSCGKSA-N	221.348	1.732	10	20	BDCD	
C[C@@H](N)[C@H]1CCN(Cc2ccc(N)cc2)C1	1334753481	FFHYEKMCJBSBQH-PWSUYJOCSA-N	219.332	1.438	10	20	BDCD	
OC[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)C1	923006879	HASTWMPDKWMTNL-AULYBMBSSA-N	233.311	1.482	10	20	BDCD	
CCOC[C@@H](O)CN(C)c1ccc(OC)cc1	8697957	OJKOIRSDZJIVPF-LBPRGKRZSA-N	239.315	1.529	10	20	BDCD	
Cc1ccc(C(=O)N2CCC2)c(O)c1O	181788934	UWZQQKOCHHIQOG-UHFFFAOYSA-N	207.229	1.252	10	20	BDCD	
CC[C@H](N[C@H](C)CO)c1ccc(F)cc1O	285960511	GPDUZKMPVIDDQG-KCJUWKMLSA-N	227.279	1.953	10	20	BDCD	
COc1ccc(O)c(CN(C)C[C@@H](C)O)c1	130695426	NTARVJUBXJIWQJ-SECBINFHSA-N	225.288	1.213	10	20	BDCD	
C[C@H](CN)N(C)Cc1cc(F)ccc1O	383004249	YPRMLWUEURWVTI-MRVPVSSYSA-N	212.268	1.310	10	20	BDCD	
C[C@@H](NC(=O)C[C@@H]1CCOC1)c1ccccc1O	827937120	LIGQNYJJKFIONR-MNOVXSKESA-N	249.310	1.996	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCc2cnon2)c1	851902827	SYZDKRXSIBSECR-QMMMGPOBSA-N	249.270	1.635	10	20	BDCD	
OCCNCc1ccc(Br)cc1O	691394046	YZOFBLNWCFUQJM-UHFFFAOYSA-N	246.104	1.237	10	20	BDCD	
CNC[C@@H](C)N[C@@H](C)c1cc(C)ccc1O	854233095	XMEXQAOZVZJPAM-MNOVXSKESA-N	222.332	1.959	10	20	BDCD	
Cc1cccc(O)c1CNCC(=O)NCC1CC1	877167404	WRVJOMDSCWDKJP-UHFFFAOYSA-N	248.326	1.316	10	20	BDCD	
COc1cccc(CNCc2ocnc2C)c1O	894764204	DMGTVUYTHLKHFR-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
CN[C@@H](C)CCNCc1ccc(N)cc1	1335290455	XQHCFUZRVFWBHK-JTQLQIEISA-N	207.321	1.356	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@H]1CCC[C@@H]1O	689861246	JJKUXYAEPRIDKJ-OCCSQVGLSA-N	234.343	1.862	10	20	BDCD	
CCn1ncnc1CN[C@H](C)c1ccccc1O	785773583	DYLPEUDWCJIMEV-SNVBAGLBSA-N	246.314	1.854	10	20	BDCD	
CC[C@H](CO)N(C)C(=O)Nc1ccc(N)cc1	379128596	ZUBSJJBDRDHOSH-LLVKDONJSA-N	237.303	1.503	10	20	BDCD	
COc1ccc(N2CCC(NC(N)=O)CC2)cc1	170671920	IRTFGFXUWWWQHX-UHFFFAOYSA-N	249.314	1.332	10	20	BDCD	
CCN(C)C(=O)CNCc1cc(C)ccc1O	185178332	ATECIAVLPYYLGG-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H]1CCOC1	226584601	YMIMDYNEPBIDNY-VIFPVBQESA-N	225.263	1.657	10	20	BDCD	
CC[C@](C)(CO)NCc1cc(F)ccc1O	226619123	PLQSBDDYTAHZHJ-GFCCVEGCSA-N	227.279	1.782	10	20	BDCD	
COCC[C@H](CO)N[C@@H](C)c1ccccc1O	281541127	IQXSFCLNWLHEFE-WDEREUQCSA-N	239.315	1.440	10	20	BDCD	
C[C@H](NC[C@H](C)CN)c1ccccc1O	817961786	CHXFIXBAVWZMKV-ZJUUUORDSA-N	208.305	1.638	10	20	BDCD	
CN1CC[C@@H]1CNCc1cc(Cl)ccc1O	712569758	CFEDBZDGEAIKGZ-LLVKDONJSA-N	240.734	1.839	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCC2CNC2)c1	817965388	PWCHNBBLLQLKIZ-JTQLQIEISA-N	220.316	1.571	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC1=NC[C@H](C)N1	849009172	IBNDGDFVFWUHBV-NSHDSACASA-N	246.358	1.498	10	20	BDCD	
Cc1cc(O)c(CNC[C@@H](C)CN)cc1C	841049162	NSYAIFODCBSVCW-VIFPVBQESA-N	222.332	1.693	10	20	BDCD	
CNC[C@H](C)NCc1cc(Cl)cc(F)c1O	853248926	LWPLZPMVZQXKGJ-ZETCQYMHSA-N	246.713	1.882	10	20	BDCD	
CCN1CCN(Cc2c(C)cccc2O)CC1=O	877339845	HDKPFMZGYIRSQU-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
CCc1cccc(CNC[C@H]2COCO2)c1O	894885751	SFOHASRTSAQEOO-LBPRGKRZSA-N	237.299	1.417	10	20	BDCD	
O=C(C[C@H]1CCCOC1)NCc1ccccc1O	793681831	PNTPISFZNIRVLY-LLVKDONJSA-N	249.310	1.825	10	20	BDCD	
NCCCCCCNCc1ccc(N)cc1	1334754675	QYZKLVVKLBGEKH-UHFFFAOYSA-N	221.348	1.878	10	20	BDCD	
CCO[C@@H](C)C(=O)NCCc1ccc(N)cc1	152570417	ICYOVDXCPSHWIK-JTQLQIEISA-N	236.315	1.353	10	20	BDCD	
C[C@H](N)C(=O)NCCCSc1nccs1	160058717	HFDRHWIGEKJJRT-ZETCQYMHSA-N	245.373	1.089	10	20	BDCD	
COc1cccc(CNCCCCCO)c1O	83367179	SHDUTMMWHVWHRR-UHFFFAOYSA-N	239.315	1.653	10	20	BDCD	
COc1cccc(CN(C)C[C@H](C)N)c1O	380612470	YPYVYROCJPJDLX-VIFPVBQESA-N	224.304	1.180	10	20	BDCD	
Cc1ccc(CN2CCN(C)CC2)c(O)c1	258232705	YUPBKLBVZXHXQL-UHFFFAOYSA-N	220.316	1.448	10	20	BDCD	
Oc1ccccc1CN1CC[C@@H](n2cncn2)C1	364506964	HHSNOSAITZGYSQ-GFCCVEGCSA-N	244.298	1.431	10	20	BDCD	
CC[C@@H](N)CN[C@@H](C)c1ccc(F)cc1O	817980962	YOMMZIUDLFVWSL-WCBMZHEXSA-N	226.295	1.919	10	20	BDCD	
CN(C)c1ccc(CN2CC3(CCOC3)C2)cc1	816671641	DJSRWDGUOPGSDX-UHFFFAOYSA-N	246.354	1.975	10	20	BDCD	
NOCCCNCc1cc(Cl)cc(F)c1O	904457867	UJMOLZMDFPHRHQ-UHFFFAOYSA-N	248.685	1.555	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CCCNC2)c1	841042260	HQOPMCQRAFBVIG-NSHDSACASA-N	236.315	1.242	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CC23CCNCC3)c1	841078753	KBAJKYSVMOODHJ-CQSZACIVSA-N	246.354	1.932	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2C[C@H](O)C2)cc1C	850417727	JKRHPOMMXPYHDD-HAQNSBGRSA-N	221.300	1.622	10	20	BDCD	
Cc1ccncc1/C=C\C(=O)N(C)c1cn[nH]c1	752503536	SNPHNDJSKZJVAH-ARJAWSKDSA-N	242.282	1.789	10	20	BDCD	
CC[C@H](CO)C(=O)NCc1cc(C)ccc1O	862757240	MPGRXVXWLCUXAP-SNVBAGLBSA-N	237.299	1.335	10	20	BDCD	
CC(C)C[C@H](N)C(=O)N(C)c1ccc(N)cc1	877078704	ACYQFMHMKFKZNP-LBPRGKRZSA-N	235.331	1.605	10	20	BDCD	
CCC1(C(=O)N(C)c2ccc(N)cc2)COC1	877078354	NFJGZZPMLTZEHD-UHFFFAOYSA-N	234.299	1.658	10	20	BDCD	
CC[C@@H](C)C[C@H](N)C(=O)N(C)c1ccc(N)cc1	1122172277	BLIHYHPTGDYKMA-MFKMUULPSA-N	249.358	1.995	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@H]2C=C[C@H]1C2	882420812	NIBYMGNEQLLEJE-YUMQZZPRSA-N	221.281	1.854	10	20	BDCD	
Cc1ccc(CN2CC[C@@](C)(C(=O)O)C2)c(O)c1	1605273266	STUFFWKZVKMMSM-CQSZACIVSA-N	249.310	1.997	10	20	BDCD	
CN(C)c1ccc(CN2C[C@@H]3C[C@@]3(CO)C2)cc1	783740117	JDLWQTDMQBYNBL-ZFWWWQNUSA-N	246.354	1.567	10	20	BDCD	
CCN1CCN(Cc2ccccc2O)C[C@@H]1C	211385424	NHNRZMHLKUOKDS-LBPRGKRZSA-N	234.343	1.918	10	20	BDCD	
Oc1ccccc1CN1CC[C@@H]2NCC[C@H]2C1	383862447	ODYOVAZMJFDTFD-AAEUAGOBSA-N	232.327	1.576	10	20	BDCD	
Oc1cc(Cl)ccc1CN1CCCNCC1	1204667463	LNIYXAMCBBBJPN-UHFFFAOYSA-N	240.734	1.841	10	20	BDCD	
Oc1ccccc1CNCCCn1cccn1	134479791	MAKDPGAINVREMW-UHFFFAOYSA-N	231.299	1.769	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@@H](N)C2)cc1	20215727	PWDDGNYRIOGBQC-CYBMUJFWSA-N	233.359	1.676	10	20	BDCD	
NCCCCCC(=O)NCc1ccccc1O	83363599	RSIBNGKWUXRXHC-UHFFFAOYSA-N	236.315	1.528	10	20	BDCD	
CN(C)c1ccc(OCC(=O)NC2CC2)cc1	277866003	ORGJGFRWGPHTBA-UHFFFAOYSA-N	234.299	1.410	10	20	BDCD	
COc1ccc(O)c(CNC(=O)CCCF)c1	830543693	BLSKDCHDCXZYDV-UHFFFAOYSA-N	241.262	1.767	10	20	BDCD	
Cc1[nH]nc(C(=O)NCc2ccccc2O)c1O	749221342	GAGLWSUBOJFGPO-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
C/C=C/C=C\C(=O)NCc1ccc(O)c(O)c1	778929527	MPOFJHQZUHOLEL-IAROGAJJSA-N	233.267	1.846	10	20	BDCD	
CS[C@H](C)C(=O)N(C)c1ccc(N)cc1	877079886	AKBACCRHNUQCHP-MRVPVSSYSA-N	224.329	1.983	10	20	BDCD	
Cc1ccc(CNCc2nonc2C)c(O)c1	877527589	TXNPUJFYGTWESO-UHFFFAOYSA-N	233.271	1.682	10	20	BDCD	
Cn1nccc1NC(=O)NCc1ccccc1O	775752159	DCTMMZMTEYTWSE-UHFFFAOYSA-N	246.270	1.447	10	20	BDCD	
Cc1noc(C)c1C(=O)N1CC(N=[N+]=[N-])C1	409424936	ZPJGPFPRHUXUMU-UHFFFAOYSA-N	221.220	1.426	10	20	BDCD	
CC1(C)CCN[C@H]1C(=O)NCc1ccc(N)cc1	1515331023	CTKGKQKEYBJHQA-LBPRGKRZSA-N	247.342	1.273	10	20	BDCD	
CCOc1cccc(CNCCCCO)c1O	193282975	SFOMVONLTQGYRB-UHFFFAOYSA-N	239.315	1.653	10	20	BDCD	
CN(Cc1cnn(C)n1)Cc1ccccc1O	289396437	RUGCFOYFMRNXKP-UHFFFAOYSA-N	232.287	1.153	10	20	BDCD	
COc1ccc(O)c(CN(C)C[C@H](C)OC)c1	289649715	MTLAAJYCEUUOGK-JTQLQIEISA-N	239.315	1.868	10	20	BDCD	
Cc1ccc(O)c(CN2CCC3(C2)OCCO3)c1	93013629	DCADHMAVYBVKCP-UHFFFAOYSA-N	249.310	1.649	10	20	BDCD	
CN(C)C(=O)COc1ccc(N2CCCC2)cc1	289342226	GDUPOWDDVNNMDC-UHFFFAOYSA-N	248.326	1.754	10	20	BDCD	
C[C@H](NC[C@H](C)CN)c1cc(F)ccc1O	817962470	MTBXEYZVGZKRDF-BDAKNGLRSA-N	226.295	1.777	10	20	BDCD	
CCc1cccc(CNC[C@@H](C)O)c1O	691458860	DHEQMZUQXNPGQX-SECBINFHSA-N	209.289	1.425	10	20	BDCD	
Cc1ccc(CN[C@@H](C)c2n[nH]c(C)n2)c(O)c1	894779234	XGVDRMGAABLHNE-VIFPVBQESA-N	246.314	1.978	10	20	BDCD	
COc1cccc(O)c1CNCc1cn(C)cn1	898045036	GNEKFQMLVFPZCE-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2CCCCN2)cc1	169815800	PSLDNPMCGZJEGE-LBPRGKRZSA-N	233.315	1.027	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](C)C(=O)O)cc1Cl	1574697211	GGSAQLNJDXUXAH-ZETCQYMHSA-N	243.690	1.917	10	20	BDCD	
CN(C)C(=O)[C@H]1CCN(Cc2ccccc2O)C1	840958745	UKOFZNOOHIXRRG-LBPRGKRZSA-N	248.326	1.302	10	20	BDCD	
O=C(O)C1CN(Cc2cc(F)ccc2O)C1	236417834	GWDSUTSYMUSBPK-UHFFFAOYSA-N	225.219	1.048	10	20	BDCD	
OC[C@@]1(F)CCCN(Cc2ccccc2O)C1	289701960	GBVGPCAJCKXSLW-CYBMUJFWSA-N	239.290	1.689	10	20	BDCD	
CCN(CC(N)=O)c1ccc(OC)cc1	299363188	JFVCGSNHYKVBQD-UHFFFAOYSA-N	208.261	1.007	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@@H](O)C2)cc1F	294775183	GIDDLBATGHDPAM-PHIMTYICSA-N	238.306	1.505	10	20	BDCD	
Cc1cccc(O)c1CNCC(=O)NC(C)C	876881160	CMOSOTOOYZENCV-UHFFFAOYSA-N	236.315	1.315	10	20	BDCD	
COc1cccc(O)c1CN1CCC[C@@H](O)C1	768141392	ZSUNBYHWTVMPIE-SNVBAGLBSA-N	237.299	1.358	10	20	BDCD	
C[C@@H]1CN(C(=O)c2cc(O)cs2)CC[C@H]1O	779462843	VYIVQOKOTYPAQJ-VXNVDRBHSA-N	241.312	1.297	10	20	BDCD	
C[C@H](NC(=O)CN(C)C)c1ccc(N(C)C)cc1	776270080	PIWHOGOYCLIERJ-NSHDSACASA-N	249.358	1.491	10	20	BDCD	
CN(CCc1cnn(C)c1)Cc1ccccc1O	77284319	CUMQLTLRFWWDLX-UHFFFAOYSA-N	245.326	1.800	10	20	BDCD	
CC(C)[C@H](CO)CNCc1ccc2c(c1)CCO2	259007381	OHSALQUDCMTRSX-AWEZNQCLSA-N	249.354	1.976	10	20	BDCD	
CCNC(=O)CN(C)c1ccc(OC)cc1	844353529	QVBSMVQDDXQRIX-UHFFFAOYSA-N	222.288	1.268	10	20	BDCD	
COC[C@@H](CO)NCc1ccc(OC)c(C)c1	234871369	XKLFFSVHHRQAQA-GFCCVEGCSA-N	239.315	1.101	10	20	BDCD	
C[C@H](N)[C@H](C)C(=O)Nc1ccc(N)cc1	294873983	CQOFXJYUUJXALP-YUMQZZPRSA-N	207.277	1.191	10	20	BDCD	
C[C@@H](NC(=O)CC(C)(C)O)c1ccccc1O	827946273	CDRIJMOHVKJBPS-SECBINFHSA-N	237.299	1.730	10	20	BDCD	
Nc1ccc(NC(=O)c2cnsn2)cc1	59974213	UQMHGKJHNGKSSD-UHFFFAOYSA-N	220.257	1.373	10	20	BDCD	
CNCCN(C)Cc1ccc(N(C)C)cc1	69801109	UFAOBDOKWOZOFI-UHFFFAOYSA-N	221.348	1.404	10	20	BDCD	
CC[C@@H](COC)NCc1cccc(OC)c1O	79735375	CVQYPTGWSQBTSH-NSHDSACASA-N	239.315	1.915	10	20	BDCD	
CCOC(=O)CSc1ncc(C(=O)O)s1	379992469	YILCACDKBUBUDK-UHFFFAOYSA-N	247.297	1.497	10	20	BDCD	
COc1cccc(CN[C@H](C)CF)c1O	288453170	NEIJHCZCFNQQMJ-MRVPVSSYSA-N	213.252	1.848	10	20	BDCD	
COCCCNCc1ccc(C)cc1O	83345877	NBBSVGRSBOUHNQ-UHFFFAOYSA-N	209.289	1.827	10	20	BDCD	
CC[C@H](C)CONC(=O)c1cccc(O)c1O	293675720	IYLYAOBSFZHROZ-QMMMGPOBSA-N	239.271	1.805	10	20	BDCD	
N[C@@H]1CCCC[C@H]1NCc1cccc(F)c1O	818431507	OUINTLFLLVMSDX-VXGBXAGGSA-N	238.306	1.891	10	20	BDCD	
C[C@H]1NCC[C@@H]1C(=O)Nc1ccc(N)cc1	832244144	LWHABRWHCIXCKS-KCJUWKMLSA-N	219.288	1.205	10	20	BDCD	
COc1cccc(O)c1CN[C@H](C)C[C@H](C)N	843126781	ADLVKWBAOSNCEB-VHSXEESVSA-N	238.331	1.616	10	20	BDCD	
Nc1ccc(NC(=O)N[C@@H]2CCCC[C@H]2O)cc1	52010808	FFNRIXXLWKAFDI-VXGBXAGGSA-N	249.314	1.694	10	20	BDCD	
CCO[C@@H]1CN(c2ccc(N)cc2)C[C@@H]1OC	409432747	LTYRVCWUHFJDOP-QWHCGFSZSA-N	236.315	1.509	10	20	BDCD	
CCOC[C@H]1CN(C(=O)CN=[N+]=[N-])CC1(C)C	409433523	MWVGGXUMKSUCGN-SECBINFHSA-N	240.307	1.818	10	20	BDCD	
CCc1cccc(CNC[C@@H]2CCN2C)c1O	712580655	NRHUCDKOCNGBBD-ZDUSSCGKSA-N	234.343	1.748	10	20	BDCD	
CC[C@H](NCc1cc(F)cc(F)c1O)C(=O)O	1331981051	ANBZVYGKDDBTPF-VIFPVBQESA-N	245.225	1.623	10	20	BDCD	
O=C1CCC(NC(=O)c2cc(O)cs2)CC1	1339809118	WZLKJGAYRDTIGC-UHFFFAOYSA-N	239.296	1.695	10	20	BDCD	
Nc1ccc(CN2CCC[C@@]23CCOC3=O)cc1	1352790011	MYIQYAKGQVXBPE-AWEZNQCLSA-N	246.310	1.550	10	20	BDCD	
CNCCCNCc1cc(F)cc(F)c1O	1578691569	QHPFZQJCFOEHEX-UHFFFAOYSA-N	230.258	1.370	10	20	BDCD	
CN(C/C=C\C(=O)O)c1ccc2c(c1)OCCO2	1777053898	NEQLCKYGPJFZMS-IHWYPQMZSA-N	249.266	1.535	10	20	BDCD	
CC[C@@H](O)CNc1ccccc1OCCOC	819423421	BIPRTQFHCQSKPO-LLVKDONJSA-N	239.315	1.895	10	20	BDCD	
C[C@@H]1OCCN(C(=O)Nc2ccc(N)cc2)[C@@H]1C	380584702	ZHTRAVQSTHUXEM-ZJUUUORDSA-N	249.314	1.910	10	20	BDCD	
CN(C[C@@H]1CCCN1)c1ccc2c(c1)OCO2	211259386	NIAOKNNEIDDLLM-JTQLQIEISA-N	234.299	1.604	10	20	BDCD	
OCCOCCCNCc1cc(F)ccc1O	227521883	KWVSKAZJQUAIBU-UHFFFAOYSA-N	243.278	1.020	10	20	BDCD	
COc1c([N+](=O)[O-])ccc(CNC2CC2)c1O	278941386	XTMOLTDEFIGHDJ-UHFFFAOYSA-N	238.243	1.561	10	20	BDCD	
C[C@H](N)CN[C@@H](C)c1cc(F)ccc1O	817972764	OIOFJEYESTZWBM-YUMQZZPRSA-N	212.268	1.529	10	20	BDCD	
C[C@@H]1[C@H](O)CCN1Cc1ccc(N(C)C)cc1	825104236	RPYLZZLAVDKAQX-BXUZGUMPSA-N	234.343	1.708	10	20	BDCD	
CCOC(=O)CCNC(=O)c1cc(O)cs1	731871081	DDIIHYNHAJRYLF-UHFFFAOYSA-N	243.284	1.137	10	20	BDCD	
CNC[C@@H]1C[C@H](F)CN1Cc1ccccc1O	843121696	HPBRANHVWCYTIR-RYUDHWBXSA-N	238.306	1.524	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](C)CN)cc1C	841063906	SJSIAVBQSAWRRJ-JTQLQIEISA-N	208.305	1.446	10	20	BDCD	
CC[C@H](C(=O)N(C)c1ccc(N)cc1)N(C)C	877074783	SGZGGMVSSCYVGI-GFCCVEGCSA-N	235.331	1.572	10	20	BDCD	
OC[C@H]1CCCN1Cc1cc(F)cc(F)c1O	893921909	UICNSRJYJCSGPB-SNVBAGLBSA-N	243.253	1.627	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC1CSC1	708391605	WQWQASRCIXFRQM-UHFFFAOYSA-N	231.267	1.875	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)C(=O)O	1350609904	BXAVBKMIZIMXHU-JTQLQIEISA-N	236.315	1.624	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)C[S@@](C)=O)c1	164301496	VZIPTOJJZANOFJ-HWPZZCPQSA-N	241.356	1.557	10	20	BDCD	
C[C@H](O)CCN(C)Cc1ccc(N(C)C)cc1	93481031	NDNYJFMWWHWMSU-LBPRGKRZSA-N	236.359	1.955	10	20	BDCD	
C[C@H](CCO)NCc1ccc2c(c1)CCCO2	921762902	RJIRSEWUACXDPZ-LLVKDONJSA-N	235.327	1.872	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H](CN)C2)c1	71409464	FUISIVHWNWOGCB-GFCCVEGCSA-N	234.343	1.871	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cc(OC)ccc1O	42303736	PDQYPGGMMFCVSV-MRVPVSSYSA-N	239.271	1.052	10	20	BDCD	
C[C@H]1NCCN(Cc2ccc(N(C)C)cc2)[C@@H]1C	379472683	SYFZBMOIWSHATP-CHWSQXEVSA-N	247.386	1.935	10	20	BDCD	
COc1ccc(CNC[C@H](C)CO)cc1C	88195388	JMIMDAZBEVMVEV-JTQLQIEISA-N	223.316	1.722	10	20	BDCD	
CN1CCN(Cc2cc(F)ccc2O)CC1	139745933	PSCPIMOPTIOHAF-UHFFFAOYSA-N	224.279	1.279	10	20	BDCD	
COC[C@@H]1CN(Cc2ccccc2O)CCO1	179577470	NAZONRWAQRCMCL-LBPRGKRZSA-N	237.299	1.239	10	20	BDCD	
Oc1ccccc1CNCCCNC1CC1	382586378	UECVKKKKORRLAS-UHFFFAOYSA-N	220.316	1.624	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@@H](C)CN)c(O)c1	817970078	KXZSUOZHJSOMTJ-VHSXEESVSA-N	208.305	1.698	10	20	BDCD	
CCO[C@@H](C)C(=O)NCc1ccc(O)cc1O	910951651	KIMRGNGBGOCGGG-QMMMGPOBSA-N	239.271	1.139	10	20	BDCD	
CC[C@H](NCc1cc(Cl)ccc1O)C(=O)O	843038305	GGUIOSZPTNEKSY-VIFPVBQESA-N	243.690	1.998	10	20	BDCD	
C[C@H](N[C@H](CO)CCF)c1cc(F)ccc1O	846208312	IGFCZLBSEFVSLV-WPRPVWTQSA-N	245.269	1.902	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C[C@H]2CCCO2)c1	862755247	PQQZDJHXMVLHEA-GFCCVEGCSA-N	249.310	1.886	10	20	BDCD	
CCOC(=O)CCN[C@H](C)c1ccccc1O	45686356	OFZIKMNGZGLTAN-SNVBAGLBSA-N	237.299	1.996	10	20	BDCD	
COc1cccc(CNCc2cn(C)cn2)c1O	898045240	JUNOXILWPARAFD-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)[C@H](C)CN1	86466778	WHXKGXMNJSTLIV-CHWSQXEVSA-N	247.386	1.935	10	20	BDCD	
CO[C@H]1CN(CCN=[N+]=[N-])C[C@@H]1n1cccn1	409432638	LMIXWTZHWZQMRA-UWVGGRQHSA-N	236.279	1.065	10	20	BDCD	
Nc1ccc(NC(=O)CCOCC(F)F)cc1	122423529	MUBJNMOXCCJIEC-UHFFFAOYSA-N	244.241	1.879	10	20	BDCD	
CCOc1ccc(CNC[C@H](C)CN)c(O)c1	841048556	KCMMSYVSLUKKKG-SNVBAGLBSA-N	238.331	1.475	10	20	BDCD	
COc1ccc(CNCC(F)(F)CN)cc1C	841059432	DAGILALQIDSULF-UHFFFAOYSA-N	244.285	1.687	10	20	BDCD	
CC1(CNCc2ccccc2O)CCNCC1	841056306	DQIJMVYBKJHZMH-UHFFFAOYSA-N	234.343	1.872	10	20	BDCD	
CCOc1ccc(CN(C)CCNC)c(O)c1	843057717	RVXMEIFOUHMKNF-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
CC[C@H](C(=O)O)N(C)Cc1cccc(F)c1O	844938523	VJERCQJMMANBPS-SNVBAGLBSA-N	241.262	1.826	10	20	BDCD	
CC(C)[C@H](CN)CNc1ccc(N)cc1	873210572	KGPWTIFSUFGIND-SNVBAGLBSA-N	207.321	1.912	10	20	BDCD	
Cc1noc(C)c1CN1CC(N=[N+]=[N-])C1	409424590	WQCMLPKPXQDEMH-UHFFFAOYSA-N	207.237	1.786	10	20	BDCD	
O=C(O)[C@@H](CF)NCc1c(O)cccc1Cl	1601648560	CUUQCBDGYSILCB-MRVPVSSYSA-N	247.653	1.558	10	20	BDCD	
CCCN[C@H](C)c1cccc(-c2nn[nH]n2)c1O	1590637871	HKCFAFYUKJQAOV-MRVPVSSYSA-N	247.302	1.633	10	20	BDCD	
Cc1noc(CCC(=O)Nc2ccc(N)cc2)n1	701092811	HIRJZXSJBYGWGN-UHFFFAOYSA-N	246.270	1.532	10	20	BDCD	
CC[C@H](N[C@@H](C)c1ccccc1O)C(=O)O	1603955103	NPDLWPQGACLQKJ-WPRPVWTQSA-N	223.272	1.906	10	20	BDCD	
CSC[C@H](O)CN(C)Cc1ccccc1O	188058295	PIDAIOCMMSKTKQ-LLVKDONJSA-N	241.356	1.548	10	20	BDCD	
CNC(=O)[C@@H]1CCCCN1Cc1ccccc1O	133042497	BBMNPYSGKVEWLD-LBPRGKRZSA-N	248.326	1.493	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)C[C@@H](C)O)c1	228086003	ZFMRZCCVIVUSTI-VHSXEESVSA-N	239.315	1.650	10	20	BDCD	
CCN(CC(=O)O)Cc1cc(Cl)ccc1O	83410664	WBHVSNBBECAPOO-UHFFFAOYSA-N	243.690	1.952	10	20	BDCD	
C[C@@H](CO)CCCNCc1ccccc1O	230161385	KHWLMAUGZHFKHA-LLVKDONJSA-N	223.316	1.890	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)[C@@H](C)O	270765821	GRKWACMOFSBANR-SNVBAGLBSA-N	237.299	1.512	10	20	BDCD	
C[C@](O)(CC(=O)NCc1ccccc1O)C1CC1	270021343	AMKAGZOKTDRSRX-AWEZNQCLSA-N	249.310	1.560	10	20	BDCD	
CC1(C)CNC(=O)CN1Cc1ccccc1O	282707383	KFYOTGHQMHCWKI-UHFFFAOYSA-N	234.299	1.103	10	20	BDCD	
NC[C@@H](N[C@@H]1CCc2cccc(O)c21)C1CC1	817960267	LHBYWTJRECOYTK-VXGBXAGGSA-N	232.327	1.706	10	20	BDCD	
Cc1ccc(O)c(CN(C)Cc2cn(C)nn2)c1	827305149	NZLTWMPUPBWZIV-UHFFFAOYSA-N	246.314	1.461	10	20	BDCD	
COc1ccc(CN[C@H](CN)C2CC2)cc1C	841027385	AOKURCHYOSPRMF-CYBMUJFWSA-N	234.343	1.831	10	20	BDCD	
CSC[C@@H](O)CN(C)c1ccc(N)cc1	923401861	YLSMUGCXJHBFNF-NSHDSACASA-N	226.345	1.429	10	20	BDCD	
[N-]=[N+]=NCCN1CCN(C[C@H]2CCCO2)CC1	409427150	JSGKQVRGUQSXGQ-LLVKDONJSA-N	239.323	1.093	10	20	BDCD	
Nc1ccc(OC2CN(C(=O)C3CC3)C2)cc1	409427605	WKELYQZEEIDTEX-UHFFFAOYSA-N	232.283	1.268	10	20	BDCD	
CCOC(=O)[C@@H](NCc1ccc(N)cc1)C1CC1	1336285203	JAZFJRIPXOBGRC-ZDUSSCGKSA-N	248.326	1.700	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC(C(=O)O)C1	1605187437	XMYVWXKTWAQNGS-UHFFFAOYSA-N	248.326	1.577	10	20	BDCD	
Cc1oc(C(=O)O)cc1COc1ccnnc1	1600832393	OIHBORPHLXORQF-UHFFFAOYSA-N	234.211	1.655	10	20	BDCD	
Nc1ccc(NC(=O)NC[C@@H](O)C2CCC2)cc1	841298639	RKFXYZAMRQSFSZ-GFCCVEGCSA-N	249.314	1.551	10	20	BDCD	
COc1ccc(N(C)CC(=O)NC(C)C)cc1	844353062	FIHZSVDRXGJAKH-UHFFFAOYSA-N	236.315	1.656	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1	160422320	SIMNAKHLOLOVMA-UTUOFQBUSA-N	232.283	1.775	10	20	BDCD	
COC[C@](C)(O)CN[C@@H](C)c1ccccc1O	382548963	GWHJOWAVEJKDJA-GXFFZTMASA-N	239.315	1.440	10	20	BDCD	
Cc1ccc(O)c(CN2CCNC(=O)[C@H]2C)c1	123511366	RNRSQYCFBRMNHT-SNVBAGLBSA-N	234.299	1.021	10	20	BDCD	
COc1ccc(O)c(CNCC(F)(F)CO)c1	185661423	LWZSJKHOXUYSBY-UHFFFAOYSA-N	247.241	1.118	10	20	BDCD	
CCNC(=O)NCc1cccc(OC)c1O	97595834	UYDIYQZHNOSIFV-UHFFFAOYSA-N	224.260	1.220	10	20	BDCD	
COCC1(C(=O)NCc2ccc(N)cc2)CCC1	297329076	XPFDENAVTPAXFO-UHFFFAOYSA-N	248.326	1.702	10	20	BDCD	
COc1cccc(O)c1CN1CC2(CC2)C1	824533374	DXZNBKHLRLFVEZ-UHFFFAOYSA-N	219.284	1.997	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)CC[C@H]1N	1120263591	SLBFGUALBDLJBX-ZWNOBZJWSA-N	219.332	1.438	10	20	BDCD	
COCC1CN(Cc2cccc(C)c2O)C1	895971418	PXPLPBVPCJUXHQ-UHFFFAOYSA-N	221.300	1.779	10	20	BDCD	
COc1ccc(CNC(=O)[C@@H]2C[C@@H]2C)c(O)c1	794382801	INVIKXCFSMYPJJ-GZMMTYOYSA-N	235.283	1.673	10	20	BDCD	
COc1cc(Nc2ccc(N)cc2)ncn1	85481319	ACQBTRKWJNDKPX-UHFFFAOYSA-N	216.244	1.811	10	20	BDCD	
C[C@H](CO)N[C@H](C)c1ccc(F)c(F)c1O	187738009	IMSDUUJUUBYCHQ-RNFRBKRXSA-N	231.242	1.702	10	20	BDCD	
COc1ccc(CN[C@@H](C)[C@H](C)OC)c(O)c1	189109055	PRSUEIAYVYYFIK-UWVGGRQHSA-N	239.315	1.914	10	20	BDCD	
CC[C@@H](F)C(=O)NCc1ccc(O)c(O)c1	1335819785	CFSLJGKJORFMJH-MRVPVSSYSA-N	227.235	1.462	10	20	BDCD	
C[C@@H](CN)NCc1ccc(N2CCCC2)cc1	1348515754	PDHDDKJFVADPIF-LBPRGKRZSA-N	233.359	1.724	10	20	BDCD	
COc1cccc(CNC(=O)[C@H]2C[C@@H]2F)c1O	1521265821	ISVLACGKSOTNQH-IUCAKERBSA-N	239.246	1.375	10	20	BDCD	
CC(C)[C@H](CNCc1cc(F)ccc1O)ON	1575433240	MJFRTALIISZTKW-LBPRGKRZSA-N	242.294	1.536	10	20	BDCD	
COc1cccc(CNCc2cnn(C)c2)c1O	20352695	KCYIOWQICHTRHY-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1C[C@H](O)C1	877640596	AOEFLXAKRLDVDT-MGCOHNPYSA-N	207.273	1.314	10	20	BDCD	
Cc1cccc(CN(CCO)C2CC2)c1O	132490260	WFJBXDDMYLWAMQ-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
OC[C@@H]1CCC[C@@H]1NCc1cc(F)ccc1O	226612798	AKMUVHKAUISVBJ-CABZTGNLSA-N	239.290	1.782	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)CCN1	83813944	DDUVRVQHSFRSIB-SNVBAGLBSA-N	206.289	1.186	10	20	BDCD	
CCC[C@@H](O)CN(C)Cc1ccccc1O	295021950	UXQOXDYBDXZFBN-GFCCVEGCSA-N	223.316	1.985	10	20	BDCD	
CCNC(=O)COc1ccc(N(C)C)cc1	277761947	KMSRBHCTHXPJSV-UHFFFAOYSA-N	222.288	1.268	10	20	BDCD	
Cc1cc(CNC(=O)c2cc(O)cs2)on1	731871192	FNBWDIISDLAQFN-UHFFFAOYSA-N	238.268	1.680	10	20	BDCD	
C[C@H](O)C[C@@H](C)NCc1ccccc1O	164461051	HSAHIEWZJYYFIA-ZJUUUORDSA-N	209.289	1.641	10	20	BDCD	
CCOc1cccc(CNCCNC)c1O	841035568	KNZUKKBONGOKGG-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
CC[C@@H](CO)Sc1ncc(C(=O)OC)s1	917777350	FFPCKHJQEJIURM-LURJTMIESA-N	247.341	1.793	10	20	BDCD	
CC[S@](C)(=O)=NC(=O)c1cc(O)cs1	925818249	BKTVMGSTQMHYFW-AWEZNQCLSA-N	233.314	1.712	10	20	BDCD	
CNCCN(C)Cc1ccc(N(C)C)c(C)c1	923360634	DARPZYVVPDLVTF-UHFFFAOYSA-N	235.375	1.712	10	20	BDCD	
Nc1ccc(NC(=O)NC[C@H]2C[C@H](O)C2)cc1	873328746	UCNUZNCRPPFLBH-JLIMDTESSA-N	235.287	1.161	10	20	BDCD	
CN(C(=O)CC1(N)CCC1)c1ccc(N)cc1	877078847	HGQAHRSGZXJFSF-UHFFFAOYSA-N	233.315	1.503	10	20	BDCD	
Oc1c(F)cccc1CN1C[C@@H]2CC[C@H](C1)N2	873218193	ZDVOCKOQLMUTKM-PHIMTYICSA-N	236.290	1.468	10	20	BDCD	
Nc1ccc(NC(=O)c2ccon2)cc1	44584580	WTJLVGKTJVCRAI-UHFFFAOYSA-N	203.201	1.509	10	20	BDCD	
Nc1ccc(CCNC(=O)C[C@@H]2CCCO2)cc1	87206659	YNAIJIRQOMXWDG-ZDUSSCGKSA-N	248.326	1.497	10	20	BDCD	
c1cc2c(cc1CNCCN1CCC1)CCO2	697377972	COMKZNWTAARBMC-UHFFFAOYSA-N	232.327	1.417	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCCCO1	157935704	FCLRUGPSCBRJPA-LBPRGKRZSA-N	235.283	1.578	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C[C@@H]1CCOC1	180242078	FPOAFWPJMYACFK-JTQLQIEISA-N	239.290	2.000	10	20	BDCD	
C[C@@H]1NCCC[C@@H]1NC(=O)Cc1ccc(N)cc1	193545439	GZDWSNYHEZAOME-GWCFXTLKSA-N	247.342	1.068	10	20	BDCD	
c1cc2c(cc1CNCC13CC(CO1)C3)CCO2	527786478	CYOPJCJEUOZCHN-UHFFFAOYSA-N	245.322	1.890	10	20	BDCD	
CCc1cccc(CN[C@H](CO)C2CC2)c1O	848897369	PSSMMIAQHZLUID-CYBMUJFWSA-N	235.327	1.815	10	20	BDCD	
CNCCC(=O)N[C@H](C)c1ccccc1O	870988460	PWIFMXMFINUPJU-SECBINFHSA-N	222.288	1.179	10	20	BDCD	
Cn1ccc(/C=C2\SC(=S)NC2=O)c1	113756330	YOJDEXGOMUOAPW-DAXSKMNVSA-N	224.310	1.514	10	20	BDCD	
CN(C)c1ccc(CNCC(F)(F)CO)cc1	183895732	AOWRBBQMOMELMC-UHFFFAOYSA-N	244.285	1.470	10	20	BDCD	
CC[C@H](N)C(=O)N(C)Cc1ccccc1O	37823776	MVFBZCMJGDJGAD-JTQLQIEISA-N	222.288	1.088	10	20	BDCD	
COCCOC(=O)NCc1ccccc1O	381548463	LUGABRFOXDXQPX-UHFFFAOYSA-N	225.244	1.265	10	20	BDCD	
CCN(CC)C(=O)CNCc1ccccc1O	134227874	RKISJPZNKHMBDM-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
CC[C@H](O)CN[C@@H](C)c1cc(F)ccc1O	229970515	ATUQDPYVNRMQIP-WPRPVWTQSA-N	227.279	1.953	10	20	BDCD	
N[C@@H](CC(=O)NCc1ccccc1O)C1CC1	228420848	MGRQTAKDKFVERG-NSHDSACASA-N	234.299	1.136	10	20	BDCD	
CN(Cc1cc(F)ccc1O)[C@@H]1CCC[C@H]1O	289747142	QMAANGTVCDKHMS-DGCLKSJQSA-N	239.290	1.877	10	20	BDCD	
CC[C@H](CO)C(=O)N[C@H](C)c1ccccc1O	827940328	ASIVTAWVVDNRIL-NXEZZACHSA-N	237.299	1.588	10	20	BDCD	
O=CN1CCCN(Cc2ccccc2O)CC1	827877053	GXLCQEOWNXJSRJ-UHFFFAOYSA-N	234.299	1.056	10	20	BDCD	
C[C@@H]1CCN1C(=O)/C=C\c1ccc(O)c(O)c1	914157153	OEQZUFPAQMUVIJ-AZVKUDOFSA-N	233.267	1.732	10	20	BDCD	
C[C@H](NC[C@]1(C)CCC(=O)N1)c1ccccc1O	834907734	AZZKJIDDABMXSU-HZMBPMFUSA-N	248.326	1.712	10	20	BDCD	
Cc1cccc(CN2CCc3n[nH]cc3C2)c1O	857876522	RVUIVOMHYZDULV-UHFFFAOYSA-N	243.310	1.982	10	20	BDCD	
C[C@H](N)CN(C)Cc1cccc(F)c1O	863652890	XYPWNIQCKLHGEQ-QMMMGPOBSA-N	212.268	1.310	10	20	BDCD	
C/C=C\C(=O)NCc1cc(C)ccc1O	862761349	OMYNLXUCJQQZGP-ARJAWSKDSA-N	205.257	1.893	10	20	BDCD	
CCN(CC(=O)NC)Cc1ccc(C)cc1O	876577712	KTGKDXFLFWMZPR-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
COc1ccc(CNC(=O)C=C(C)C)c(O)c1	794381612	QJABMMIQCVPYAO-UHFFFAOYSA-N	235.283	1.983	10	20	BDCD	
Cn1cnc(=NCc2c(O)cccc2Cl)[nH]1	390767926	SNFLIRCLJRIWSP-UHFFFAOYSA-N	238.678	1.208	10	20	BDCD	
O=C(O)[C@@H](F)CNCc1cc(F)cc(F)c1O	1332018231	WKPZFNVFARWOTN-QMMMGPOBSA-N	249.188	1.183	10	20	BDCD	
COc1cccc(CNC[C@H](C)C(=O)O)c1O	1332977797	CJKPHSROWVCKSU-QMMMGPOBSA-N	239.271	1.211	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCCNCC2)cc1	1343472095	DLIBMULPHNQBAN-LBPRGKRZSA-N	247.342	1.275	10	20	BDCD	
Nc1ccc(CNC2(CC(=O)O)CCC2)cc1	1601216073	MJOMRQUNYWHHFG-UHFFFAOYSA-N	234.299	1.756	10	20	BDCD	
Nc1ccc(CC(=O)Nc2ccccn2)cc1	20185856	CBSTUGUJKXTCKK-UHFFFAOYSA-N	227.267	1.845	10	20	BDCD	
C[C@H](N[C@@H]1CC[C@H]1O)c1ccc(F)cc1O	378756497	YIZZDUWLVBWXQE-WHGOUJPWSA-N	225.263	1.705	10	20	BDCD	
CCCOc1ccccc1NC[C@@H](O)COC	819399396	URNNFPKKLBOXTQ-LLVKDONJSA-N	239.315	1.895	10	20	BDCD	
Cc1cc(NS(C)(=O)=O)ccc1O	3078573	QXYUBYUJNMCDNU-UHFFFAOYSA-N	201.247	1.072	10	20	BDCD	
CC[C@H]1C(=O)NCCN1Cc1ccccc1O	179569584	GGLCHVFBJMYZOX-NSHDSACASA-N	234.299	1.103	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCCO2)cc1	32013616	JXIITDSXPQGEHQ-LLVKDONJSA-N	220.272	1.064	10	20	BDCD	
COc1cccc(CN[C@H](C)c2cn[nH]c2)c1O	229884889	ARZDLLFGEDVPAO-SECBINFHSA-N	247.298	1.975	10	20	BDCD	
CCC1(NC(=O)c2cccc(O)c2O)CC1	296000005	VMUFMZDAZPOCSN-UHFFFAOYSA-N	221.256	1.770	10	20	BDCD	
O=C1NC[C@@H](CSc2nccs2)O1	264634548	KXHOEOSCKUKQQX-YFKPBYRVSA-N	216.287	1.344	10	20	BDCD	
COCC[C@H](CO)NCc1cccc(C)c1O	281250719	MMUBJFXLMWBYGH-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
CO[C@@H](C)CNC(=O)c1c(F)ccc(O)c1O	295153054	BXXSDQMIJZEYQF-LURJTMIESA-N	243.234	1.002	10	20	BDCD	
COC[C@@H](O)CNc1ccccc1OCCF	819489403	UQJHDZYMPFPNAK-JTQLQIEISA-N	243.278	1.454	10	20	BDCD	
CSC[C@H](C)NC(=O)c1cc(O)cs1	736710734	LDULVGUQHOZVSX-LURJTMIESA-N	231.342	1.935	10	20	BDCD	
CC[C@H](CO)N[C@@H](C)c1cccc(OC)c1O	846135207	CBSCDJISGIIBOI-VHSXEESVSA-N	239.315	1.822	10	20	BDCD	
Nc1ccc(CCN[C@@H]2CCCNCC2)cc1	841037910	CRKSWPLLSJDFBS-CQSZACIVSA-N	233.359	1.543	10	20	BDCD	
Cc1cc(CN(C)C[C@@H](C)N)ccc1N(C)C	923409342	PDAREGAXOFKARK-GFCCVEGCSA-N	235.375	1.840	10	20	BDCD	
Nc1ccc(CCNC(=O)CCCF)cc1	851632813	WWFVJGUSBIYSPS-UHFFFAOYSA-N	224.279	1.677	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H](O)C(C)C)c1	862756101	QHOKHQIJERBXIJ-GFCCVEGCSA-N	237.299	1.334	10	20	BDCD	
CN(C)c1ccc(CN(C)C2CC(O)C2)cc1	761223406	QMDXPUDAYCWDDV-UHFFFAOYSA-N	234.343	1.708	10	20	BDCD	
Cc1cccc(O)c1CN(C)Cc1cn(C)nn1	877630713	KEXVSEVPKRDQMT-UHFFFAOYSA-N	246.314	1.461	10	20	BDCD	
Cc1cccc(CNC[C@@H]2COCO2)c1O	894875709	IPFSYRIROSFMLD-LLVKDONJSA-N	223.272	1.163	10	20	BDCD	
C[C@@H](NCC(C)(C)O)c1cc(F)ccc1O	87111428	VWXCAQPIOROPLD-MRVPVSSYSA-N	227.279	1.953	10	20	BDCD	
[N-]=[N+]=NCCn1ccn2nc(C(=O)O)cc12	409437326	FLGOJISSQUYSTK-UHFFFAOYSA-N	220.192	1.144	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NCc1ccc2c(c1)CCO2	694392401	GNXPMWPGDMTQOL-KGLIPLIRSA-N	233.311	1.889	10	20	BDCD	
COc1cccc(O)c1CN1CCN[C@H](C)C1	768140884	YKGZKFXRWJJFKI-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
Nc1ccc(NC(=O)C[C@@H]2COC(=O)C2)cc1	1345597543	PCHSZDVUYRXKRF-QMMMGPOBSA-N	234.255	1.161	10	20	BDCD	
Cc1cccc(CNC[C@H](C)C(=O)O)c1O	848637570	JHZXXGBCRKRMIS-VIFPVBQESA-N	223.272	1.511	10	20	BDCD	
CC(C)OCC(=O)NCc1ccc(N)cc1	164972596	JJXIDKAXOGRHFC-UHFFFAOYSA-N	222.288	1.310	10	20	BDCD	
C[C@@H](CSc1ncc([N+](=O)[O-])s1)C(=O)O	226766118	QMCDSXKUJRMHFD-BYPYZUCNSA-N	248.285	1.864	10	20	BDCD	
CCCCNC(=S)NCc1cccn1C	231647846	XKFIXBIOXRFZLF-UHFFFAOYSA-N	225.361	1.789	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@@H]2CCOC2)cc1	401349556	OTGHRZYJNPGQKM-NSHDSACASA-N	234.299	1.312	10	20	BDCD	
C[C@H](NC(=O)CCC(=O)O)c1ccccc1O	868461486	GWUYLVAKTIULSC-QMMMGPOBSA-N	237.255	1.434	10	20	BDCD	
Nc1ccc(NC(=O)C[C@H]2CCCO2)cc1	83522085	YOAMXLWJTZLDHK-LLVKDONJSA-N	220.272	1.776	10	20	BDCD	
CC[C@@H]1C[C@H]1NC(=O)Cc1ccc(N)cc1	226349346	RQTFDAFACYARLO-ZYHUDNBSSA-N	218.300	1.726	10	20	BDCD	
CC(=O)C(=O)CSc1ccc(C)cn1	289806534	YWWNVSJKRYFWLM-UHFFFAOYSA-N	209.270	1.640	10	20	BDCD	
Cc1c[nH]nc1CNCCc1ccc(N)cc1	841037548	AJSVNTFTGWTQFM-UHFFFAOYSA-N	230.315	1.633	10	20	BDCD	
CCn1nccc1CNCCc1ccc(N)cc1	841034033	FQTMBJIGCBNZQX-UHFFFAOYSA-N	244.342	1.818	10	20	BDCD	
N=C(NCc1ccccc1O)NCC1CCC1	848985033	YALPBRWFLHGKOF-UHFFFAOYSA-N	233.315	1.806	10	20	BDCD	
Nc1ccc(-n2cc(C3(O)CCC3)nn2)cc1	849134745	NRSLUYSOXZLAKY-UHFFFAOYSA-N	230.271	1.221	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](CN)C2CC2)c1	841027763	FXVQMQJGRDOLAB-GFCCVEGCSA-N	220.316	1.528	10	20	BDCD	
O=C(O)C1CC(NCc2ccc3c(c2)CCO3)C1	871881956	QSHNWYKAVXDBSR-UHFFFAOYSA-N	247.294	1.574	10	20	BDCD	
CN(Cc1ccccc1O)[C@H](C(=O)O)C1CC1	873641359	TUFQQKAXTNZABQ-LBPRGKRZSA-N	235.283	1.687	10	20	BDCD	
Cc1ccc(CN(CCO)CC2CC2)c(O)c1	876640124	ZFMIMKZMORJTBG-UHFFFAOYSA-N	235.327	1.905	10	20	BDCD	
CCOc1ccc(N(C)CC(=O)NC2CC2)cc1	150733223	RYNFZHJZFVDGJL-UHFFFAOYSA-N	248.326	1.800	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2C[C@H]3CC[C@@H]2O3)cc1	160422451	SIMNAKHLOLOVMA-WOPDTQHZSA-N	232.283	1.775	10	20	BDCD	
COC[C@H](CO)N[C@@H](C)c1cc(F)ccc1O	234823019	WHBSTPBZUBAACS-WPRPVWTQSA-N	243.278	1.189	10	20	BDCD	
OC[C@H]1C[C@H](N[C@H]2CCc3cccc(O)c32)C1	927149184	XBPKFBOQYPTHQL-DLOVCJGASA-N	233.311	1.740	10	20	BDCD	
O=C(NCc1ccccc1O)NC1CC1	136333564	BJWLKBBWHMYIEA-UHFFFAOYSA-N	206.245	1.354	10	20	BDCD	
Oc1ccccc1CN1CC[C@]2(CCNC2)C1	31994586	UAAXXDDKCCMRPL-AWEZNQCLSA-N	232.327	1.578	10	20	BDCD	
CCN(CCC(=O)O)Cc1ccccc1O	83406470	GYYUDPAOXVXOAR-UHFFFAOYSA-N	223.272	1.689	10	20	BDCD	
CC[C@@]1(C(=O)NCc2ccccc2O)CCNC1	228422926	MVLGQPMDVSXFBV-CQSZACIVSA-N	248.326	1.398	10	20	BDCD	
COC[C@@H](CO)NCc1cccc(Cl)c1O	234872500	QOXVBVJDRYCFNF-SECBINFHSA-N	245.706	1.143	10	20	BDCD	
Oc1cc2c(cc1CN1CCO[C@H]3C[C@H]31)OCO2	368313087	SOVQWRZILGRGEJ-KOLCDFICSA-N	249.266	1.094	10	20	BDCD	
CN(C)c1ccc(OC[C@@H]2CNC(=O)O2)cc1	289320763	CGNJEYVQVGJZHJ-NSHDSACASA-N	236.271	1.240	10	20	BDCD	
C[C@@](O)(C(=O)NCc1ccccc1O)C1CCC1	813489444	ZOTATXBQWDLSEA-AWEZNQCLSA-N	249.310	1.560	10	20	BDCD	
CC[C@@H](N[C@@H]1CCNC1)c1ccc(F)cc1O	817945167	WARRLEVCSNVKJT-ZYHUDNBSSA-N	238.306	1.934	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)[C@@H]1CCCN1	817958522	WPLYWENEEABAMI-FZMZJTMJSA-N	233.359	1.541	10	20	BDCD	
C[C@H](NC[C@@H](N)C1CC1)c1cc(F)ccc1O	817965967	XSUNLGJHIFGGPC-QPUJVOFHSA-N	238.306	1.919	10	20	BDCD	
Cc1ccc(C(=O)N2CC=CC2)c(O)c1O	910011238	PTKSBJIMBGGGJO-UHFFFAOYSA-N	219.240	1.418	10	20	BDCD	
Cc1ccc(C(=O)N2CCCCN2)c(O)c1O	854427523	DJKDFRITJBEQQT-UHFFFAOYSA-N	236.271	1.147	10	20	BDCD	
Cc1ccc(O)c(CN2CCCNC(=O)C2)c1	769113964	FXSCNFSVDGKKKR-UHFFFAOYSA-N	234.299	1.023	10	20	BDCD	
Cc1ccc(CN2CCCN(C=O)CC2)c(O)c1	877641727	GXKXZHIHRZQUDE-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
CC(C)[C@@](C)(O)C(=O)NCc1ccccc1O	771417041	JWAUMPLJZXDSFF-CYBMUJFWSA-N	237.299	1.415	10	20	BDCD	
[N-]=[N+]=NC1CN(CC(=O)Nc2nccs2)C1	409423898	REXCWWDDIVSPHF-UHFFFAOYSA-N	238.276	1.076	10	20	BDCD	
C[C@@]1(NCc2ccccc2O)CCOC1	120127348	RJFVTHSSYYIZLO-GFCCVEGCSA-N	207.273	1.661	10	20	BDCD	
CC1CC(NC(=O)Cc2ccc(N)cc2)C1	158249502	KGSFXHGHVOGCQN-UHFFFAOYSA-N	218.300	1.726	10	20	BDCD	
C[C@]1(C(=O)NCc2ccccc2O)CCCCO1	837481044	MWWZBBHAFCZNQL-CQSZACIVSA-N	249.310	1.968	10	20	BDCD	
Cc1cccc(CN[C@@H](CN)C2CC2)c1O	841028772	RLYPBXPXTKBPFB-LBPRGKRZSA-N	220.316	1.528	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H](N)C1CCC1	399006212	YLGOELQCMSIITL-CYBMUJFWSA-N	248.326	1.478	10	20	BDCD	
Cc1nn(C)cc1C(=O)NCc1ccccc1O	226653814	IRKOLOYNFNZCID-UHFFFAOYSA-N	245.282	1.364	10	20	BDCD	
C[C@]1(NC(=O)c2cccc(O)c2O)CCOC1	126548722	AHTFAHKKMRLGKA-LBPRGKRZSA-N	237.255	1.007	10	20	BDCD	
COc1cccc(CNC[C@H]2CCOC2)c1O	37738184	BXLPZQVJIQYZBW-SNVBAGLBSA-N	237.299	1.527	10	20	BDCD	
CCNC(=O)[C@@H](C)NCc1cc(C)ccc1O	71407098	RFGHMZXROOWQOT-SNVBAGLBSA-N	236.315	1.315	10	20	BDCD	
CC[C@H](NC[C@H](C)O)c1ccc(F)cc1O	285842144	XKYSEVOQHSJKLN-KWQFWETISA-N	227.279	1.953	10	20	BDCD	
CNC(=O)COc1ccc2c(c1)c(C)c(C)n2C	334993455	IZHALNQVLPSIQQ-UHFFFAOYSA-N	246.310	1.920	10	20	BDCD	
COC[C@H](CO)N[C@H](C)c1ccc(C)cc1O	234838686	VASWKLQCASEKSW-MNOVXSKESA-N	239.315	1.359	10	20	BDCD	
COC[C@H](O)CNCc1cccc(Cl)c1O	162865669	LMRDFGHXEAVURD-SECBINFHSA-N	245.706	1.143	10	20	BDCD	
Cc1cccc(CN2CCO[C@H](C)C2)c1O	162807545	XAMAMVMHGJJHTN-LLVKDONJSA-N	221.300	1.921	10	20	BDCD	
C[C@H](CCCCN)NC(=O)Cc1ccc(N)cc1	834786802	SUKGTHHAWPAQGT-LLVKDONJSA-N	249.358	1.445	10	20	BDCD	
CCNCCNCc1cc(OC)ccc1O	841034780	DJVSVBCUPZSEQR-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
C[C@@H](CN)CNCc1cc(F)ccc1O	841047983	FMWXMZJTYYFNGR-QMMMGPOBSA-N	212.268	1.216	10	20	BDCD	
CC[C@@H](N)CNCc1ccc(N(C)C)cc1C	841072237	MGHCDRJXYYCUOW-CYBMUJFWSA-N	235.375	1.888	10	20	BDCD	
C[C@@H](NC(=O)c1cnn(C)n1)c1ccccc1O	827946285	CNOGCVRSJULUHF-MRVPVSSYSA-N	246.270	1.012	10	20	BDCD	
Cc1cccc(CN2CC[C@@H]([C@@H](C)N)C2)c1O	843056956	DEEFFOSCOIUEPO-VXGBXAGGSA-N	234.343	1.870	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CO[C@H](C)C2)c1	862757042	FEBJAMIIVWNLPS-ZYHUDNBSSA-N	249.310	1.742	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C(=O)C(C)(C)C)c1	862759566	GNGJGOJUFLZTAW-UHFFFAOYSA-N	249.310	1.932	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC(F)(F)C1	776522373	KYLLLOCIKDAYFT-UHFFFAOYSA-N	233.239	1.935	10	20	BDCD	
C[C@H](O)[C@@H]1CCCCN1C(=O)CN=[N+]=[N-]	409424654	CNFSTFGEOAEKIY-YUMQZZPRSA-N	212.253	1.059	10	20	BDCD	
CCN1CCC[C@H]1CNCc1ccccc1O	19959875	VYZFVGWSSXTIKK-ZDUSSCGKSA-N	234.343	1.966	10	20	BDCD	
C[C@H]1COC[C@H]1NCc1ccc(N(C)C)cc1	688042878	JNTYCMZLUBDGFK-SMDDNHRTSA-N	234.343	1.877	10	20	BDCD	
Cc1cccc(CN[C@H](CO)CC(F)F)c1O	717826556	XMMYDGZZJVFEEZ-JTQLQIEISA-N	245.269	1.806	10	20	BDCD	
CC[C@@H](NCc1cc(F)ccc1O)C(=O)NC	697934834	GDQWIRRTSBZAJC-SNVBAGLBSA-N	240.278	1.146	10	20	BDCD	
C[C@@H](CCO)N[C@H](C)c1ccc(F)cc1O	132564724	FVXYZVVNJUXEBA-DTWKUNHWSA-N	227.279	1.953	10	20	BDCD	
O=C(O)CN(Cc1ccccc1O)C1CC1	83406072	VMKZLSSXSHGYRQ-UHFFFAOYSA-N	221.256	1.441	10	20	BDCD	
CN(CCC(N)=O)Cc1cc(Cl)ccc1O	382223900	WQUYTRQHIJXFEP-UHFFFAOYSA-N	242.706	1.353	10	20	BDCD	
COC[C@@H](C)CC(=O)N(C)c1ccc(N)cc1	95033743	YTSRVOOAJCTXNS-JTQLQIEISA-N	236.315	1.904	10	20	BDCD	
CC(F)(F)CNC(=O)NCc1ccccc1O	836479993	UYCHULSBDOEYSV-UHFFFAOYSA-N	244.241	1.847	10	20	BDCD	
C[C@@H](CN)CNCc1cc(Cl)cc(F)c1O	841050202	ZRIDKBJJUJGVJY-ZETCQYMHSA-N	246.713	1.869	10	20	BDCD	
NC1(CNCc2cccc(F)c2O)CCC1	841048829	MACUQXWUMXYXJC-UHFFFAOYSA-N	224.279	1.502	10	20	BDCD	
Cc1ccc(CNCCCCO)c(O)c1	877482587	DBIVQXUUIPDKHN-UHFFFAOYSA-N	209.289	1.563	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)C1(CO)CC1	877625579	PQWRTMSDRPCAEX-NSHDSACASA-N	235.327	1.951	10	20	BDCD	
CCO[C@@H]1C[C@@H]1C(=O)NCc1ccc(N)cc1	689957555	QVANATAMSBNORS-NWDGAFQWSA-N	234.299	1.310	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCCC[C@H]2N)cc1	1336117005	KUPXHMURLZPTLP-CHWSQXEVSA-N	219.332	1.628	10	20	BDCD	
COc1cccc(O)c1CNCCC(C)(C)O	775368598	JUFWRYHIBMFNGW-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
Cc1cccc(CN[C@H](C(=O)O)C(C)C)c1O	158741769	HSOOKTOJOUGTEE-NSHDSACASA-N	237.299	1.899	10	20	BDCD	
CN(CCCC(=O)O)c1ccc2c(c1)OCO2	258860985	JZJXXYAQXDNYSL-UHFFFAOYSA-N	237.255	1.716	10	20	BDCD	
COC(=O)C=Cc1ccc(N(C)C)cc1	1857776414	ZKGVSZCAHWJHDJ-UHFFFAOYSA-N	205.257	1.939	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@H](O)C2)c1O	827826891	NALOOAHEUMJXII-XYPYZODXSA-N	207.273	1.314	10	20	BDCD	
C[C@@H](C(=O)O)C(=O)N[C@H](C)c1ccccc1O	868461438	FOMRBHXOOUZMRZ-HTQZYQBOSA-N	237.255	1.290	10	20	BDCD	
CCO[C@@H](C)C(=O)N(C)Cc1ccccc1O	65515490	YIQDIJHZEFAWIP-JTQLQIEISA-N	237.299	1.776	10	20	BDCD	
Cc1cc(O)c(CN2CCC[C@@H]2C(N)=O)cc1C	179579608	QZQCGTQRPXTBNS-GFCCVEGCSA-N	248.326	1.459	10	20	BDCD	
CC[C@H](CO)N[C@H](C)c1ccc(F)cc1O	62745359	MEXJYXHXBGGISL-PSASIEDQSA-N	227.279	1.953	10	20	BDCD	
CCN1CC(=O)N[C@@H]1c1ccc(N(C)C)cc1	189887994	IVIXEXVIPYIZHA-ZDUSSCGKSA-N	233.315	1.203	10	20	BDCD	
O=C(O)[C@@H]1CCCN(Cc2ccccc2O)C1	38539474	VKVUEAGKYJPBOW-LLVKDONJSA-N	235.283	1.689	10	20	BDCD	
O=C(NOCC1CC1)c1cccc(O)c1O	293684439	BLJGEXGPTMHQLR-UHFFFAOYSA-N	223.228	1.169	10	20	BDCD	
[N-]=[N+]=NCCN1CCC(N2CCCC2)CC1	384549643	NFNXTIPIKLCFQP-UHFFFAOYSA-N	223.324	1.857	10	20	BDCD	
N[C@H](CO)c1cccc(Br)c1O	72198718	YQNUKWBOXOLUSU-SSDOTTSWSA-N	232.077	1.147	10	20	BDCD	
CC(=O)C(=O)COc1cc(F)cc([N+](=O)[O-])c1	808025859	PWTVSIDKQTYPSG-UHFFFAOYSA-N	241.174	1.271	10	20	BDCD	
CC[C@H](NC[C@@H](C)N)c1ccccc1O	817974003	XIPRRAVLJKVWCY-KOLCDFICSA-N	208.305	1.780	10	20	BDCD	
CC(C)OCCONC(=O)c1cc(O)cs1	812806174	RGAKFQROEJOSRA-UHFFFAOYSA-N	245.300	1.540	10	20	BDCD	
CC(C)[C@@H](N)CNCc1cccc(F)c1O	841029034	DKLSRZAZGSAWLT-NSHDSACASA-N	226.295	1.604	10	20	BDCD	
CC[C@H](N)CNCc1ccc(N(C)C)cc1C	841072238	MGHCDRJXYYCUOW-ZDUSSCGKSA-N	235.375	1.888	10	20	BDCD	
Oc1ccccc1CN1[C@H]2CCNC[C@H]1CC2	843057441	DKTYORXLOMWODY-CHWSQXEVSA-N	232.327	1.719	10	20	BDCD	
CO[C@H]1CCN(C(=O)c2cc(O)cs2)C1	752821007	QWQPCTNVMSBMLK-QMMMGPOBSA-N	227.285	1.315	10	20	BDCD	
Nc1ccc(CCNCc2ccncc2)cc1	71428849	VFIAHDYVBPHSKK-UHFFFAOYSA-N	227.311	1.996	10	20	BDCD	
CC[C@@H]1C[C@H]1C(=O)NCc1cccc(O)c1O	1123890326	XCJBJCIILRLRSM-PSASIEDQSA-N	235.283	1.760	10	20	BDCD	
[N-]=[N+]=NC1CN(CC(=O)NC2CCCCC2)C1	409423896	RDMRIYPXPHTTAW-UHFFFAOYSA-N	237.307	1.430	10	20	BDCD	
CC[C@H](F)C(=O)NCc1ccc(O)c(O)c1	1335819786	CFSLJGKJORFMJH-QMMMGPOBSA-N	227.235	1.462	10	20	BDCD	
CON(C(=O)c1cc(O)cs1)C(C)C	1261728122	KKXXPLHCWVXZKQ-UHFFFAOYSA-N	215.274	1.866	10	20	BDCD	
CS[C@@H](C)CNC(=O)c1cccc(O)c1O	163277688	MENSYLDJJPJYNH-ZETCQYMHSA-N	241.312	1.579	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCCCO)c1	20188107	QSASMZUUAVLDHX-SECBINFHSA-N	225.288	1.434	10	20	BDCD	
CCN(C)CCN[C@@H]1CCc2cccc(O)c21	295831048	DXNKFJJWHPHDME-GFCCVEGCSA-N	234.343	1.921	10	20	BDCD	
O=C1CCCN1CCNCc1ccccc1O	405386856	NCQGDCFXNWWHQK-UHFFFAOYSA-N	234.299	1.104	10	20	BDCD	
CC[C@H](O)CCNC(=O)Cc1ccc(N)cc1	154935217	MJSUONXWTYYNQE-LBPRGKRZSA-N	236.315	1.089	10	20	BDCD	
C[C@H](Cn1ccnc1)NCc1ccccc1O	37157234	HBINXFCYFXHCDT-LLVKDONJSA-N	231.299	1.767	10	20	BDCD	
NCCC(=O)NCc1ccc(N2CCCC2)cc1	195171462	AKACGOZVEKHILC-UHFFFAOYSA-N	247.342	1.252	10	20	BDCD	
O=[N+]([O-])c1ccc(O)c(CNCCCCO)c1	193250584	OLMIYQRQOYWXNN-UHFFFAOYSA-N	240.259	1.163	10	20	BDCD	
CC1(C)OCC(NCc2ccccc2O)CO1	230695500	HVLKLGQTQRWDGX-UHFFFAOYSA-N	237.299	1.633	10	20	BDCD	
O=C(NC1CC1)c1c(F)ccc(O)c1O	276449966	ASNBGOLCPHUHSP-UHFFFAOYSA-N	211.192	1.129	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@H]1[C@@H]3CNC[C@@H]31)CC2	817977857	QRFQEIQFPYKSDP-DEKYYXRVSA-N	230.311	1.187	10	20	BDCD	
Cc1cc(C)c([C@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c(O)c1	817978092	VTXAHTMJVUGNRM-UUIJZJDISA-N	246.354	1.877	10	20	BDCD	
NC[C@@H]1CCC[C@@H]1NCCc1ccc(N)cc1	817958110	SEEMBMQCGVCCCZ-JSGCOSHPSA-N	233.359	1.528	10	20	BDCD	
Cc1ncc(C(=O)N(C)Cc2ccccc2O)[nH]1	731871554	IHTRWZGWISLTPB-UHFFFAOYSA-N	245.282	1.696	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)CCN	841101220	SFALYGUUMOIFCF-UHFFFAOYSA-N	221.348	1.452	10	20	BDCD	
COc1cccc(CN[C@H](C)C[C@H](C)N)c1O	843129821	RPBWINLHBNCPQD-VHSXEESVSA-N	238.331	1.616	10	20	BDCD	
CC(C)[C@@H](CO)NC(=O)c1cc(O)cs1	761162102	CNSNCZOPBQHSRF-MRVPVSSYSA-N	229.301	1.200	10	20	BDCD	
Cc1cccc(CNC2(C)COC2)c1O	877691558	RFYIPYCSIYVBGP-UHFFFAOYSA-N	207.273	1.579	10	20	BDCD	
C[C@H](O)CSc1ncc([N+](=O)[O-])s1	882737916	BYRBOJCLDVWUSL-BYPYZUCNSA-N	220.275	1.524	10	20	BDCD	
CCc1cccc(CNC[C@@H]2COCO2)c1O	894885746	SFOHASRTSAQEOO-GFCCVEGCSA-N	237.299	1.417	10	20	BDCD	
COC1(C)CN(Cc2cc(F)cc(F)c2O)C1	894780661	HORVRWNDVNCORH-UHFFFAOYSA-N	243.253	1.891	10	20	BDCD	
CN(C)c1ccc(CNCc2cnccn2)cc1	54765669	LGYYQLLCHMULLQ-UHFFFAOYSA-N	242.326	1.832	10	20	BDCD	
CN(C(=O)c1cccc(O)c1O)c1cnn(C)c1	185721995	OQNDZFBPAXMOGS-UHFFFAOYSA-N	247.254	1.108	10	20	BDCD	
CCOC1(C(F)(F)F)CN(CCN=[N+]=[N-])C1	409432405	LHRSEWMAESPFAU-UHFFFAOYSA-N	238.213	1.950	10	20	BDCD	
CCc1ocnc1C(=O)NCc1ccccc1O	740083362	GZYGXEINLGOVBB-UHFFFAOYSA-N	246.266	1.873	10	20	BDCD	
C[C@H]1C[C@H](C(=O)O)CN(Cc2ccccc2O)C1	399049892	KPTNWSISZYHDPU-JQWIXIFHSA-N	249.310	1.935	10	20	BDCD	
C[C@H](CNCc1ccc2c(c1)CCO2)N(C)C	38087508	CRIANRBOOFQNRQ-LLVKDONJSA-N	234.343	1.661	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](CN)C2)c1	70955785	JSGGXZZHSJSTBG-LLVKDONJSA-N	220.316	1.481	10	20	BDCD	
O=C(CSc1nccs1)NC1CC1	47268334	UTKBGZDBOSFTLV-UHFFFAOYSA-N	214.315	1.514	10	20	BDCD	
COCC1(NC(=O)Cc2ccc(N)cc2)CC1	697543087	JZVWXRYQJKMYID-UHFFFAOYSA-N	234.299	1.107	10	20	BDCD	
CN[C@@H](CC(C)C)C(=O)N(C)c1ccc(N)cc1	884441273	DLEJSCLGPFLTFH-ZDUSSCGKSA-N	249.358	1.866	10	20	BDCD	
Cc1ccc(CN[C@H]2CCOC2=O)c(O)c1	895807823	CXEXIWJGPJJFCV-JTQLQIEISA-N	221.256	1.106	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@@H]2CCC(F)(F)[C@H]2C1	409426068	HLEPWQXJXGSQGM-BQBZGAKWSA-N	230.218	1.800	10	20	BDCD	
Oc1ccc(Cl)cc1CN1CC(O)C1	409422542	FRKRRMQJJPJMRN-UHFFFAOYSA-N	213.664	1.222	10	20	BDCD	
CC[C@H](NCc1ccccc1O)C(=O)O	84847067	KPQUMOQJPIVUPC-VIFPVBQESA-N	209.245	1.345	10	20	BDCD	
Cc1ccc(C(=O)N2CC3(CC3)C2)c(O)c1O	1350944231	NYISBXPJAXLQLC-UHFFFAOYSA-N	233.267	1.642	10	20	BDCD	
CCN[C@H](C)CNCc1cc(F)cc(F)c1O	1577887091	IFWRBUZABSKFPO-MRVPVSSYSA-N	244.285	1.758	10	20	BDCD	
Nc1ccc(CN[C@H]2CCCNC(=O)C2)cc1	1580445515	HLSBGMYJUGHOEG-LBPRGKRZSA-N	233.315	1.027	10	20	BDCD	
CO[C@H](C)Sc1ncc(C(=O)O)s1	1599040058	RBBIEKAVJPOMNQ-BYPYZUCNSA-N	219.287	1.926	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C[S@@](C)=O)c1O	164410288	XZLIAZLAGMVDIL-QFYYESIMSA-N	241.356	1.557	10	20	BDCD	
CN(C[C@@H]1CCOC1)C(=O)Cc1ccc(N)cc1	237231010	MRYJZCWBPKTYLC-LBPRGKRZSA-N	248.326	1.306	10	20	BDCD	
C[C@H](O)[C@H](C)NCc1ccc2c(c1)CCCN2C	395765774	YEMBGUKDUGOVLH-RYUDHWBXSA-N	248.370	1.928	10	20	BDCD	
COc1ccc(N(C)CCN(C)CCN)cc1	846225304	LFSCQQCXROSLLG-UHFFFAOYSA-N	237.347	1.022	10	20	BDCD	
CC[C@H](F)C(=O)NCc1cccc(OC)c1O	1353620222	XGVPZDZSMJXHNX-VIFPVBQESA-N	241.262	1.765	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC[C@@H](C)O)c1	35601838	UVAXSFWALKDRRH-BDAKNGLRSA-N	225.288	1.432	10	20	BDCD	
C[C@H](CO)NCc1ccc2c(c1)CCO2	37363052	ZPBWOKDMTZENQZ-SECBINFHSA-N	207.273	1.092	10	20	BDCD	
C[C@@H](O)[C@H]1CCCN(Cc2ccccc2O)C1	136822314	JDVONYTWGVEICU-NEPJUHHUSA-N	235.327	1.985	10	20	BDCD	
Cc1nonc1CN(C)c1ccc2c(c1)OCO2	270323816	KOPGZKUXWFZWCR-UHFFFAOYSA-N	247.254	1.743	10	20	BDCD	
CC[C@@](C)(O)CNC(=O)c1cc(O)cs1	748355411	KEQXIGHXBDVQLA-SNVBAGLBSA-N	229.301	1.345	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2CCCNC2)cc1C	841041657	CWECPXMCTCPBJO-ZDUSSCGKSA-N	234.343	1.851	10	20	BDCD	
CCCONC(=O)c1cccc(O)c1O	686764649	AEBALZRBTWVFHQ-UHFFFAOYSA-N	211.217	1.169	10	20	BDCD	
CN(C)C(C)(C)CNC(=O)c1cc(O)cs1	757753319	AIYGXKWUAXQWIX-UHFFFAOYSA-N	242.344	1.524	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)C[C@H](C)N	863652797	WZCQZQPXAGDPGT-LBPRGKRZSA-N	235.375	1.840	10	20	BDCD	
CC[C@@H](O)CCNCc1ccc(C)cc1O	877112831	YLZZGKPLKONVQM-GFCCVEGCSA-N	223.316	1.951	10	20	BDCD	
CN(CC1(C)COC1)C(=O)c1cc(O)cs1	862762854	BIUWMGAZSHZMHY-UHFFFAOYSA-N	241.312	1.562	10	20	BDCD	
C[C@H](NNc1ccc(N)cc1)c1ncnn1C	1118506383	OJCIUGYGKUOWMI-QMMMGPOBSA-N	232.291	1.075	10	20	BDCD	
COc1ccc(CN[C@H]2C[C@@H](C(=O)O)C2)cc1C	874046578	DYUHUUISDOLBEZ-TXEJJXNPSA-N	249.310	1.956	10	20	BDCD	
CC(C)(O)CCNC(=O)c1cc(O)cs1	776286849	DJQYMSRFZAGFCV-UHFFFAOYSA-N	229.301	1.345	10	20	BDCD	
CC1=NO[C@H](CNCc2cccc(C)c2O)C1	895307067	NYODNHDQYHYELB-LBPRGKRZSA-N	234.299	1.955	10	20	BDCD	
Nc1ccc(NC(=O)NC[C@H]2C[C@H]2C(=O)O)cc1	1608273028	FXDYAEMXYYSEHA-GMSGAONNSA-N	249.270	1.111	10	20	BDCD	
N[C@@H]1CCC[C@@H](NCc2ccc3c(c2)CCO3)C1	841055528	PCMNUMAKAJSOSP-ZIAGYGMSSA-N	246.354	1.981	10	20	BDCD	
CC[C@@H]1NCC[C@H]1C(=O)NCc1ccccc1O	700654379	RLXHPQGFYKVQKE-NEPJUHHUSA-N	248.326	1.397	10	20	BDCD	
C[C@H](CCCO)NCc1cc(F)cc(F)c1O	708485641	MHKRWOVZCVSBPI-MRVPVSSYSA-N	245.269	1.921	10	20	BDCD	
CCn1cc(NC(=O)c2cccc(O)c2O)cn1	126258461	UCBOVKGOQYIJIT-UHFFFAOYSA-N	247.254	1.567	10	20	BDCD	
O=C1NC(=S)S/C1=C/c1ccc(F)nc1	186375370	UXXJFFCEYIPMHF-ZZXKWVIFSA-N	240.284	1.710	10	20	BDCD	
CCN1CCN(Cc2cccc(C)c2O)CC1	124502162	WYABNVCESRCTNO-UHFFFAOYSA-N	234.343	1.838	10	20	BDCD	
Cc1cccc(CN2CCC[C@H](C(N)=O)C2)c1O	183374410	BBTFGSMVRPAYQQ-LBPRGKRZSA-N	248.326	1.398	10	20	BDCD	
C[C@@H](NCCO)c1cc2c(cc1O)CCCC2	184890326	QGPDCQOMGHNUME-SNVBAGLBSA-N	235.327	1.914	10	20	BDCD	
CNC(=O)CCCNCc1ccccc1O	136403516	OZFMXNWEGKKHAM-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
CCN(CCO)Cc1ccc(N(C)C)cc1	133088725	FOVBJXXOINPYIZ-UHFFFAOYSA-N	222.332	1.567	10	20	BDCD	
Cc1cccc(CN[C@@H](CO)C2CC2)c1O	381363434	GDBBGTQSMXXMKO-LBPRGKRZSA-N	221.300	1.561	10	20	BDCD	
C[C@@H](NCCCCO)c1cc(F)ccc1O	193283042	IXVNBAXJYLILRD-SECBINFHSA-N	227.279	1.954	10	20	BDCD	
COc1ccc(C(=O)OCC(=O)C(C)=O)cc1	808488689	YPPBHTPIFHOVKD-UHFFFAOYSA-N	236.223	1.010	10	20	BDCD	
CCN(Cc1cc(OC)ccc1O)[C@@H](C)CO	816653606	ALUABBIVVCQILI-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
Cc1cc(N(C)C)ccc1C[C@H](C)NC(N)=O	840941501	YFWVRYRVPBOAQA-JTQLQIEISA-N	235.331	1.660	10	20	BDCD	
CN(Cc1ccc(N)cc1)C1(CN)CCC1	1120268187	BKTKTHQJQZKLJN-UHFFFAOYSA-N	219.332	1.582	10	20	BDCD	
C[C@@H](O)CN[C@H](C)c1c(O)cccc1F	886487782	VDUUPKHKFHSWFY-HTQZYQBOSA-N	213.252	1.563	10	20	BDCD	
C[C@]1(CO)CCCN1Cc1cc(F)ccc1O	788435040	DISOIGPMKPEQEV-CYBMUJFWSA-N	239.290	1.878	10	20	BDCD	
CN(CC(N)=O)Cc1ccc(N2CCCC2)cc1	1319932088	HZXUBMJGDBJHQX-UHFFFAOYSA-N	247.342	1.204	10	20	BDCD	
COc1ccc(O)c(CNC[C@H]2C[C@@H](O)C2)c1	720892936	KWTYWTUJEDYGGG-JGZJWPJOSA-N	237.299	1.261	10	20	BDCD	
CC[C@H](CO)NCc1ccc2c(c1)CCO2	37362915	MDJKNNLXTRWOLH-GFCCVEGCSA-N	221.300	1.482	10	20	BDCD	
CCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1	183443446	QKSLAVQRNZJEHW-MRVPVSSYSA-N	223.272	1.555	10	20	BDCD	
O=C(O)CCCNCc1ccc2c(c1)CCO2	37418064	ZDHWMKQSJVZAPT-UHFFFAOYSA-N	235.283	1.576	10	20	BDCD	
Cc1cccc(CN(C)Cc2nnc[nH]2)c1O	180324516	ZNQRBZFVXUXQCW-UHFFFAOYSA-N	232.287	1.451	10	20	BDCD	
C[C@H]1C[C@H](CN)CN1Cc1cc(F)ccc1O	220338285	XHYBWYSVKBHVCD-VHSXEESVSA-N	238.306	1.700	10	20	BDCD	
CCOc1ccc(O)c(CN2CC[C@H](O)C2)c1	271091707	LCANGIFNLCIULO-NSHDSACASA-N	237.299	1.358	10	20	BDCD	
COc1ccc(O)c(CNC(=N)N2CCC2)c1	849009068	YILHCAGAWVHXBH-UHFFFAOYSA-N	235.287	1.131	10	20	BDCD	
CN(Cc1cccc(F)c1O)[C@H]1CCNC1	843048954	BRFZVVXYRGPXDE-JTQLQIEISA-N	224.279	1.325	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@H]2CCNC2=O)cc1C	758398394	NOXJVKPWNVHYHY-LBPRGKRZSA-N	248.326	1.329	10	20	BDCD	
Cc1ccc(CNC[C@@](C)(O)C2CC2)c(O)c1	877027261	LXPUFCUPGKJEMY-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H]1CCCNC1=O	877586358	BNJGKXWOYARNTA-NSHDSACASA-N	248.326	1.316	10	20	BDCD	
CN[C@@H](C)CCNCc1ccc(N(C)C)cc1	1118019111	NMZUMGUHSIECGQ-LBPRGKRZSA-N	235.375	1.840	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H](O)[C@@H](C)C1	877433983	LCLVUBDQFLSKHU-AAEUAGOBSA-N	235.327	1.903	10	20	BDCD	
CC(=O)[C@H](C)OC(=O)c1cccc(O)c1O	776281744	JNWZNPKRQIULRN-ZETCQYMHSA-N	224.212	1.232	10	20	BDCD	
COc1ccc(CNC(=O)c2cnc[nH]2)c(O)c1	794380444	ZNYDFJUBNBAPOR-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
COC(=O)C(C)(C)NCc1ccc(N)cc1	83351917	GUSYTMSOOGNTHT-UHFFFAOYSA-N	222.288	1.310	10	20	BDCD	
CO[C@H]1C[C@H](NCc2cc(F)cc(F)c2O)C1	708443657	RJCGRQFZZWYNRE-MGCOHNPYSA-N	243.253	1.937	10	20	BDCD	
Nc1ccc(CNC(=O)CC[C@H]2CCNC2)cc1	1343473917	RVFBSTKVQFFZPV-LBPRGKRZSA-N	247.342	1.275	10	20	BDCD	
CC(C)(C)NC(=O)c1cccc(O)c1O	126189901	OZAAWYUXUYOKIE-UHFFFAOYSA-N	209.245	1.626	10	20	BDCD	
CC(C)[C@H](N)C(=O)Nc1ccc(N)cc1	169813693	HEGCDNWMICIEJZ-JTQLQIEISA-N	207.277	1.191	10	20	BDCD	
Cc1ccc(O)c(CN2CCN[C@H](C)[C@H]2C)c1	379473033	UKARXLNTWNJFGE-VXGBXAGGSA-N	234.343	1.883	10	20	BDCD	
NC[C@H]1CCN(Cc2ccccc2O)C1	50245319	KCNDKUWEZBKHIO-SNVBAGLBSA-N	206.289	1.173	10	20	BDCD	
CCOC[C@@H](O)CNc1ccccc1OC	68950353	NEZPSUUUBWTHDG-JTQLQIEISA-N	225.288	1.505	10	20	BDCD	
Cc1cc(NS(=O)(=O)C2CC2)ccc1O	148627082	CVXRRKOMYJYLMT-UHFFFAOYSA-N	227.285	1.605	10	20	BDCD	
C[C@@H](CCO)NCc1ccc2c(c1)CCCN2C	132443253	HQCGUVWHCJSTJV-LBPRGKRZSA-N	248.370	1.930	10	20	BDCD	
CN(C)c1ccc(CNCC(C)(C)O)cc1	82687396	DXYJVJJBHSJMMC-UHFFFAOYSA-N	222.332	1.613	10	20	BDCD	
Cc1cccc(CN2CCC(C(=O)O)CC2)c1O	821111857	ABBWYCGSQCDHRE-UHFFFAOYSA-N	249.310	1.997	10	20	BDCD	
Nc1ccc(NC[C@H](N)CC(F)F)cc1	903917482	MESROCWVNWDEAR-MRVPVSSYSA-N	215.247	1.663	10	20	BDCD	
C[C@@H]1C[C@H]1CNC(=O)NCCc1ccc(N)cc1	841710703	HTUMGHPMUDYQAV-PWSUYJOCSA-N	247.342	1.767	10	20	BDCD	
CCN(C)c1ccc(CN2CC[C@@H]2CO)cc1	934013195	GFOZJSOVUIJEJE-CQSZACIVSA-N	234.343	1.709	10	20	BDCD	
C[C@H]1[C@@H](C)N(Cc2ccccc2O)CCN1C	775985863	PGZKXTOGCMQLMF-NWDGAFQWSA-N	234.343	1.917	10	20	BDCD	
Cc1ccc(CNC/C=C\CO)c(O)c1	877624059	IFYBJGIXTDUVON-IHWYPQMZSA-N	207.273	1.339	10	20	BDCD	
CC(=O)C(=O)Cn1c(C)nc2c1CCCC2	1327183679	LGWNLVBOPZRDDX-UHFFFAOYSA-N	220.272	1.228	10	20	BDCD	
C[C@@H](CC(=O)O)N[C@@H]1CCc2cccc(O)c21	1609888474	MKXGPOVVPDNROH-WCBMZHEXSA-N	235.283	1.832	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)[C@H](C)CN1C	1120371045	NSKVUXFKFFFPJV-NWDGAFQWSA-N	233.359	1.793	10	20	BDCD	
C[C@H](NCCC(=O)O)c1cc(F)cc(F)c1O	1589127052	UTLUHPHEFYGGPD-LURJTMIESA-N	245.225	1.796	10	20	BDCD	
COc1ccc(N(C)CCOCCN)cc1F	843359215	NGBXYVZZPLADOA-UHFFFAOYSA-N	242.294	1.246	10	20	BDCD	
CCOC[C@H](O)CNc1ccccc1OCC	69276560	XWGPVBBDZJAUIK-LLVKDONJSA-N	239.315	1.895	10	20	BDCD	
C[C@@H]1C[C@@H]1C(=O)NCc1ccc(O)c(O)c1	158898096	FRQQLKZUSDGAPU-APPZFPTMSA-N	221.256	1.370	10	20	BDCD	
COc1ccc(CNCc2nncn2C)cc1C	37989086	BWHWQTWXVLIFBU-UHFFFAOYSA-N	246.314	1.422	10	20	BDCD	
COc1cccc(CNCC2(O)CCC2)c1O	134518048	YLONMAPDKSJUJF-UHFFFAOYSA-N	237.299	1.405	10	20	BDCD	
Cc1cc(CN2CCN[C@@H](C)C2)ccc1N(C)C	923292448	YEWUTJQEOMDNBE-ZDUSSCGKSA-N	247.386	1.855	10	20	BDCD	
CNC[C@@H](C)N[C@H](C)c1cc(C)ccc1O	854233094	XMEXQAOZVZJPAM-GHMZBOCLSA-N	222.332	1.959	10	20	BDCD	
CC1(S(=O)(=O)NCc2ccccc2O)CC1	696348132	BSMKPFIZFBJOPY-UHFFFAOYSA-N	241.312	1.364	10	20	BDCD	
Cc1ccc(CN[C@H](CO)CC(F)F)c(O)c1	877479305	UYPUWOUVDCGYRT-JTQLQIEISA-N	245.269	1.806	10	20	BDCD	
C/C=C/C[C@@H](CO)NC(=O)c1cc(O)cs1	771742217	BJQNXRDKYYSTNT-SGJFDWMWSA-N	241.312	1.511	10	20	BDCD	
CNC(=O)C1(NCc2ccccc2O)CCCC1	779173072	AOYBXIHVADVTHJ-UHFFFAOYSA-N	248.326	1.541	10	20	BDCD	
O=C(O)CNCc1ccc2c(c1)CCCO2	82598930	UGDLSIRFZUCYPW-UHFFFAOYSA-N	221.256	1.186	10	20	BDCD	
CN1CCC(NCc2cc(F)ccc2O)CC1	83366100	DVKWGADEASJGNA-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
COC(=O)CN[C@H](C)c1cc(OC)ccc1O	19885507	YHFGHMNVBXATJG-MRVPVSSYSA-N	239.271	1.224	10	20	BDCD	
CC[C@@H](CO)NCc1cccc(Cl)c1O	162826117	FJMVWYLFCNOFOC-VIFPVBQESA-N	229.707	1.906	10	20	BDCD	
CCn1cnnc1CN[C@@H](C)c1ccccc1O	228791317	YBTYOYYAPVLCOZ-JTQLQIEISA-N	246.314	1.854	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CCC[C@H]2O)c1	323484003	AOBBQSMLODATEA-DGCLKSJQSA-N	237.299	1.404	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@](C)(O)C2)cc1	180183156	FPSUVSZHBYXAFL-AWEZNQCLSA-N	234.343	1.709	10	20	BDCD	
C[C@H](N[C@@H]1CCNC1)c1ccc(F)cc1O	817945072	SPMLADFWIXWHQA-WCBMZHEXSA-N	224.279	1.544	10	20	BDCD	
NCC[C@H](NCc1cc(F)ccc1O)C(F)F	841074404	PMAFEBRYCDAJNL-VIFPVBQESA-N	248.248	1.603	10	20	BDCD	
N[C@H]1CCCN(Cc2cccc(F)c2O)C1	843043697	DCFGRELQECGGIA-JTQLQIEISA-N	224.279	1.454	10	20	BDCD	
Cc1ccc(CN[C@H](C)c2ncnn2C)c(O)c1	877469784	YZGJLWRXBPDSFG-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
C/C=C\COC(=O)c1cccc(O)c1O	776282087	NSOAGSBLEVNRLI-IHWYPQMZSA-N	208.213	1.831	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@@H](N)C1)c1ccccc1O	873252853	WNBKXIXRKZEJIZ-MXWKQRLJSA-N	220.316	1.780	10	20	BDCD	
C[C@@H](N)C(=O)NCc1ccc(N2CCCC2)cc1	83884421	UHRBBODRIIHMSS-LLVKDONJSA-N	247.342	1.250	10	20	BDCD	
Cc1cccc(CN2C[C@H]3COC[C@H]3C2)c1O	718252281	XXCNKCAQQGDMQR-BETUJISGSA-N	233.311	1.779	10	20	BDCD	
COC(=O)[C@@H]1CCN(Cc2ccc(N)cc2)[C@@H]1C	1335290430	WJWKAZAPSZOMAY-ZWNOBZJWSA-N	248.326	1.652	10	20	BDCD	
CCCC[C@H](CN)NCc1ccc(N)cc1	1352790088	OJPUTUXKBCYLOT-CYBMUJFWSA-N	221.348	1.876	10	20	BDCD	
CNC[C@@H]1CCCN1Cc1cc(F)ccc1O	220322890	MUEBSCHYTIBLAF-LBPRGKRZSA-N	238.306	1.715	10	20	BDCD	
CNC(=O)[C@@H]1CCCN(Cc2ccc(N)cc2)C1	232278504	HHNIZYJVFSXLPY-GFCCVEGCSA-N	247.342	1.227	10	20	BDCD	
CC1(C)[C@H]2CN(C(=O)c3cccc(O)c3O)C[C@@H]21	193097113	WVJJDVGOQSWPLF-UWVGGRQHSA-N	247.294	1.826	10	20	BDCD	
COc1cccc(CN[C@H]2COC[C@H]2C)c1O	699792031	VBQQRQYFFYCYBY-KOLCDFICSA-N	237.299	1.525	10	20	BDCD	
CCc1cccc(CN[C@@H]2CC[C@H]2O)c1O	848917977	LYJGJLREVIHBEF-VXGBXAGGSA-N	221.300	1.568	10	20	BDCD	
CC[C@@H](C)N(CC(=O)O)Cc1ccc(N)cc1	1604961343	ITLOMPQXXUYBCC-SNVBAGLBSA-N	236.315	1.954	10	20	BDCD	
C[C@H](NC(=O)[C@H]1CCC[C@H]1N)c1ccccc1O	1579482740	SAFYUEUXMXKPBF-ZMLRMANQSA-N	248.326	1.697	10	20	BDCD	
Nc1ccc(CC(=O)NCCOCC2CC2)cc1	226325840	ZNGDYDUGWORCBI-UHFFFAOYSA-N	248.326	1.354	10	20	BDCD	
CC(C)=CC(=O)NCc1ccc(N)cc1	135438633	BIVFQDJZBCVZLU-UHFFFAOYSA-N	204.273	1.851	10	20	BDCD	
CNC[C@H]1CCCN1C(=O)Cc1ccc(N)cc1	161192617	NELWLMKIBGMYRN-CYBMUJFWSA-N	247.342	1.022	10	20	BDCD	
CN(Cc1ccccc1O)Cc1cnnn1C	91956508	MKABZTVGDLTSBU-UHFFFAOYSA-N	232.287	1.153	10	20	BDCD	
Cc1cc(O)c([C@H]2NC(=O)CN2C)cc1C	266219198	PTSQVLNQVROBPO-LBPRGKRZSA-N	220.272	1.069	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2C[C@]23CCNC3)cc1	376245053	OQIDGYIHSVUQHU-AAEUAGOBSA-N	231.299	1.207	10	20	BDCD	
CC[C@H](N)CN[C@H](C)c1cc(F)ccc1O	817979279	JMLJGCGPIZNPGV-SCZZXKLOSA-N	226.295	1.919	10	20	BDCD	
CCN(C[C@H](C)OC)C(=O)c1cc(O)cs1	812778146	HAFKFLDLQFREMO-QMMMGPOBSA-N	243.328	1.951	10	20	BDCD	
C[C@H](N)C[C@@H](C)NCCc1ccc(N)cc1	817957706	OJXZJKQEDWOGGP-WDEREUQCSA-N	221.348	1.527	10	20	BDCD	
Cc1ccc(C(=O)N2CC(F)C2)c(O)c1O	753073606	DSVIVGDQZOJFST-UHFFFAOYSA-N	225.219	1.200	10	20	BDCD	
CN(CCNCc1ccccc1O)CC(F)F	858336605	NFQXVPHVFKKXAZ-UHFFFAOYSA-N	244.285	1.679	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@@](C)(O)C1	769541440	BFILHFLJJYUQEH-CYBMUJFWSA-N	237.299	1.358	10	20	BDCD	
O=C(N[C@@H]1CCCOCC1)c1cc(O)cs1	776498339	JXPYZCBDSAVVDG-MRVPVSSYSA-N	241.312	1.753	10	20	BDCD	
c1cnc(CNCc2ccc3c(c2)CCO3)cn1	698104005	ZIMGYSJHGUIKOE-UHFFFAOYSA-N	241.294	1.701	10	20	BDCD	
COc1cccc(O)c1CNC[C@@H]1CCN1C	922575768	MZJLDRHJSBZTOK-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
COc1ccc(N2CC[C@H](CNC(C)=O)C2)cc1	62574803	CJJWAEGYKMMAAU-GFCCVEGCSA-N	248.326	1.658	10	20	BDCD	
CCOc1ccccc1NC[C@@H](O)COC	68891310	CPDSYWHAAFLACK-SNVBAGLBSA-N	225.288	1.505	10	20	BDCD	
CC[C@H](CCO)NCc1ccc2c(c1)CCO2	77453698	SBUZPCDBMYWKPN-CYBMUJFWSA-N	235.327	1.872	10	20	BDCD	
Cc1noc(NC(=O)c2cccc(O)c2O)n1	126562500	AHULFFOYAUAADM-UHFFFAOYSA-N	235.199	1.042	10	20	BDCD	
CC(C)CC(=O)NCCc1ccc(N)cc1	32013774	BTPDAHGDIYDCEN-UHFFFAOYSA-N	220.316	1.974	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C2CC=CC2)c1	77615030	VNWLRNQWSSCKIM-UHFFFAOYSA-N	247.294	1.983	10	20	BDCD	
Nc1ccc(CN2CCN(CC3CC3)CC2)cc1	44384014	RLTBXAZAXLBNIB-UHFFFAOYSA-N	245.370	1.796	10	20	BDCD	
CN1CC[C@H](Sc2nccs2)C1=O	265218939	RKNNBQDOSWZGRK-LURJTMIESA-N	214.315	1.466	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C1(CO)CC1	827903782	OVWLLVZVWOPFHP-UHFFFAOYSA-N	225.263	1.488	10	20	BDCD	
COC(=O)NCCCSc1nccs1	733972313	CMFGEALBLGYENZ-UHFFFAOYSA-N	232.330	1.981	10	20	BDCD	
C[C@@H](NC(=O)C(C)(C)CO)c1ccccc1O	827941469	SEZLKNRBPMGWTA-SECBINFHSA-N	237.299	1.588	10	20	BDCD	
CN(C(=O)c1cc(O)cs1)c1cn[nH]c1	748396199	ZRCLIDZMDMCZKQ-UHFFFAOYSA-N	223.257	1.453	10	20	BDCD	
N[C@H]1C[C@@H](CN[C@@H]2CCc3cccc(O)c32)C1	873249907	NJAQSOLUJJUPBW-ADEWGFFLSA-N	232.327	1.706	10	20	BDCD	
Oc1ccc(F)cc1CN[C@H]1C[C@H](O)C1	827827454	VIVNSDBVGHKUMF-MGCOHNPYSA-N	211.236	1.144	10	20	BDCD	
c1csc(Sc2ncnc3[nH]ncc23)n1	301108469	VEWCWBZJECJSIB-UHFFFAOYSA-N	235.297	1.961	10	20	BDCD	
C[C@@H](CN(C)C)NCc1ccc2c(c1)CCO2	135598906	TWVJPNOMFUXRRD-NSHDSACASA-N	234.343	1.661	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)CCO)c1	132517190	SNCVBTVCDSRCNY-SECBINFHSA-N	225.288	1.261	10	20	BDCD	
C[C@@H](N[C@@H]1CCN(C)C1)c1ccccc1O	42544119	APWITNXQFKBVDN-GHMZBOCLSA-N	220.316	1.747	10	20	BDCD	
COc1cccc(CN2CC(C)(OC)C2)c1O	813330806	AUYWNGNBDKIKMT-UHFFFAOYSA-N	237.299	1.622	10	20	BDCD	
O=C(NC1CCOCC1)c1cc(O)cs1	732273950	MFRYLNKHVQZGIJ-UHFFFAOYSA-N	227.285	1.363	10	20	BDCD	
CC1(C)COCCN1C(=O)c1cc(O)cs1	823454679	KEFOGIDDUCKKJK-UHFFFAOYSA-N	241.312	1.705	10	20	BDCD	
CCOc1ccc(CN[C@@H](C)CCN)c(O)c1	841050924	KZJSINUUOMNDLW-JTQLQIEISA-N	238.331	1.618	10	20	BDCD	
CO[C@@H](C(=O)N[C@H](C)c1ccccc1O)C1CC1	827946836	STPONYFXWYKOTQ-NOZJJQNGSA-N	249.310	1.994	10	20	BDCD	
C[C@@H](NCc1cnon1)c1ccc(N(C)C)cc1	851951560	YTSBUROIKARQMO-SNVBAGLBSA-N	246.314	1.986	10	20	BDCD	
COCCOCCNCc1ccc(C)cc1O	876968975	LNOCQPUMRZAMSD-UHFFFAOYSA-N	239.315	1.453	10	20	BDCD	
CCN(CCO)Cc1cc(Cl)cc(F)c1O	775639363	VSDZSHSYIULCJV-UHFFFAOYSA-N	247.697	1.999	10	20	BDCD	
CN(C)c1ccc(CNC(=N)NCC2CC2)cc1	887347538	ZEAZWSNOKMFIKV-UHFFFAOYSA-N	246.358	1.777	10	20	BDCD	
CN(Cc1ccc(N)cc1)Cc1cnn(C)c1	42488502	BLTOBGVLJWJJJZ-UHFFFAOYSA-N	230.315	1.634	10	20	BDCD	
CCN(CC(=O)O)Cc1ccc(N)cc1	1596226376	YGAGXWNLHHDKSX-UHFFFAOYSA-N	208.261	1.175	10	20	BDCD	
Cc1ccc([C@H](C)NCc2cnnn2C)c(O)c1	287467598	WCWUVCXMSZZQQG-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
CN(C)CCN(C)Cc1cc(F)cc(F)c1O	708414206	PCUQAUVPZOWXQF-UHFFFAOYSA-N	244.285	1.664	10	20	BDCD	
C[C@H]1[C@@H](C)OCCN1C(=O)Nc1ccc(N)cc1	380584700	ZHTRAVQSTHUXEM-VHSXEESVSA-N	249.314	1.910	10	20	BDCD	
CC1(C)NCC[C@@H]1NCc1ccccc1O	841085550	GSUWNTIFNQKNRP-LBPRGKRZSA-N	220.316	1.622	10	20	BDCD	
CN(Cc1ccc(N2CCOCC2)cc1)C(N)=O	73137616	DBHOIRNRJHRWJT-UHFFFAOYSA-N	249.314	1.034	10	20	BDCD	
COc1cccc(CN[C@H]2CCOC2)c1O	87784617	YZAXLUWBVRWCBL-JTQLQIEISA-N	223.272	1.279	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@@H](N)C1	91545526	AKGMIZGFTKWHHO-ZYHUDNBSSA-N	248.326	1.478	10	20	BDCD	
CC(C)(O)CN[C@H]1CCc2cccc(O)c21	297880737	VBZHQOMRGPWBKQ-JTQLQIEISA-N	221.300	1.740	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cc2ccccc2[nH]1	808485659	UFUNDPNPAMOYKW-UHFFFAOYSA-N	245.234	1.483	10	20	BDCD	
CCOc1ccc(O)c(CN[C@H](C)C(=O)O)c1	739503081	BEIPTDOCZNHRFM-MRVPVSSYSA-N	239.271	1.354	10	20	BDCD	
CCC[C@@H](CCO)NC(=O)c1cc(O)cs1	869869411	ZWSOZWVICMONQV-QMMMGPOBSA-N	243.328	1.735	10	20	BDCD	
COC[C@H](CCO)NCc1c(C)cccc1O	877048317	KSAHLSMDHNTZNA-NSHDSACASA-N	239.315	1.188	10	20	BDCD	
C[C@@H](C(=O)NC1CC1)N(C)Cc1ccccc1O	109773587	JTSYZOGFPJUQEV-JTQLQIEISA-N	248.326	1.491	10	20	BDCD	
Cc1cccc(CN(C)CCN(C)C)c1O	165418180	WIUZQONKWMQFDP-UHFFFAOYSA-N	222.332	1.694	10	20	BDCD	
COCCN(CCOC)Cc1ccc(N)cc1	36197501	MTSGXSWIKOKTHF-UHFFFAOYSA-N	238.331	1.364	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCOC1	66918522	AKUNFEMBGLLAOC-NSHDSACASA-N	235.283	1.387	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2ccccc2O)CO1	401968299	IBLUXNBKZIKOMC-MWLCHTKSSA-N	207.273	1.659	10	20	BDCD	
COC[C@@H](C)N(C)Cc1cc(F)ccc1O	179946260	XPYAMPIHHQYYAI-SECBINFHSA-N	227.279	1.998	10	20	BDCD	
CC(C)N(CC(N)=O)Cc1ccc(N(C)C)cc1	121627132	WALKUKJTXDMVRC-UHFFFAOYSA-N	249.358	1.448	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)[C@H](C)CO1	35782348	RXBTWGKUODNCHA-MNOVXSKESA-N	248.326	1.447	10	20	BDCD	
C[C@@H](CC[S@](C)=O)NCc1ccccc1O	131297539	RIHUFTMVZIWJMN-MGPLVRAMSA-N	241.356	1.639	10	20	BDCD	
C[C@@H]1OCC[C@@]1(C)NC(=O)Nc1ccc(N)cc1	235415720	BSSTUCMMGFMUNW-TVQRCGJNSA-N	249.314	1.958	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)CCC(N)=O	840946543	QJWIHZUSNSORKP-UHFFFAOYSA-N	249.358	1.368	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@H]1CCC=CO1	910949673	OOLLURCBTZEZGT-GFCCVEGCSA-N	249.266	1.407	10	20	BDCD	
CCN(C)c1ccc(CN2CC[C@@H](CO)C2)cc1	773752089	HVLWIQKJBMJONB-CQSZACIVSA-N	248.370	1.957	10	20	BDCD	
CC(C)c1noc(CN2CC(N=[N+]=[N-])C2)n1	409422595	GNXKWXQEQLTWML-UHFFFAOYSA-N	222.252	1.688	10	20	BDCD	
CCN(OC)C(=O)c1ccc(C)c(O)c1O	1347836162	CZEYPFMKTAEMLN-UHFFFAOYSA-N	225.244	1.430	10	20	BDCD	
CSC[C@H](C)NC(=O)c1cccc(O)c1O	163278256	HFKSICAAIZNJOJ-ZETCQYMHSA-N	241.312	1.579	10	20	BDCD	
CN(C)C(=O)CCN[C@@H]1CCc2cccc(O)c21	297542538	FELINGIBGLXNNQ-LLVKDONJSA-N	248.326	1.447	10	20	BDCD	
C[C@]1(CO)CCCN(Cc2ccc(N)cc2)C1	688702224	XCBVIXLPCKDHOV-AWEZNQCLSA-N	234.343	1.863	10	20	BDCD	
CCOc1ccc(O)c(CNCC(C)(C)O)c1	111385528	ZDZKLLAALYXLQQ-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
C[C@@H]1C[C@@H](CN)CN1Cc1ccc(N(C)C)cc1	216058743	JZIPFPQVEOOPHS-OCCSQVGLSA-N	247.386	1.922	10	20	BDCD	
Cc1cccc(CNCC(=O)NC(C)C)c1O	124640742	POGSTTCJZHWMEO-UHFFFAOYSA-N	236.315	1.315	10	20	BDCD	
C[C@H](NC[C@@H]1COCCO1)c1ccccc1O	38060522	RGYADTQDGYJZCU-WDEREUQCSA-N	237.299	1.458	10	20	BDCD	
CCNC(=O)[C@@H](C)NCc1ccc(N(C)C)cc1	35134261	HOGDKJPXXKWUCV-LLVKDONJSA-N	249.358	1.367	10	20	BDCD	
C[C@@H](NC[C@@]1(O)CCOC1)c1ccccc1O	183629691	JOQGPRGPCPOCSW-MFKMUULPSA-N	237.299	1.194	10	20	BDCD	
CN(C)c1ccc(CNCc2ncc[nH]2)cc1	49714722	HGLQIVCTRCNMGX-UHFFFAOYSA-N	230.315	1.766	10	20	BDCD	
CC1=NO[C@@H](CNCc2cc(F)ccc2O)C1	826567401	XVIHQRWAUVPTKB-LLVKDONJSA-N	238.262	1.786	10	20	BDCD	
C[C@H]1CNCCN1Cc1cc(F)ccc1O	722393973	CNXVPUGWLJKLRA-VIFPVBQESA-N	224.279	1.325	10	20	BDCD	
CON(C)CCCNC(=O)c1cc(O)cs1	824572955	ABQPQESNKIKLNO-UHFFFAOYSA-N	244.316	1.067	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCCCON)c1	902425324	LZKWNYNZSYNYBI-VIFPVBQESA-N	240.303	1.332	10	20	BDCD	
c1cc(N2CCCC2)ccc1CN[C@@H]1CCNC1	841045514	XOALYSPSIXPVJU-CQSZACIVSA-N	245.370	1.738	10	20	BDCD	
COCCOCCNCc1c(C)cccc1O	876968706	JQPMJHRQWBYYFM-UHFFFAOYSA-N	239.315	1.453	10	20	BDCD	
Nc1ccc(NC(=O)c2cn(C3CC3)nn2)cc1	876504679	SXFNZEJNOULHQW-UHFFFAOYSA-N	243.270	1.448	10	20	BDCD	
C[C@@H]1[C@@H](C)N(Cc2ccccc2O)CCN1C	775985865	PGZKXTOGCMQLMF-VXGBXAGGSA-N	234.343	1.917	10	20	BDCD	
O=C(Cc1ccco1)NCc1ccc(O)c(O)c1	778916274	AJGOITRPKDWDAG-UHFFFAOYSA-N	247.250	1.550	10	20	BDCD	
CC(C)(CNCc1ccc2c(c1)CCO2)C(=O)O	258840895	MXDICYTXBPCJJK-UHFFFAOYSA-N	249.310	1.822	10	20	BDCD	
O=C1NCCC[C@@H]1CNCc1ccccc1O	839196651	WRUOOWZWTLRZAW-LLVKDONJSA-N	234.299	1.008	10	20	BDCD	
CO[C@@H]1CCN(Cc2ccc(N)cc2)C1	146378337	IYCRMSLSQUGCHF-GFCCVEGCSA-N	206.289	1.490	10	20	BDCD	
CCOCCN(C)Cc1ccc(N)cc1	35360488	KXMYNFCXVDMULW-UHFFFAOYSA-N	208.305	1.737	10	20	BDCD	
Cc1ccc(O)c(CN2CCN(C)CC2)c1	34217515	IGQYWSPZTBDXQL-UHFFFAOYSA-N	220.316	1.448	10	20	BDCD	
CCOCCNCc1cccc(OC)c1O	36229034	WEKHGADVCDETSN-UHFFFAOYSA-N	225.288	1.527	10	20	BDCD	
COc1cccc(CNC[C@@H](O)C2CC2)c1O	71299568	LWABOBRPCLWZKV-LLVKDONJSA-N	237.299	1.261	10	20	BDCD	
CCNC(=O)CN(C)c1ccc(OC)c(F)c1	131434111	DXIRQUMPFJBBCH-UHFFFAOYSA-N	240.278	1.407	10	20	BDCD	
O=C(NCc1ccccc1O)C(F)(F)F	82277870	OWOFCPOGSIRNBP-UHFFFAOYSA-N	219.162	1.571	10	20	BDCD	
COc1ccc(CNCC2(CO)CC2)cc1C	80246580	PXGDZLHIERMDFB-UHFFFAOYSA-N	235.327	1.866	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@@H]2CCCO2)cc1	87206460	OJEUUCYDHFLAOA-LBPRGKRZSA-N	234.299	1.454	10	20	BDCD	
CN1CC[C@@H]2CCN(Cc3ccccc3O)[C@@H]2C1	272699122	YGCJJBYKJFOWPC-TZMCWYRMSA-N	246.354	1.918	10	20	BDCD	
COc1cc(O)c(CN[C@@H](C)CF)cc1OC	289247166	ASGBKBGWCHUWTA-QMMMGPOBSA-N	243.278	1.857	10	20	BDCD	
CCOC1CN(Cc2ccccc2O)C1	297492942	UEXXUYMYCZVBED-UHFFFAOYSA-N	207.273	1.613	10	20	BDCD	
C[C@H]1CCNCC[C@H]1NCCc1ccc(N)cc1	817958213	SZESUKHNLPPXMO-SWLSCSKDSA-N	247.386	1.789	10	20	BDCD	
CCO/C=C/C(=O)NCc1ccc(O)c(O)c1	847591820	ZWDHBXNEBUFFMS-AATRIKPKSA-N	237.255	1.264	10	20	BDCD	
CCOc1ccc(N(C)Cc2cn(C)nn2)cc1	761663710	YKSASQIDAOXARQ-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
Cc1ccc(CNC2([C@H](C)O)CC2)c(O)c1	877637479	IWDDSGWBJIZKMN-JTQLQIEISA-N	221.300	1.704	10	20	BDCD	
CO[C@H](C)CC(=O)NCc1ccc(O)c(O)c1	778919496	FXPYBSHCBNFJHF-MRVPVSSYSA-N	239.271	1.139	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)OCCF)c1	1118877153	BDNMYVXQGOSWFT-UHFFFAOYSA-N	227.235	1.896	10	20	BDCD	
O=C(OCCn1ccnc1)c1cc(O)cs1	771957398	HKEIRFUUKDBSAI-UHFFFAOYSA-N	238.268	1.507	10	20	BDCD	
C[C@@H](NCc1nncn1C)c1ccccc1O	38007599	XZDXUDHVSZOJMG-SECBINFHSA-N	232.287	1.372	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@@H](C(F)F)C1	409433074	XFSXVJBKGXBXRR-RXMQYKEDSA-N	204.180	1.410	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H]2CCCCN2)cc1	131836892	GHLSLZKBCURNCB-CYBMUJFWSA-N	247.342	1.070	10	20	BDCD	
COc1ccc(N(C)C[C@@H](C)N)cc1F	258648321	AIKJTILNOSBOTM-MRVPVSSYSA-N	212.268	1.618	10	20	BDCD	
CCOc1ccc(N(C)CCOCCN)cc1	843358928	GPQBNBPTHDUECB-UHFFFAOYSA-N	238.331	1.497	10	20	BDCD	
CC1(C)NCC[C@@H]1NCc1ccc2c(c1)CCO2	841086330	NBFNINSPLADPTF-AWEZNQCLSA-N	246.354	1.852	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1ccc[nH]1	119970559	UFTCIQGHKCYVCP-UHFFFAOYSA-N	230.267	1.993	10	20	BDCD	
Oc1cccc(Cl)c1CNCCN1CCC1	309647510	RBKQHRBEPIVAHW-UHFFFAOYSA-N	240.734	1.841	10	20	BDCD	
C[C@H](O)[C@H]1CCCN(Cc2ccc(N)cc2)C1	688874704	GFDFBBNTYGUYBJ-AAEUAGOBSA-N	234.343	1.862	10	20	BDCD	
Oc1ccccc1CNCCc1cnccn1	389983343	YVRDYYVZPTZXNU-UHFFFAOYSA-N	229.283	1.515	10	20	BDCD	
CN(C)c1ccc(CNCCN2CCCC2)cc1	20126715	BYODYHMGHQQMFZ-UHFFFAOYSA-N	247.386	1.938	10	20	BDCD	
C[C@@H](NCCCO)c1ccc(F)cc1O	62745301	GEUUHYINOYKGMH-MRVPVSSYSA-N	213.252	1.564	10	20	BDCD	
COC(=O)[C@@H](C)N[C@H](C)c1ccccc1O	42304480	HAFQKTKSEYRFPV-RKDXNWHRSA-N	223.272	1.604	10	20	BDCD	
CN(C)c1ccc(CNC(=O)CCCN)cc1	40825802	WADSLBXDRKCUAI-UHFFFAOYSA-N	235.331	1.108	10	20	BDCD	
C[C@@H](CCCO)CNCc1ccccc1O	294923801	YXSXZNNHFBFAGS-NSHDSACASA-N	223.316	1.890	10	20	BDCD	
C[C@@H](Sc1nccs1)C(=O)N(C)C	299045151	NZSIFDCRWFHASX-ZCFIWIBFSA-N	216.331	1.712	10	20	BDCD	
CCN(Cc1nc(=O)[nH][nH]1)c1ccc(OC)cc1	271663831	YLZJCRFGXNHDNW-UHFFFAOYSA-N	248.286	1.133	10	20	BDCD	
CCOc1ccc(O)c(CN[C@H]2[C@@H]3CNC[C@@H]32)c1	841079128	ZCXOGYYKUYNSLR-IMRBUKKESA-N	248.326	1.098	10	20	BDCD	
N[C@@H](CNCc1cccc(Cl)c1O)C1CC1	841048047	BKAFASKGXAMUJI-NSHDSACASA-N	240.734	1.873	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCC[C@H]2N)cc1	852790455	QNPGOKUCMFDWFB-WDEREUQCSA-N	219.288	1.335	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)C2)c1	862755509	UQTSNIROANKIKO-JTQLQIEISA-N	247.294	1.686	10	20	BDCD	
COC(=O)C1(C)CN(Cc2ccc(C)cc2O)C1	877599471	AQXBZJRTKIOAFI-UHFFFAOYSA-N	249.310	1.696	10	20	BDCD	
CCOc1ccc(N2N=C(C(C)=O)CC2=O)cc1	871943500	KPHOQWLUKJQNJS-UHFFFAOYSA-N	246.266	1.767	10	20	BDCD	
CC(=O)OC[C@H](C)NCc1ccccc1O	892792711	UEXRAYXWEDQQHN-VIFPVBQESA-N	223.272	1.433	10	20	BDCD	
COCCC(=O)N(C)c1ccc(N)cc1	53730698	HKGULCVFWRVMSC-UHFFFAOYSA-N	208.261	1.268	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCCCCN)c1	37714912	PZJLGNBVCOPNTA-SNVBAGLBSA-N	238.331	1.790	10	20	BDCD	
CCCn1cc(CNCc2ccccc2O)nn1	714497333	FGBBBLVOTICJFZ-UHFFFAOYSA-N	246.314	1.684	10	20	BDCD	
CCc1cccc(CNC[C@H]2C[C@@H](O)C2)c1O	720995269	OUHOAIMNBQVMOZ-GSJFWJNXSA-N	235.327	1.815	10	20	BDCD	
O=C(O)CCNCc1cc(F)c(F)cc1O	1606201284	FIEFPXXIZZAFOP-UHFFFAOYSA-N	231.198	1.235	10	20	BDCD	
C[C@@H]1NCCN(Cc2cc(F)ccc2O)[C@@H]1C	379439311	PWTSYSAGSOBINC-VHSXEESVSA-N	238.306	1.714	10	20	BDCD	
CN(C)c1ccc(CN[C@@H](CO)C2CC2)cc1	734161567	VSNZFTDNTAXVME-AWEZNQCLSA-N	234.343	1.613	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2ccon2)c1	114544024	YNLFWPMPFOHCCS-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
C[C@H](NC[C@H]1COCCO1)c1ccccc1O	38060524	RGYADTQDGYJZCU-QWRGUYRKSA-N	237.299	1.458	10	20	BDCD	
Cc1nccn1CC(=O)c1ccc(O)c(O)c1	36389219	KSGAXVJQIURHFA-UHFFFAOYSA-N	232.239	1.486	10	20	BDCD	
CC[C@H](O)CCNCc1ccccc1O	131701964	MTOUGAIKRSRFFX-NSHDSACASA-N	209.289	1.643	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@H]1CCOC1	41046011	SWOOMXJUSVTUIT-GFCCVEGCSA-N	220.316	1.737	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1ccc(N(C)C)cc1	295150877	RDBSMFOJRKHLGT-ZDUSSCGKSA-N	236.359	1.955	10	20	BDCD	
Oc1ccccc1CN1CCOCC12CC2	802658447	BEIPIBVMDFMZFF-UHFFFAOYSA-N	219.284	1.757	10	20	BDCD	
C[C@@H](N)C[C@@H](C)NCc1ccc2c(c1)CCO2	817902093	HZLRPDIFJKBNBF-GHMZBOCLSA-N	234.343	1.837	10	20	BDCD	
Cc1cc(O)c(CN2CCCNC(=O)C2)cc1C	769116060	SCGBFBCSRZZVAG-UHFFFAOYSA-N	248.326	1.331	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC(CCF)CC1	409425122	FBGNAMPTIIOOBF-UHFFFAOYSA-N	214.244	1.895	10	20	BDCD	
Nc1ccc(CN2[C@H]3CC[C@H]2COC3)cc1	695056410	KMXNNGFLSVRKIV-STQMWFEESA-N	218.300	1.632	10	20	BDCD	
C[C@@H]1COC[C@H]1NC(=O)NCc1ccc(N)cc1	1336978814	VXSUZKAQTHRSOB-BXKDBHETSA-N	249.314	1.103	10	20	BDCD	
CC[C@@H](F)C(=O)NCc1cccc(OC)c1O	1353620221	XGVPZDZSMJXHNX-SECBINFHSA-N	241.262	1.765	10	20	BDCD	
COC[C@H](CO)NCc1ccc(OC)c(C)c1	234793151	XKLFFSVHHRQAQA-LBPRGKRZSA-N	239.315	1.101	10	20	BDCD	
C[C@@H](NCc1cn(C)cn1)c1ccccc1O	851895212	CCGWRXPANCGYTC-SNVBAGLBSA-N	231.299	1.977	10	20	BDCD	
CN[C@@H]1CCCN(Cc2ccccc2O)C1	53201577	QRDBOWAMQSERFB-GFCCVEGCSA-N	220.316	1.576	10	20	BDCD	
C[C@@H](CCO)NCc1ccc(N(C)C)c(F)c1	119654443	YSNGHHGMFFIHDR-JTQLQIEISA-N	240.322	1.752	10	20	BDCD	
CC[C@@H](C(=O)Nc1ccc(N)cc1)N(C)C	62460928	AOKIZTRXJWOUFJ-NSHDSACASA-N	221.304	1.548	10	20	BDCD	
COC[C@H](C)N(C)C(=O)Cc1ccc(N)cc1	37815703	CDEQMHSSNBHHBF-JTQLQIEISA-N	236.315	1.305	10	20	BDCD	
Oc1ccccc1CNC[C@@H]1CCCN1	229321433	BLWRWDSYQPBREM-NSHDSACASA-N	206.289	1.234	10	20	BDCD	
CC[C@H](C(=O)OCC(=O)C(C)=O)c1ccccc1	808487299	ZNZBYLPATRGPQC-LBPRGKRZSA-N	248.278	1.882	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)[C@@H]1CCCN1	817958523	WPLYWENEEABAMI-RISCZKNCSA-N	233.359	1.541	10	20	BDCD	
Oc1cc2c(cc1CN1CC[C@@H]3C[C@@H]3C1)OCO2	853581667	WXJYUGCPYSAQGL-NXEZZACHSA-N	247.294	1.963	10	20	BDCD	
Oc1ccccc1CNC[C@H]1CCOC1	37738032	AUFJXIPUDALONE-SNVBAGLBSA-N	207.273	1.518	10	20	BDCD	
C[C@H](NC[C@H]1C[C@H](O)C1)c1cc(F)ccc1O	720951954	TVRWWJFQSJCONN-QXEWZRGKSA-N	239.290	1.953	10	20	BDCD	
C[C@H](CC(N)=O)N[C@H](C)c1ccccc1O	163988614	JRLIEGIHMNPHAY-RKDXNWHRSA-N	222.288	1.307	10	20	BDCD	
CC[C@@H](CCO)NCc1cc(F)cc(F)c1O	708484362	HJPPVMPZTLDUJP-JTQLQIEISA-N	245.269	1.921	10	20	BDCD	
Cc1ccc(CN[C@@H]2CCC[C@@H]2CO)c(O)c1	877575068	FSSSHXJYLPNBMT-CHWSQXEVSA-N	235.327	1.951	10	20	BDCD	
CCNc1nnc(SCC(=O)C(C)=O)s1	289807814	YXRKWEPKWZYOHG-UHFFFAOYSA-N	245.329	1.220	10	20	BDCD	
CSCCNC(=O)c1cccc(O)c1O	163274885	PZBBZYXJGFUEPB-UHFFFAOYSA-N	227.285	1.191	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CC1(CN)CC1	817921874	JVSRAWNWMACCMY-UHFFFAOYSA-N	248.326	1.480	10	20	BDCD	
CNCCN[C@H](C)c1cc(F)cc(F)c1O	817953199	WWQAKSGXIQXFOQ-SSDOTTSWSA-N	230.258	1.540	10	20	BDCD	
C[C@@H](NC(=O)[C@](C)(O)C1CC1)c1ccccc1O	827946287	CNPRXBNPJVGTKX-YMTOWFKASA-N	249.310	1.730	10	20	BDCD	
N[C@H]1C[C@H](NCc2cccc(F)c2O)C1	906518308	VQMUPZAJESZTTH-KYZUINATSA-N	210.252	1.111	10	20	BDCD	
CC(C)N(CC(=O)O)Cc1cccc(F)c1O	820015459	UUMVPWKXIGOHBZ-UHFFFAOYSA-N	241.262	1.826	10	20	BDCD	
COC1CN(Cc2ccc(N(C)C)c(F)c2)C1	839128487	QEDNKLSRNLMHEG-UHFFFAOYSA-N	238.306	1.722	10	20	BDCD	
C[C@@H](CN)CNCc1c(O)ccc(Cl)c1F	841047695	BSZSBOUZVIFEHL-ZETCQYMHSA-N	246.713	1.869	10	20	BDCD	
CCc1cccc(CN2CC[C@H](O)C2)c1O	848881643	QTVREAYXXJBDCP-LBPRGKRZSA-N	221.300	1.521	10	20	BDCD	
Cc1cccc(CN2CCC[C@H](CN)C2)c1O	843047854	YXDQSABYJFGVLZ-GFCCVEGCSA-N	234.343	1.871	10	20	BDCD	
COc1cc(C)cc(CNC2(C)COC2)c1O	895443440	JSMFSNBOXSLDGG-UHFFFAOYSA-N	237.299	1.588	10	20	BDCD	
CN(C)c1ccc(CNCc2csnn2)cc1	36902093	DATUMCLEFWVHPX-UHFFFAOYSA-N	248.355	1.894	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@H]2CC(=O)N(C)C2)c1	273564586	JCVRFFBKBLRGON-QWRGUYRKSA-N	248.326	1.582	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(N)cc2)C[C@H]1O	399920644	PNCBVAKSVJQEBQ-WCQYABFASA-N	220.316	1.472	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@@H](O)[C@@H](CCF)C1	409429948	IAMFCAMDQYJCIS-DTWKUNHWSA-N	216.260	1.339	10	20	BDCD	
C[C@@H](O)C[C@@H](C)NCc1cc(F)cc(F)c1O	708483610	DZBYWRCILWDAHC-HTQZYQBOSA-N	245.269	1.919	10	20	BDCD	
Cc1cc(CNC(=O)c2cccc(O)c2O)n[nH]1	716820281	SPBLMJZGQOAULZ-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
COc1cc(C)c(CN[C@H](C)C(=O)O)c(O)c1	1594054121	HWIPXWFCCQIIRK-MRVPVSSYSA-N	239.271	1.272	10	20	BDCD	
CCN(CC(=O)O)Cc1cc(C)cc(C)c1O	1596224893	ITBHBOABFUBJNH-UHFFFAOYSA-N	237.299	1.916	10	20	BDCD	
CC(=O)NCCCN[C@H](C)c1ccccc1O	179902635	PAGGDQKSZODYFA-SNVBAGLBSA-N	236.315	1.569	10	20	BDCD	
C[C@H](O)CCN[C@@H](C)c1ccccc1O	82992609	QNIYSYGPAIQBHS-UWVGGRQHSA-N	209.289	1.814	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)[C@H](C)CN1	83117997	QNEFQDUMHVTGAF-WDEREUQCSA-N	220.316	1.574	10	20	BDCD	
Cc1ccc(C(=O)N2CC[C@@H](C)C2)c(O)c1O	271266728	KYGUUEBSIWBKRL-MRVPVSSYSA-N	235.283	1.888	10	20	BDCD	
COC(=O)c1ccc(O)c([C@@H](C)NC2CC2)c1	273365833	DZNZFLMTTDQPBA-MRVPVSSYSA-N	235.283	1.992	10	20	BDCD	
CC(=O)C(=O)COC(=O)CCC1CCCC1	808488373	FGCACIOUPPCQDE-UHFFFAOYSA-N	226.272	1.658	10	20	BDCD	
N=C(NCc1ccccc1O)Nc1ccccn1	849057995	JKTXMSZOEZVIHV-UHFFFAOYSA-N	242.282	1.924	10	20	BDCD	
COc1cccc([C@@H](C)N[C@@H](C)CO)c1O	846148188	OZECMJFTQYRFQV-DTWKUNHWSA-N	225.288	1.432	10	20	BDCD	
C[C@@H](CCN)NCc1cccc(Cl)c1O	841052680	VVINBLGSRHCNNJ-QMMMGPOBSA-N	228.723	1.873	10	20	BDCD	
NCc1ccc2c(c1)CCCN2C[C@@H]1CCNC1	843351320	KBHZUHXEZWKBGY-CYBMUJFWSA-N	245.370	1.507	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2C)c1	862757344	PXVHBTIXFMGEFZ-MWLCHTKSSA-N	219.284	1.973	10	20	BDCD	
Cc1ccc(C(=O)NCCC(F)F)c(O)c1O	1124029319	YHDDIBTWKRCPMP-UHFFFAOYSA-N	245.225	1.791	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@H]1COCO1	894891072	XXALMZFFBNHMMU-VIFPVBQESA-N	245.225	1.133	10	20	BDCD	
CCOC(=O)c1cnc(SCCCO)s1	393762717	OOTJLFSJBAFFNN-UHFFFAOYSA-N	247.341	1.794	10	20	BDCD	
Cc1[nH]c(=O)c(C=O)c2cc(O)c(O)cc12	95828915	MRERTLOUNAVSMG-UHFFFAOYSA-N	219.196	1.060	10	20	BDCD	
CN1C[C@H]2CN(Cc3ccc(N)cc3)C[C@H]2C1	707015875	DRFHKZURYYFQIU-BETUJISGSA-N	231.343	1.262	10	20	BDCD	
Nc1ccc(NC(=O)C2(C(=O)O)CC2)cc1	1601216923	WGINBEZFGIJVRO-UHFFFAOYSA-N	220.228	1.072	10	20	BDCD	
C[C@H](O)[C@H]1CCN(Cc2ccc(N)cc2)C1	161633324	JNWIGMWTZLGXSS-JQWIXIFHSA-N	220.316	1.472	10	20	BDCD	
Nc1ccc(CCNC(=O)N[C@H]2C=CCC2)cc1	851663193	VORXJEYZIPMWTG-ZDUSSCGKSA-N	245.326	1.829	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccncn1	396987392	FCWZYTLLLPEGMP-UHFFFAOYSA-N	229.239	1.112	10	20	BDCD	
COc1ccc(CN[C@@H](C)CCO)c(O)c1	96811508	SIADBJTUWVECCJ-VIFPVBQESA-N	225.288	1.261	10	20	BDCD	
C[C@H](CO)N[C@@H]1CCc2cccc(O)c21	296196307	YTMGUYXZDVLFDU-PSASIEDQSA-N	207.273	1.350	10	20	BDCD	
Cc1ccc(C(=O)N2CCCOC2)c(O)c1O	297124743	PJIDMMWNZRNDQY-UHFFFAOYSA-N	237.255	1.226	10	20	BDCD	
C[C@H]1Cc2c(cccc2-c2nccn2C)C(=O)N1	656369663	RHFNVUBRIVBXHG-VIFPVBQESA-N	241.294	1.762	10	20	BDCD	
CC(=O)OC(C)(C)C(=O)Nc1ccc(N)cc1	904925746	KPYOJBSBYBTTHC-UHFFFAOYSA-N	236.271	1.549	10	20	BDCD	
CNC(=O)NCc1ccc(N(C)C)cc1C	734651852	CPLBLBVZUHVVJG-UHFFFAOYSA-N	221.304	1.490	10	20	BDCD	
CN(C)c1ccc(CNC2(C)CCNCC2)cc1	841062965	DXAAURDVIJIHAL-UHFFFAOYSA-N	247.386	1.984	10	20	BDCD	
CNC[C@@H](C)N[C@H](C)c1cc(F)ccc1O	854231701	JYUAWASRADADPQ-RKDXNWHRSA-N	226.295	1.790	10	20	BDCD	
Cc1ccc(CN(C)[C@@H]2CCNC2=O)c(O)c1	876814217	DOJXMDZCHUAEQX-LLVKDONJSA-N	234.299	1.021	10	20	BDCD	
Cc1ccc(CN(C)C[C@@H](C)O)c(O)c1	877320679	QEBVBNOJXLNNDX-SNVBAGLBSA-N	209.289	1.513	10	20	BDCD	
C[C@H](N[C@H](C)CO)c1c(O)cccc1F	886509988	OIOYBVBETSUOGR-SFYZADRCSA-N	213.252	1.563	10	20	BDCD	
O=C(NOC[C@H]1CCOC1)c1cc(O)cs1	788592098	OFOCRZNHQPKFRB-ZETCQYMHSA-N	243.284	1.152	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)[C@H]1CO	299914836	SXRJSZRBOYKINN-GWCFXTLKSA-N	220.316	1.472	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@H]1CC1(F)F	296464516	JPEXPAJOBRROCI-SSDOTTSWSA-N	243.209	1.369	10	20	BDCD	
C[C@@H](NCC(F)(F)CN)c1ccc(F)cc1O	817966683	SYJXODUVVMSLOQ-SSDOTTSWSA-N	248.248	1.776	10	20	BDCD	
C[C@H](NC1CCNCC1)c1ccc(F)cc1O	817934970	DEGQFFIJEMJYHE-VIFPVBQESA-N	238.306	1.934	10	20	BDCD	
NC[C@H]1CC[C@@H](NCc2ccccc2O)C1	724090541	SAZYQIYSHTUEAV-CMPLNLGQSA-N	220.316	1.609	10	20	BDCD	
CN(CCNC(=O)c1cc(O)cs1)C1CC1	731871151	FBWKQGMZNJATDM-UHFFFAOYSA-N	240.328	1.278	10	20	BDCD	
C[C@H]1CC[C@H](CNC(=O)c2cc(O)cs2)O1	839791597	DEHAPOMTVKVZJX-IONNQARKSA-N	241.312	1.751	10	20	BDCD	
O=C(NCc1ccon1)NCc1ccccc1O	747513120	LODMKIQXONGFGL-UHFFFAOYSA-N	247.254	1.380	10	20	BDCD	
CNCCNCc1ccc(N2CCCCC2)cc1	841036741	SXCAEYUFGTWOOI-UHFFFAOYSA-N	247.386	1.986	10	20	BDCD	
Cc1cc(CNCCc2ccc(N)cc2)nn1C	841038180	GVOVVMRJFBNJSF-UHFFFAOYSA-N	244.342	1.643	10	20	BDCD	
Cc1cccc(CN2CCN[C@@H](C)[C@H]2C)c1O	843058277	QSMRZGWLHWAIGT-NWDGAFQWSA-N	234.343	1.883	10	20	BDCD	
C[C@@H](N)[C@@H]1CCCN(Cc2ccccc2O)C1	70171412	GAFVFCMGSBPYQS-VXGBXAGGSA-N	234.343	1.951	10	20	BDCD	
C[C@@H](NC(=O)c1ncnn1C)c1ccccc1O	866161587	QWAMAYXHYJAEIH-MRVPVSSYSA-N	246.270	1.012	10	20	BDCD	
C[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O	768465787	LHKXTFYXLQIWMY-TVQRCGJNSA-N	249.310	1.802	10	20	BDCD	
COc1cc(C)cc(CNC[C@@H](C)OC)c1O	894534103	XTZGICAOUUWSAO-SNVBAGLBSA-N	239.315	1.834	10	20	BDCD	
CCc1cccc(CN[C@@H]2CCN(C)C2)c1O	709435741	NUXFLEKBYQXHJY-CYBMUJFWSA-N	234.343	1.748	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1C[C@@]12CCOC2	764251177	QBEHQKIRUCHMGI-BXUZGUMPSA-N	247.294	1.435	10	20	BDCD	
NC[C@@H](NCc1ccc(N)cc1)C1CCCC1	1356083735	ZJVRIKFKHMUGND-CQSZACIVSA-N	233.359	1.876	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)CC(=O)O)c1	1604821279	VSYWMSFXMHPGDH-MRVPVSSYSA-N	239.271	1.354	10	20	BDCD	
COCCN(C)Cc1cccc(C)c1O	162808642	NYLUMCACNIPGEX-UHFFFAOYSA-N	209.289	1.779	10	20	BDCD	
OC[C@@H](NCc1cccc(Cl)c1O)C1CC1	309528732	CTCSXASJUHAYCC-LLVKDONJSA-N	241.718	1.906	10	20	BDCD	
Cc1cccc(CN2CC[C@H](CC(N)=O)C2)c1O	377852921	VFWZSFRQOOQXJM-LLVKDONJSA-N	248.326	1.398	10	20	BDCD	
CCc1cccc(CNC2([C@H](C)O)CC2)c1O	827585511	KOBHSTOCOLOSOM-JTQLQIEISA-N	235.327	1.958	10	20	BDCD	
C[C@@H]1NCC[C@@H]1C(=O)N(C)Cc1ccccc1O	92954830	GJFCPOIWBQPTAI-JQWIXIFHSA-N	248.326	1.349	10	20	BDCD	
CCOc1ccc(CN[C@H](C)CCN)c(O)c1	841050925	KZJSINUUOMNDLW-SNVBAGLBSA-N	238.331	1.618	10	20	BDCD	
N[C@]12CCC[C@@H]1CN(Cc1ccccc1O)C2	857226542	QUCPGBJOYHLZPH-OCCSQVGLSA-N	232.327	1.705	10	20	BDCD	
COC(=O)CN(C)Cc1c(O)cccc1Cl	768400051	CYDBAVNGBPQKEZ-UHFFFAOYSA-N	243.690	1.650	10	20	BDCD	
Cc1ccc(CN[C@]2(C)CCOC2)c(O)c1	877121185	PXYIFXMJMUZTGI-CYBMUJFWSA-N	221.300	1.969	10	20	BDCD	
C[C@H](CCO)NCCCSc1nccs1	779349066	VKUZZDNQCCDIEN-SECBINFHSA-N	246.401	1.986	10	20	BDCD	
Oc1cc2c(cc1CN1CC=CCC1)[C@@H](O)CO2	778577629	SZGULQGNLDKSOB-ZDUSSCGKSA-N	247.294	1.580	10	20	BDCD	
C[C@@H]1NC(=O)[C@@H](C)N(Cc2ccccc2O)[C@@H]1C	895117721	VQQCMSYZAWLOIH-HBNTYKKESA-N	248.326	1.490	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H]2CCN2C)cc1	712581283	LXICOOFIFSKAMO-AWEZNQCLSA-N	233.359	1.546	10	20	BDCD	
C[C@H]1C[C@@H]1C(=O)NCc1cccc(O)c1O	1349080005	WLWAGZLJOJPOKK-CBAPKCEASA-N	221.256	1.370	10	20	BDCD	
C[C@@H]1C[C@H](CN)CN1C(=O)Cc1ccc(N)cc1	834361295	HLSQBNXQQPUVST-ZYHUDNBSSA-N	247.342	1.007	10	20	BDCD	
Cc1cc(Cl)cc([C@H](C)NCCO)c1O	309115181	LGSHPHFRIOKRFP-QMMMGPOBSA-N	229.707	1.997	10	20	BDCD	
COc1cccc(CNc2ncc(F)cn2)c1O	301756583	DSOFJPAUXXUKGV-UHFFFAOYSA-N	249.245	1.942	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H]2CCCN2)cc1	234265037	GHFAYZIWMKDTNV-ZDUSSCGKSA-N	233.359	1.594	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CCCCO	92172998	PWHDXYOTIDCJRL-UHFFFAOYSA-N	237.299	1.513	10	20	BDCD	
C[C@@H](NCC1CNC1)c1cc(F)ccc1O	817964938	JUOILRQNKSLOLU-MRVPVSSYSA-N	224.279	1.401	10	20	BDCD	
CC1(C)NCC[C@@H]1NCc1cccc(F)c1O	841085448	CPAXBLWNDOXTIG-NSHDSACASA-N	238.306	1.761	10	20	BDCD	
C[C@@H](CC(C)(C)O)NC(=O)c1cc(O)cs1	854762017	SNWPTOBHQSNJTD-ZETCQYMHSA-N	243.328	1.733	10	20	BDCD	
C[C@H](CO)NCc1cc(F)c(N(C)C)cc1F	858106186	GSJMQWDJHQYDDB-MRVPVSSYSA-N	244.285	1.501	10	20	BDCD	
CC[C@@H](O)CCCNC(=O)c1cc(O)cs1	761570758	BDPRNRXLSFPWBV-MRVPVSSYSA-N	243.328	1.735	10	20	BDCD	
CCN(CCCO)Cc1cc(C)ccc1O	769484767	ZDLZIEMZXDWLOG-UHFFFAOYSA-N	223.316	1.905	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)C(F)F	787377521	OOPMLWWGBTUWMP-UHFFFAOYSA-N	242.269	1.942	10	20	BDCD	
CN[C@H](C)CCNCc1ccc2c(c1)CCO2	1325625373	JZNPWNBSMWUIEQ-LLVKDONJSA-N	234.343	1.709	10	20	BDCD	
C[C@@H]1C[C@H]1C(=O)NCCc1ccc(O)c(O)c1	98074509	ZHOFPZGAJRBXRE-PSASIEDQSA-N	235.283	1.413	10	20	BDCD	
COC[C@H]1CC(F)(F)CN1C(=O)CN=[N+]=[N-]	409429485	HNQIKKCPJYMKGS-ZCFIWIBFSA-N	234.206	1.179	10	20	BDCD	
O[C@H]1CC[C@@H](CNCc2ccc3c(c2)CCO3)C1	188849940	TWVHGIWHVVOUHV-OCCSQVGLSA-N	247.338	1.872	10	20	BDCD	
COCCN(C)Cc1cc(F)cc(F)c1O	708401495	UGDCDEMMGAGRAE-UHFFFAOYSA-N	231.242	1.749	10	20	BDCD	
C[C@@H](NC[C@H]1CNCCO1)c1ccccc1O	817984032	VCIKIOFLHGPVRD-GHMZBOCLSA-N	236.315	1.031	10	20	BDCD	
C[C@@]1(CO)CCCN1Cc1ccc(N)cc1	722979158	BSZJXZHKYRYKKK-ZDUSSCGKSA-N	220.316	1.616	10	20	BDCD	
CC(C)CN(CC(=O)O)Cc1ccc(N)cc1	1603804964	ZCHJDIHQHLBJRO-UHFFFAOYSA-N	236.315	1.811	10	20	BDCD	
CN(C)C(=O)NCCCSc1nccs1	114374561	DVFCANZECKQXER-UHFFFAOYSA-N	245.373	1.897	10	20	BDCD	
C[C@H](NCCC(=O)O)c1ccc(N(C)C)cc1	37252414	YTXCEIUYJVLBCZ-JTQLQIEISA-N	236.315	1.878	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](CN)C[C@H]2C)c1	228065290	XTAJWQDQEKRHGU-VXGBXAGGSA-N	234.343	1.870	10	20	BDCD	
COc1ccc(CN[C@@H](C)CCO)cc1C	96811712	JZWQQYLOIBFNIM-NSHDSACASA-N	223.316	1.864	10	20	BDCD	
Cc1ccc(O)c(CN2CCNC(=O)C[C@@H]2C)c1	377888770	LYTNKKBEFQGABI-NSHDSACASA-N	248.326	1.411	10	20	BDCD	
C[C@@H](NC(=O)c1cccc(O)c1O)C(F)(F)F	288757419	ZTTJPGGKCXPSNK-RXMQYKEDSA-N	249.188	1.778	10	20	BDCD	
C[C@H](CF)NC(=O)c1c(F)ccc(O)c1O	295271470	DYVWVANDWJKYFA-RXMQYKEDSA-N	231.198	1.325	10	20	BDCD	
CC[C@H](NC/C=C/CO)c1ccccc1O	717533784	ZNXRWDODVZPDFP-FYJFLYSWSA-N	221.300	1.981	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H](C)CN)c(O)c1	817966296	KXZSUOZHJSOMTJ-NXEZZACHSA-N	208.305	1.698	10	20	BDCD	
COC(=O)CN(C)c1ccc(OC)c(OC)c1	64517333	MJPWDNCJGZXQQX-UHFFFAOYSA-N	239.271	1.313	10	20	BDCD	
CCN(C[C@@H]1CCC(=O)N1)c1ccc(OC)cc1	844303939	HJVYNIOVOJAGGY-NSHDSACASA-N	248.326	1.800	10	20	BDCD	
Cc1cc(O)c(CN[C@H](CO)C2CC2)cc1C	742371116	IBSRCCMLQUUUCU-CYBMUJFWSA-N	235.327	1.870	10	20	BDCD	
CCn1cnnc1NCc1cc(C)ccc1O	922660314	OKMXFCXEQFXGFC-UHFFFAOYSA-N	232.287	1.924	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1C[C@@H](CO)C1	877667112	LQXOQDXTKHKUFR-PHIMTYICSA-N	221.300	1.561	10	20	BDCD	
Cc1ccc(CN2CC[C@](F)(CO)C2)c(O)c1	877503769	AGPQUKPNUAIFTA-CYBMUJFWSA-N	239.290	1.607	10	20	BDCD	
COc1cccc(CNCCC(C)(C)O)c1O	274774092	SVFMQHJOMWWTHF-UHFFFAOYSA-N	239.315	1.651	10	20	BDCD	
COc1cccc(CNC[C@H]2C[C@@H](O)C2)c1O	720893548	NVLJHVVCVVCAMS-JGZJWPJOSA-N	237.299	1.261	10	20	BDCD	
Nc1ccc(CN2CC[C@@]3(CCNC3)C2)cc1	1336287052	WHFJEMSSIGDEKV-CQSZACIVSA-N	231.343	1.454	10	20	BDCD	
COc1cccc(O)c1CN1C[C@H]2CNC[C@@H]2C1	770396042	YEDGDTPMKQPWST-GHMZBOCLSA-N	248.326	1.052	10	20	BDCD	
CC[C@@H](N[C@@H]1CCc2cccc(O)c21)C(=O)O	1603915937	WQFNGKSKCPRUOR-NXEZZACHSA-N	235.283	1.832	10	20	BDCD	
Oc1ccccc1CNC[C@@]1(O)CCSC1	165145008	OGWNJSDIDZPSRQ-LBPRGKRZSA-N	239.340	1.350	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CC1(F)F	295355449	VTCZWDPWJPCASI-QMMMGPOBSA-N	227.210	1.664	10	20	BDCD	
Oc1cccc(Cl)c1CNCC1COC1	527818962	WGTZQGVSRRBZBM-UHFFFAOYSA-N	227.691	1.782	10	20	BDCD	
C[C@@H](N)CC(=O)N[C@H](C)c1ccccc1O	870987716	BBDQFDQURIUISO-RKDXNWHRSA-N	222.288	1.307	10	20	BDCD	
Cc1ccc(CN2CCNC[C@@H]2C)c(O)c1	1579692078	SGISFXYLXUFRRN-NSHDSACASA-N	220.316	1.494	10	20	BDCD	
NC[C@@H]1CCN(Cc2ccccc2O)C1	50245320	KCNDKUWEZBKHIO-JTQLQIEISA-N	206.289	1.173	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@H]2CCOC2)cc1	125155995	FHPYBABUNUFDJW-LBPRGKRZSA-N	248.326	1.405	10	20	BDCD	
N[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1	128318236	IKIACLOQNGNAKQ-SECBINFHSA-N	240.734	1.969	10	20	BDCD	
C[C@@H]1COCCN1C(=O)Cc1ccc(N)cc1	35773347	WWNQTVAXPIVPFP-SNVBAGLBSA-N	234.299	1.059	10	20	BDCD	
COc1cccc(CNCc2cc[nH]n2)c1O	41014160	OGVKDAGKYNJMSX-UHFFFAOYSA-N	233.271	1.414	10	20	BDCD	
CCN(CCO)Cc1cc(OC)ccc1O	132478122	YMHVSTXJPSINHN-UHFFFAOYSA-N	225.288	1.215	10	20	BDCD	
Nc1ccc(CNC[C@H]2CCCO2)cc1	40410242	PUMJDIWEXAGGOM-GFCCVEGCSA-N	206.289	1.537	10	20	BDCD	
Cc1ccc(O)c(CNCc2cocn2)c1	381619758	YEWUWOMADGDSQU-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
OCCN(Cc1ccccc1O)CC(F)F	193020133	BHHKAVBXCKYQQN-UHFFFAOYSA-N	231.242	1.452	10	20	BDCD	
COc1cccc(CN2CCC[C@@H]2CO)c1O	92470964	RWDUPKONCZCITP-LLVKDONJSA-N	237.299	1.358	10	20	BDCD	
O=C1CCN(CNCc2ccccc2O)CC1	275720490	MAUZHZYHKLJANX-UHFFFAOYSA-N	234.299	1.104	10	20	BDCD	
CC(=O)C(=O)COc1cccc([N+](=O)[O-])c1	808012481	LSOUFOXHRQBOMN-UHFFFAOYSA-N	223.184	1.132	10	20	BDCD	
CCc1cccc(CN[C@H](CC)CO)c1O	691474315	MRKVUKCGOSLPHG-GFCCVEGCSA-N	223.316	1.815	10	20	BDCD	
CC(=O)C1=NN(c2ccc(F)cc2C)C(=O)C1	871947690	BMLZHAJOSIERJY-UHFFFAOYSA-N	234.230	1.816	10	20	BDCD	
C[C@@H](NC(=O)[C@@]1(C)CCNC1)c1ccccc1O	870988773	ZDAFYLQGHORIFP-YGRLFVJLSA-N	248.326	1.569	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C(C)(C)O	185846394	RIWLUHJJOISHPE-UHFFFAOYSA-N	223.272	1.122	10	20	BDCD	
O=C(Nc1ccc(F)nc1)c1cccc(O)c1O	187195001	CVUAOMYYBDUJTF-UHFFFAOYSA-N	248.213	1.884	10	20	BDCD	
CCCN1CCN(Cc2ccc(N)cc2)CC1	19726897	IROSHQYEWRDFEW-UHFFFAOYSA-N	233.359	1.796	10	20	BDCD	
C[C@@H](O)CNCc1cc(Cl)ccc1O	35601824	IXRWRDXAAPLSNP-SSDOTTSWSA-N	215.680	1.516	10	20	BDCD	
CN1CCN(Cc2ccccc2O)C(C)(C)C1	271474367	ZRYLXUJUUDSTJZ-UHFFFAOYSA-N	234.343	1.918	10	20	BDCD	
C[C@@H](C(=O)O)N(C)Cc1cc(Cl)ccc1O	83406651	BWPCQJHBWTYUQV-ZETCQYMHSA-N	243.690	1.951	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cc(F)ccc1O	83355200	ZNWUWPMQVKAEPN-SSDOTTSWSA-N	227.235	1.182	10	20	BDCD	
NC(=O)CC1(CNCc2ccccc2O)CC1	817411509	SPXIYXUSKMESFB-UHFFFAOYSA-N	234.299	1.137	10	20	BDCD	
CCc1cccc(CN2CC[C@@H](O)[C@H]2C)c1O	848914792	NTTZAMQHDWULBQ-ZWNOBZJWSA-N	235.327	1.910	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@H]1CCNC1	841044222	BOAOGUSNEMZZIO-VIFPVBQESA-N	226.707	1.497	10	20	BDCD	
CN[C@@H]1CCN(Cc2cccc(F)c2O)C1	843044768	IMSPVWDWYOWXCH-SNVBAGLBSA-N	224.279	1.325	10	20	BDCD	
CCN(C)CCNCc1cc(C)ccc1O	70955713	JJCKLZFLBJLUPT-UHFFFAOYSA-N	222.332	1.742	10	20	BDCD	
C[C@@H]1NCC[C@@H]1C(=O)N[C@H](C)c1ccccc1O	870988335	MTASIQKVRWDBFL-UMNHJUIQSA-N	248.326	1.567	10	20	BDCD	
CC(C)NC(=O)CN[C@H]1CCc2cccc(O)c21	295877321	HKERMEBCLLAXRG-NSHDSACASA-N	248.326	1.494	10	20	BDCD	
C[C@@H](NCc1nc(O)n[nH]1)c1ccccc1O	392394385	NTBVPKOEIDRFMX-SSDOTTSWSA-N	234.259	1.067	10	20	BDCD	
CCc1cccc(CN2CCN(C)CC2)c1O	692107084	BWRNHDBQHOLVSF-UHFFFAOYSA-N	234.343	1.702	10	20	BDCD	
O=C(O)c1cnc(NCc2ccccc2O)cn1	1602534119	YLYALBIRWVNSAA-UHFFFAOYSA-N	245.238	1.493	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)C[C@@H](C)N1C	141909518	JBUKOHRSIQKNEB-TXEJJXNPSA-N	234.343	1.917	10	20	BDCD	
CC[C@@H]1CC[C@@H](C(=O)NCc2ccccc2O)O1	268268067	SCKRTXXBQFWARL-YPMHNXCESA-N	249.310	1.966	10	20	BDCD	
Cc1cc(O)c([C@@H]2NC(=O)CN2C)cc1C	266219197	PTSQVLNQVROBPO-GFCCVEGCSA-N	220.272	1.069	10	20	BDCD	
C[C@@H]1CCNC[C@H]1NCCc1ccc(N)cc1	817957613	NGHUBLSRBYLLIF-BXUZGUMPSA-N	233.359	1.399	10	20	BDCD	
C[C@H](N)C[C@H](C)NCc1cc(F)ccc1O	843127423	DGHDTVQYNBBWRQ-IUCAKERBSA-N	226.295	1.747	10	20	BDCD	
COc1ccc(O)c(CN[C@]2(C)CCOC2)c1	164777430	NPFLHJUTEDWAKO-CYBMUJFWSA-N	237.299	1.669	10	20	BDCD	
CC[C@@H](NCc1c(C)cccc1O)C(=O)NC	877575673	BALJAZZENQENEN-LLVKDONJSA-N	236.315	1.315	10	20	BDCD	
C[C@@H](NC(=O)C[C@H]1CCCN1)c1ccccc1O	870988072	FWQVTYRFTXPGIY-GHMZBOCLSA-N	248.326	1.712	10	20	BDCD	
COc1cccc(CNCc2c[nH]cn2)c1O	88750883	DSUVBHWCKYQJRO-UHFFFAOYSA-N	233.271	1.414	10	20	BDCD	
Nc1ccc(CN[C@H]2CCCNC2)cc1	1246170993	PLHGRBNVWXYNKG-LBPRGKRZSA-N	205.305	1.110	10	20	BDCD	
Oc1c(Cl)cccc1CNC1CNC1	1574440242	SFPZMSQZRLBQGZ-UHFFFAOYSA-N	212.680	1.107	10	20	BDCD	
C[C@@H](NC[C@H]1CCCNC1=O)c1ccccc1O	838916111	DVFBHNBAXFUJPT-GHMZBOCLSA-N	248.326	1.569	10	20	BDCD	
CN(Cc1cc(F)ccc1O)CC(C)(C)CN	220325361	UURGEKIFXNXOQN-UHFFFAOYSA-N	240.322	1.948	10	20	BDCD	
C[C@H](O)CNCc1ccc(N2CCCC2)cc1	37257704	RESAEJOONNSFPW-LBPRGKRZSA-N	234.343	1.757	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@@H]2C(=O)O)c1	86726636	IVJHIRJHUIYJPR-LLVKDONJSA-N	235.283	1.750	10	20	BDCD	
COc1ccc(O)c(CNCC(C)(C)O)c1	83461051	CUDPIEKCRMJIAW-UHFFFAOYSA-N	225.288	1.261	10	20	BDCD	
C[C@@H](O)CN[C@@H]1CCc2cccc(O)c21	295809563	CRYGRDVUZQCENP-PSASIEDQSA-N	207.273	1.350	10	20	BDCD	
CN(C)c1ccc(CNCCC(=O)O)cc1F	818390675	FKFMEMXCZNOQKK-UHFFFAOYSA-N	240.278	1.456	10	20	BDCD	
Cc1cc(CN(C)CC(=O)O)ccc1N(C)C	846262947	OOXHTKBLKBALIC-UHFFFAOYSA-N	236.315	1.577	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C[C@@H](C)N)c1	843128158	IIJBBYWEMVXPEG-MNOVXSKESA-N	222.332	1.916	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CCN(C)C(=O)C2)c1	844732487	XXOVOXVKWIOGIF-UHFFFAOYSA-N	248.326	1.283	10	20	BDCD	
C[C@@H](O)CN(C)Cc1cc(F)cc(F)c1O	894450279	HELPOFBMFRLNBW-SSDOTTSWSA-N	231.242	1.483	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C[C@@H](O)C1CC1	785700063	VFVJSTAZIHGODJ-OAHLLOKOSA-N	248.370	1.955	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1C[C@@H](O)[C@H](C)C1	897680117	PIGUGQQMCIHYCD-IUODEOHRSA-N	248.370	1.874	10	20	BDCD	
CC(C)N1CC[C@@H](NCc2ccc(N)cc2)C1=O	1337837453	BJNMPWWNQQUYDJ-CYBMUJFWSA-N	247.342	1.368	10	20	BDCD	
Cc1nn(C)c(C)c1CNCc1ccc(N)cc1	1356083487	PIZOOTFAJXFZHK-UHFFFAOYSA-N	244.342	1.909	10	20	BDCD	
CCN(CCC(=O)O)Cc1ccc(N)cc1	1596314686	BMYOFHYFDJYHGY-UHFFFAOYSA-N	222.288	1.565	10	20	BDCD	
C[C@@H](N[C@@H]1CCOC1=O)c1ccccc1O	19876314	UVVJSESFQIDRSH-PSASIEDQSA-N	221.256	1.358	10	20	BDCD	
CN(C)C(=O)NCc1ccc2c(c1)CCCN2C	169808714	VUKONBORBIYGFR-UHFFFAOYSA-N	247.342	1.840	10	20	BDCD	
CCc1cccc(CN[C@H]2C[C@H](CO)C2)c1O	897355430	QYMFAYSGRGDHBL-MJHDQNEOSA-N	235.327	1.815	10	20	BDCD	
Cc1cc(NC(=O)Cc2ccc(N)cc2)n(C)n1	22172556	DDWQDQPQTKBRQS-UHFFFAOYSA-N	244.298	1.492	10	20	BDCD	
CC(=O)CN(C)c1ccc2c(c1)OCO2	220218123	WNWYMSJDAOMUCV-UHFFFAOYSA-N	207.229	1.441	10	20	BDCD	
Cc1[nH]ncc1C(=O)N(C)Cc1ccccc1O	80043970	RIPRLIBLJDIFBC-UHFFFAOYSA-N	245.282	1.696	10	20	BDCD	
CN(C)C[C@@H]1CCN(Cc2ccccc2O)C1	179574646	RCKDLEDGWWOTDM-LBPRGKRZSA-N	234.343	1.776	10	20	BDCD	
C[C@H](N[C@H]1C[C@@H](O)C1)c1ccc(F)cc1O	296109882	ZLLODQRRYLWLAD-UJNFCWOMSA-N	225.263	1.705	10	20	BDCD	
Oc1cc2c(cc1CN1CCO[C@H]3C[C@@H]31)OCO2	368313091	SOVQWRZILGRGEJ-ONGXEEELSA-N	249.266	1.094	10	20	BDCD	
CC(=O)C(=O)Cn1nc(Cl)c2ccccc21	808032219	TZPAVGNFOUMCLE-UHFFFAOYSA-N	236.658	1.848	10	20	BDCD	
CCOC(=O)[C@@H](C)OC(=O)c1cc(O)cs1	732353303	FJDSVJNYKGLMFH-ZCFIWIBFSA-N	244.268	1.562	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC[C@@H](N)C1	843045533	UQGAISSCKZLGHR-CYBMUJFWSA-N	233.359	1.594	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@@H](O)C2CC2)cc1	854270006	CFGUSPIAJQVUEG-ZDUSSCGKSA-N	248.326	1.140	10	20	BDCD	
Cc1cc(CN2CCC[C@@H](N)C2)ccc1N(C)C	923282875	UYDKTIVCDBGCKN-CQSZACIVSA-N	247.386	1.984	10	20	BDCD	
COC[C@](C)(CO)NCc1ccc(C)cc1O	877155637	ISKOJCZVJHBOAE-ZDUSSCGKSA-N	239.315	1.188	10	20	BDCD	
CN(C(=O)[C@@H]1NCCC1(C)C)c1ccc(N)cc1	877074290	FPLVYLHXGOKNNN-LBPRGKRZSA-N	247.342	1.620	10	20	BDCD	
COc1ccc(CNC(=O)C2CCC2)c(O)c1	794370566	PPDMCOIJMJFXPX-UHFFFAOYSA-N	235.283	1.817	10	20	BDCD	
CCN(CCOCCO)Cc1ccc(N)cc1	40229092	VZYFNHDWWVOAJP-UHFFFAOYSA-N	238.331	1.100	10	20	BDCD	
C[C@H]1COC[C@H]1NCc1ccccc1O	688046039	GWKYORWWPOBGNY-GXSJLCMTSA-N	207.273	1.517	10	20	BDCD	
NCc1ccc(N2CCC(N)CC2)cc1	521401125	YGKQBZOWQVKIOG-UHFFFAOYSA-N	205.305	1.073	10	20	BDCD	
C[C@H](CN)NCc1ccc2c(c1)CCCO2	162066990	HAMOAQSPXPDZFK-SNVBAGLBSA-N	220.316	1.448	10	20	BDCD	
COc1ccc(CNCC[S@@](C)=O)cc1C	124198624	VYGVACHEHFUIOT-INIZCTEOSA-N	241.356	1.472	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCCNC1	37823731	FGTZOGJZUUJLHT-LLVKDONJSA-N	248.326	1.350	10	20	BDCD	
O=C(NCc1ccccc1O)C1CC=CC1	77613749	AVDKKBFEKVFSMR-UHFFFAOYSA-N	217.268	1.975	10	20	BDCD	
COc1cccc(CN2CCOC[C@H]2C)c1O	132173858	ZGESUGDWMWFXLE-SNVBAGLBSA-N	237.299	1.622	10	20	BDCD	
COC[C@@H]1CCN(Cc2ccccc2O)C1	132743478	AKCDPQCDSSTUHE-LLVKDONJSA-N	221.300	1.861	10	20	BDCD	
CN(Cc1nnc[nH]1)Cc1ccccc1O	179577424	VKGMHBFUDJPLFZ-UHFFFAOYSA-N	218.260	1.142	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1CCC(=O)O1	821390903	FRVUHOANXWLDGQ-LLVKDONJSA-N	235.283	1.530	10	20	BDCD	
CCC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1	832283914	CZWISKCQRGXHEJ-GFCCVEGCSA-N	235.331	1.279	10	20	BDCD	
CCN(CCOC)C(=O)c1cc(O)cs1	732269278	RUOPTJMARPGJOH-UHFFFAOYSA-N	229.301	1.562	10	20	BDCD	
CO[C@@H](C)C(=O)NCc1cc(Cl)ccc1O	846471850	BRFRLWUTOXPHIC-ZETCQYMHSA-N	243.690	1.697	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCC(=O)C1	843820013	INWSGDNRHUKFHR-JTQLQIEISA-N	247.294	1.720	10	20	BDCD	
CCN[C@H](C)C(=O)N(C)c1ccc(N)cc1	877074399	IYDXBCZDQNFIJG-SECBINFHSA-N	221.304	1.230	10	20	BDCD	
Cc1cccc(O)c1CNCc1cn(C)cn1	898043162	GRUHJJWEQOFILF-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
COc1cccc(CNC[C@H](C)CCO)c1O	97435949	ZZJPCKYWHGOAKS-SNVBAGLBSA-N	239.315	1.509	10	20	BDCD	
C[C@@H]1COC[C@@H]1NC(=O)NCc1ccc(N)cc1	1336978830	VXSUZKAQTHRSOB-SKDRFNHKSA-N	249.314	1.103	10	20	BDCD	
CN1CCC[C@H](N(C)Cc2ccccc2O)C1=O	778949492	JEKHFSJBIOWKSU-LBPRGKRZSA-N	248.326	1.445	10	20	BDCD	
CNC[C@@H](C)CNCc1cc(F)cc(F)c1O	1578627610	RWSJNMOIQXTMPS-MRVPVSSYSA-N	244.285	1.616	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1ccncc1	159034403	QUSHHISZZMXKSW-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(F)c2O)CCN1	309828577	XWPSNDGTKIIDCI-SECBINFHSA-N	224.279	1.325	10	20	BDCD	
C[C@@]1(CNC(=O)Cc2ccc(N)cc2)CCOC1	397178043	HLYLKCQDMRQSLG-AWEZNQCLSA-N	248.326	1.354	10	20	BDCD	
Cc1ccc(O)c(CNCc2cn(C)cn2)c1	858239570	PREQEAQSSQGJDK-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
COC(=O)CCCN(C)c1ccc(N)cc1	37286870	RELJOMLXUXXFKG-UHFFFAOYSA-N	222.288	1.658	10	20	BDCD	
CCOc1cccc(CN(C)C[C@@H](C)O)c1O	130717896	VLALTXAQQJZBGT-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
COC1(C)CN(Cc2cccc(C)c2O)C1	839101535	MWFXLKAZPLDLNU-UHFFFAOYSA-N	221.300	1.921	10	20	BDCD	
CCOc1ccc(CNCCCNC)c(O)c1	841041977	KQVINYJHPXHGHW-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
CCOc1cccc(CN[C@H](C)CCN)c1O	841052458	XUUQNTCCJHLWJC-SNVBAGLBSA-N	238.331	1.618	10	20	BDCD	
C[C@H](CCNC(=O)Cc1ccc(N)cc1)N(C)C	697921091	TUFNPGDXMCDHJK-LLVKDONJSA-N	249.358	1.268	10	20	BDCD	
CC1(NCc2cc(Cl)ccc2O)COC1	877691245	LUHVAVUMGLRMJC-UHFFFAOYSA-N	227.691	1.924	10	20	BDCD	
CC(C)CCN1CCN(CCN=[N+]=[N-])CC1	409432233	UZZMZLXHBXFJTI-UHFFFAOYSA-N	225.340	1.960	10	20	BDCD	
OCCOCCNCc1cccc(Cl)c1O	162824253	XYRJPYVQEGJRCO-UHFFFAOYSA-N	245.706	1.144	10	20	BDCD	
O=C(O)[C@H](NCc1cccc(F)c1O)C1CC1	1608550631	WWBKOXGPMHLODW-SNVBAGLBSA-N	239.246	1.484	10	20	BDCD	
Cc1cc(O)c(CNCCC(=O)O)cc1Cl	1605216639	JDUKAQVIZACVIM-UHFFFAOYSA-N	243.690	1.918	10	20	BDCD	
Oc1ccc(F)cc1CNCCn1ccnc1	226582680	CUHPVAJYWUBTIC-UHFFFAOYSA-N	235.262	1.518	10	20	BDCD	
CC(=O)OCCSc1nccs1	916759365	KVDCIHZCZYUBBF-UHFFFAOYSA-N	203.288	1.798	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](CO)C1)c1ccccc1O	927151665	YMLXWCVQSWSBQC-GMTAPVOTSA-N	221.300	1.814	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCCN(C)C)c1	35628437	WDDLFKIAWSNAIV-LLVKDONJSA-N	222.332	1.913	10	20	BDCD	
Cc1cccc(CN2CC[C@@](C)(O)C2)c1O	180633995	CTPMXOPPLXSWTN-CYBMUJFWSA-N	221.300	1.657	10	20	BDCD	
C[C@H](CCO)N[C@H](C)c1ccccc1O	132433380	HATLBZPDAXAMOR-NXEZZACHSA-N	209.289	1.814	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@](C)(CN)C2)cc1	386458309	SGDRVJALXNOZON-OAHLLOKOSA-N	247.386	1.923	10	20	BDCD	
C[C@@H](NCC[S@](C)=O)c1ccccc1O	163980436	JBMCWKXQRIBUDW-RFAUZJTJSA-N	227.329	1.421	10	20	BDCD	
C[C@H](NC[C@H](C)CN)c1ccc(F)cc1O	817962950	PSQFSFXASMLSHY-BDAKNGLRSA-N	226.295	1.777	10	20	BDCD	
C[C@@H](NC[C@H]1CCCN1)c1cc(F)ccc1O	817951621	HOSVXMSNMAKAKG-MWLCHTKSSA-N	238.306	1.934	10	20	BDCD	
O=C(NCCc1ccccn1)c1cc(O)cs1	731865849	UDPZHNHRAZJSPX-UHFFFAOYSA-N	248.307	1.821	10	20	BDCD	
CC(C)N(C)C(=O)/C=C\c1ccc(O)c(O)c1	588405403	MZFMZIDCNJROLO-ALCCZGGFSA-N	235.283	1.978	10	20	BDCD	
O=C(O)C1(NCc2cc(F)cc(F)c2O)CC1	903989179	SPZAQBQZAIREHD-UHFFFAOYSA-N	243.209	1.377	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(F)c2O)CC[C@H]1N	843051421	HFVBPQZNKFFJFL-BXKDBHETSA-N	238.306	1.700	10	20	BDCD	
CN1CC(=O)N[C@@H]1c1cc(Cl)ccc1O	917500605	VLZWFPDKKXCSTQ-JTQLQIEISA-N	226.663	1.106	10	20	BDCD	
CCNC(=O)CN(C)Cc1c(C)cccc1O	876621806	IZFLCFAEHONIPW-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H]1C[C@H](O)C1	877811627	RGKFRYFPBHAAOK-NNUKFRKNSA-N	248.370	1.922	10	20	BDCD	
CCOCCNCc1ccc(C)cc1O	877145402	GZXXTTBMZURTLU-UHFFFAOYSA-N	209.289	1.827	10	20	BDCD	
Oc1cc2c(cc1CNC/C=C/Cl)OCO2	898436960	XFJSEQWRPYJBHL-OWOJBTEDSA-N	241.674	1.963	10	20	BDCD	
O[C@H]1CC[C@H](CNCc2ccc3c(c2)CCO3)C1	188849957	TWVHGIWHVVOUHV-JSGCOSHPSA-N	247.338	1.872	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccc(Cl)nc2)C1	409422855	JJNYPGVOIGWQBI-UHFFFAOYSA-N	237.650	1.870	10	20	BDCD	
CCc1cccc(CNCC2(CO)CC2)c1O	709430413	BGNIFSWLGWSDDO-UHFFFAOYSA-N	235.327	1.817	10	20	BDCD	
CC(C)[C@@H](CO)CNCc1ccc2c(c1)CCO2	259007383	OHSALQUDCMTRSX-CQSZACIVSA-N	249.354	1.976	10	20	BDCD	
COC(=O)CC(C)(C)NCc1ccccc1O	237133385	NHKCNZHZPYLQAE-UHFFFAOYSA-N	237.299	1.824	10	20	BDCD	
CCOCC(=O)N(C)Cc1ccccc1O	70266040	FKGBWNKILLHWSL-UHFFFAOYSA-N	223.272	1.387	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](CN)C2)c1	70955787	JSGGXZZHSJSTBG-NSHDSACASA-N	220.316	1.481	10	20	BDCD	
C[C@@H]1C[C@@H](CN)CN1Cc1cc(F)ccc1O	220338095	XHYBWYSVKBHVCD-ZJUUUORDSA-N	238.306	1.700	10	20	BDCD	
Oc1ccccc1CN1CC([C@@H]2CCOC2)C1	368443625	UWLFLPNGCKLHQO-GFCCVEGCSA-N	233.311	1.861	10	20	BDCD	
CN(C)c1ccc([C@@H](N)CNC(=O)C2CC2)cc1	832286137	WPKWOFLQFMSWPN-ZDUSSCGKSA-N	247.342	1.279	10	20	BDCD	
N[C@@H]1CCC[C@H](NCc2cc(F)ccc2O)C1	841058199	QKQSOEKQXVBMKY-NEPJUHHUSA-N	238.306	1.891	10	20	BDCD	
Cc1ccc(CNCCc2cnccn2)c(O)c1	877131950	PMGZWQPZEIQLTN-UHFFFAOYSA-N	243.310	1.823	10	20	BDCD	
C[C@H](N)[C@@H](C)C(=O)N(C)c1ccc(N)cc1	877077531	LYEBGIHDDOVAMO-BDAKNGLRSA-N	221.304	1.215	10	20	BDCD	
CCCN[C@@H](C)C(=O)N(C)c1ccc(N)cc1	877077791	USFPRZXMRQFWMK-JTQLQIEISA-N	235.331	1.620	10	20	BDCD	
CN(C(=O)[C@H]1CCCNCC1)c1ccc(N)cc1	877075855	JZVDBTOHTLPNMQ-NSHDSACASA-N	247.342	1.621	10	20	BDCD	
CCc1cccc(CN2C[C@@H](C)[C@@H](O)C2)c1O	897680530	SGAMOMRIGLTCBV-MFKMUULPSA-N	235.327	1.767	10	20	BDCD	
COc1ccc(CNC(=O)c2cn[nH]c2)c(O)c1	794384292	YSXKOMAAGIHRMB-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
CN(CC(=O)O)Cc1cc(F)cc(F)c1O	708075209	KFWYVINJTPPFHC-UHFFFAOYSA-N	231.198	1.187	10	20	BDCD	
C[C@@H]1OCC[C@H]1C(=O)NCc1ccccc1O	163138550	ZHECCSVZLJFIQE-GXSJLCMTSA-N	235.283	1.433	10	20	BDCD	
C[C@H]1C[C@H](NC(=O)c2cccc(O)c2O)CO1	401487456	XZWHEORVCJOKKG-YUMQZZPRSA-N	237.255	1.005	10	20	BDCD	
C[C@@H](N)CN(C)Cc1cc(Cl)ccc1O	379793507	JUOFWLXZINKTNQ-MRVPVSSYSA-N	228.723	1.825	10	20	BDCD	
C[C@H](O)C[C@@H](C)NCc1ccc2c(c1)CCO2	228074539	OSKJWSZOUHNROG-MNOVXSKESA-N	235.327	1.871	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CCOC2)c1	87416133	FVRYQPUOCPWYCW-SNVBAGLBSA-N	223.272	1.279	10	20	BDCD	
CO[C@H]1CN(Cc2ccccc2O)C[C@H]1OC	234883892	UECJBNHHLOIQLA-BETUJISGSA-N	237.299	1.238	10	20	BDCD	
CCCn1c(C)nnc1SCC(=O)C(C)=O	808029072	POZOFDPUTOITFE-UHFFFAOYSA-N	241.316	1.247	10	20	BDCD	
CNCCCN[C@H](C)c1ccc(F)cc1O	817941354	UABWZIBTKAQUIS-SECBINFHSA-N	226.295	1.791	10	20	BDCD	
O=C(CCO)NCc1ccc(N2CC=CC2)cc1	902873775	QXEUBBNINVYXOS-UHFFFAOYSA-N	246.310	1.061	10	20	BDCD	
CCCC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1	832286101	WDLJSLLOJJQORV-CYBMUJFWSA-N	249.358	1.669	10	20	BDCD	
CC1(C)C[C@@H]1NC(=O)c1cc(O)cs1	839815142	YNPICWVSIBVZAG-QMMMGPOBSA-N	211.286	1.982	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C2(CO)CC2)c1O	696064440	VUEOKZWBDXQVIM-NSHDSACASA-N	235.327	1.951	10	20	BDCD	
Nc1ccc(OCc2cn(C3COC3)nn2)cc1	1329315065	CYLMFPCPUQHYJO-UHFFFAOYSA-N	246.270	1.011	10	20	BDCD	
CO[C@@H](C)C(=O)N(C)Cc1ccccc1O	79621566	VDNUIRDSXQQNII-VIFPVBQESA-N	223.272	1.386	10	20	BDCD	
CCOc1cccc(CNCCF)c1O	280677001	MSVSAEIVFHMSBP-UHFFFAOYSA-N	213.252	1.850	10	20	BDCD	
Cc1ccc(CN(C)CC(=O)O)c(O)c1	1600409694	LCWYFLAVMAFABB-UHFFFAOYSA-N	209.245	1.217	10	20	BDCD	
Nc1ccc(NC(=O)COCC2CC2)cc1	19870522	HPZVZWDREMEZNY-UHFFFAOYSA-N	220.272	1.634	10	20	BDCD	
CC(C)[C@H](CCO)NCc1ccccc1O	164859817	WXQBMMVYGOVYEV-LBPRGKRZSA-N	223.316	1.889	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCc2nncn2C)c1	38007767	NYOSPHVHQNXIFO-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
COCCCNCc1cccc(C)c1O	83345876	IZXWPZTXEWQNOA-UHFFFAOYSA-N	209.289	1.827	10	20	BDCD	
C[C@@H](NC(=O)C1=CCOCC1)c1ccccc1O	827941146	NYFBQIIUBXQSAM-SNVBAGLBSA-N	247.294	1.916	10	20	BDCD	
O=C(NOC1CCC1)c1c(F)ccc(O)c1O	832331996	CZALSHDLUVWFMI-UHFFFAOYSA-N	241.218	1.451	10	20	BDCD	
CCCNCCNCc1cccc(OC)c1O	841046612	JIPHYEAEAJZYNN-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
C[C@H](CN)NCc1cc(Cl)ccc1O	841060357	WTJNFGVKZUVOLQ-SSDOTTSWSA-N	214.696	1.482	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H]2[C@@H](CO)[C@@H]2C1	877545081	GDLOQIRYVKWHOB-ITGUQSILSA-N	233.311	1.371	10	20	BDCD	
CC[C@@]1(O)CCN(Cc2cc(F)ccc2O)C1	779217792	BPIQVUNCEZLQAY-CYBMUJFWSA-N	239.290	1.878	10	20	BDCD	
CCOC(=O)c1cnc(SC[C@H](C)O)s1	882738442	VEONQQOFQSQPGG-LURJTMIESA-N	247.341	1.793	10	20	BDCD	
C[C@@H](NC(=O)CC1(N)CCC1)c1ccccc1O	870988071	FWIBGOJIGZHDFC-SNVBAGLBSA-N	248.326	1.841	10	20	BDCD	
COC[C@@H](C)NCc1cc(F)ccc1O	83347411	NITISNNUIRCJJV-MRVPVSSYSA-N	213.252	1.656	10	20	BDCD	
CN(Cc1cn[nH]c1)Cc1ccccc1O	768872895	LLBKTPOSDJYQJM-UHFFFAOYSA-N	217.272	1.747	10	20	BDCD	
Nc1ccc(NC(=O)NN2CCCCC2)cc1	148168381	PXZUBUAKWLPWCU-UHFFFAOYSA-N	234.303	1.791	10	20	BDCD	
NC(=O)CN(Cc1ccccc1O)C1CCCC1	109797460	RGCKAQKDIIHDEY-UHFFFAOYSA-N	248.326	1.622	10	20	BDCD	
COc1cccc(CN(CCO)C2CC2)c1O	271083880	SKCDWZSZYHDQCH-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
COCC(C)(C)CNC(=O)c1cc(O)cs1	832761816	QVFFHCKEDOQIRT-UHFFFAOYSA-N	243.328	1.856	10	20	BDCD	
CNC[C@H](C)NCc1cccc(F)c1O	853248812	KJLGMMHKAVTBTG-QMMMGPOBSA-N	212.268	1.229	10	20	BDCD	
COc1cccc(CN(C)Cc2cn[nH]c2)c1O	769425002	NIQQKBUYSCRZPE-UHFFFAOYSA-N	247.298	1.756	10	20	BDCD	
Cc1ccc(CNCCC[S@](C)=O)c(O)c1	877051945	ONETXCLNDLPDIQ-INIZCTEOSA-N	241.356	1.559	10	20	BDCD	
Cc1cccc(O)c1CNCCN1CCCC1	877142040	IIXZLCYZFVHCPA-UHFFFAOYSA-N	234.343	1.886	10	20	BDCD	
CCn1ncnc1CNCc1ccc(C)cc1O	877491500	KOLMRPHQBQMZLF-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
COc1ccc(N(CC(=O)O)CC2CC2)cc1	873644380	WYCHNXVMWCYBFA-UHFFFAOYSA-N	235.283	1.996	10	20	BDCD	
COC1CN(Cc2ccc(C)cc2O)C1	877580709	XJBKPRQALWKQAH-UHFFFAOYSA-N	207.273	1.531	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1=CCOCC1	793690917	YHWZIBALVDGJEY-UHFFFAOYSA-N	249.266	1.061	10	20	BDCD	
CCN(C)CCNCc1cccc(OC)c1O	54109900	LUTYLGZTIPELIF-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
C[C@H]1C[C@H](NCc2ccccc2O)CCN1C	90721239	ULPUYZMYDUJNPC-WCQYABFASA-N	234.343	1.965	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccsc2)C1	409422165	BOPCJFOUOXZRLO-UHFFFAOYSA-N	208.246	1.883	10	20	BDCD	
CN(Cc1ccc(N)cc1)[C@H]1CCNC1	1334774752	MUQXGLQOBLMUCK-LBPRGKRZSA-N	205.305	1.063	10	20	BDCD	
Cc1nc(C(C)(C)NCc2ccc(N)cc2)no1	1345160183	SVDXKLSMCKFMQO-UHFFFAOYSA-N	246.314	1.985	10	20	BDCD	
CC[C@]1(C(=O)NCc2ccccc2O)CCCN1	228420588	LKUIGXQAPNQIRL-CQSZACIVSA-N	248.326	1.541	10	20	BDCD	
O[C@@H](CNCc1ccc2c(c1)CCO2)C1CCC1	316036701	VNRHHQIXGBYINZ-AWEZNQCLSA-N	247.338	1.872	10	20	BDCD	
CC[C@@H](OC)C(=O)N(C)c1ccc(N)cc1	877078030	ABZJFVPGCVTIGU-LLVKDONJSA-N	222.288	1.657	10	20	BDCD	
Oc1ccc(F)cc1CN1CC[C@@H](O)C1	179912612	XZLVKRIVURVDPU-SNVBAGLBSA-N	211.236	1.098	10	20	BDCD	
CC[C@@H](CO)N[C@H](C)c1ccc(F)cc1O	62745358	MEXJYXHXBGGISL-SCZZXKLOSA-N	227.279	1.953	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)N	37807403	SKTUTFUYNOTGAT-NSHDSACASA-N	249.358	1.448	10	20	BDCD	
C[C@H]1CN(c2ccc(N)cc2)CC[C@@H]1O	126768281	VLDZSYJUOOYEJH-CABZTGNLSA-N	206.289	1.476	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@H]1CCOC1)CC2	381496012	BFMOYAIFBIECIT-WDEREUQCSA-N	219.284	1.758	10	20	BDCD	
COc1ccc(O)c(CN2CCOC[C@@H]2C)c1	132172271	AOZFFBLRWHGKAX-JTQLQIEISA-N	237.299	1.622	10	20	BDCD	
CCOc1ccc(N(C)CCn2cncn2)cc1	739926641	IZQRUKLHAAYWIO-UHFFFAOYSA-N	246.314	1.813	10	20	BDCD	
Cc1cccc(O)c1CN(C)[C@@H]1CCNC1=O	876816399	YIDGTCXQEBCHJU-LLVKDONJSA-N	234.299	1.021	10	20	BDCD	
COc1cccc(O)c1CN(C)C1CC(O)C1	761223228	NPGFESQJKIMPAD-UHFFFAOYSA-N	237.299	1.356	10	20	BDCD	
Cc1cccc(O)c1CN(C)CC[C@H](C)O	876745424	HJSJSPZZEVFYLF-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
CC[C@@H]1C(=O)NCCCN1Cc1ccccc1O	898541693	NZXQXZPQOWFOLK-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
Cc1cc[nH]c1C(=O)NCc1ccccc1O	797943552	SPDYYVSORIXDAV-UHFFFAOYSA-N	230.267	1.959	10	20	BDCD	
COc1cc(C)cc(CN2CCO[C@@H]3C[C@H]32)c1O	793614919	NAJWOIVMXYCELH-VXGBXAGGSA-N	249.310	1.682	10	20	BDCD	
Nc1ccc(CNCC2(C(=O)O)CC2)cc1	1601216310	VGMPJYQEDJRQCW-UHFFFAOYSA-N	220.272	1.223	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCCC(=O)O	1594311530	KTIQPKAUDIIFBQ-UHFFFAOYSA-N	236.315	1.625	10	20	BDCD	
Nc1ccc(CCNC(=O)N2CC=CCC2)cc1	841956400	AMONCJZUNAGJFJ-UHFFFAOYSA-N	245.326	1.783	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H](O)C(F)(F)F	876966825	WSCGARXBHRNGCP-JTQLQIEISA-N	249.232	1.713	10	20	BDCD	
CNC(=O)[C@H](C)N[C@@H](C)c1ccc(F)cc1O	62748172	FKZFUTRGCJQRDI-YUMQZZPRSA-N	240.278	1.316	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H]1N	300334492	ZDRICQJKBPTZCJ-LDYMZIIASA-N	224.279	1.310	10	20	BDCD	
COc1cccc(CNCC(F)(F)CO)c1O	183869415	XXIYQKOGQPCLSW-UHFFFAOYSA-N	247.241	1.118	10	20	BDCD	
C[C@H](CCO)N[C@@H]1CCc2cccc(O)c21	297575985	GVUVOWXNRPCUOL-MWLCHTKSSA-N	221.300	1.740	10	20	BDCD	
CCOCCNCc1cccc(C)c1O	163728485	SQTNOASMQJRJCA-UHFFFAOYSA-N	209.289	1.827	10	20	BDCD	
Cc1cc(CN2C[C@H](N)C[C@H]2C)ccc1N(C)C	923412918	KYJIUBWCPIEFQH-TZMCWYRMSA-N	247.386	1.983	10	20	BDCD	
CCN1CC(=O)N[C@H]1c1ccc(N(C)C)cc1C	840819016	TWRMUERNPUWJCV-CQSZACIVSA-N	247.342	1.511	10	20	BDCD	
COC[C@H](O)CN[C@@H](C)c1c(O)cccc1F	886607305	OZQMYZNOVADCFP-DTWKUNHWSA-N	243.278	1.189	10	20	BDCD	
Nc1ccc(CNC(=O)NC2CCOCC2)cc1	1336762876	LOOQDLMQVPVMPI-UHFFFAOYSA-N	249.314	1.247	10	20	BDCD	
CC[C@H](Sc1nccs1)C(N)=O	61680123	RICVZKVBGVEZAS-YFKPBYRVSA-N	202.304	1.499	10	20	BDCD	
Nc1ccoc1C(=O)NCc1c(O)cccc1O	1580464152	MIWVKPBLZRICRC-UHFFFAOYSA-N	248.238	1.203	10	20	BDCD	
CN(Cc1cc(F)cc(F)c1O)CC(C)(C)N	708520320	SAFQYJZPSSCYHR-UHFFFAOYSA-N	244.285	1.840	10	20	BDCD	
C[C@@H](N[C@@H]1CC[C@H]1O)c1ccc(F)cc1O	378756496	YIZZDUWLVBWXQE-AVPPRXQKSA-N	225.263	1.705	10	20	BDCD	
Cc1ccc(CN[C@H]2CCC[C@@H]2O)c(O)c1	877700288	LPLDVWHACSPAPK-RYUDHWBXSA-N	221.300	1.704	10	20	BDCD	
Cc1ccc(O)c(CNCCC(=O)O)c1	70955128	XZEYGFQTRGVYJQ-UHFFFAOYSA-N	209.245	1.265	10	20	BDCD	
CC1(C)COCCN1Cc1ccc(N)cc1	42461173	NRBPHFCQDSQKJF-UHFFFAOYSA-N	220.316	1.880	10	20	BDCD	
C[C@@H](CO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O	273613631	WWHNQNDCKOLWAB-JGVFFNPUSA-N	240.259	1.332	10	20	BDCD	
CC(=O)C(=O)COC(=O)C1(c2ccccc2)CC1	808486896	LVXXOHUPCXFWHK-UHFFFAOYSA-N	246.262	1.420	10	20	BDCD	
O=C(O)CCCOC(=O)c1cc(O)cs1	738579614	DBJXJDTXJFHXRY-UHFFFAOYSA-N	230.241	1.475	10	20	BDCD	
Cc1cccc(CN2CC[C@@]3(CCNC3)C2)c1O	843120443	KRPNTNIKKMOGJX-OAHLLOKOSA-N	246.354	1.886	10	20	BDCD	
CCNCCNCc1cc(C)c(C)cc1O	841035504	GWNGZHDBOWKABP-UHFFFAOYSA-N	222.332	1.708	10	20	BDCD	
COC(=O)CN(C)Cc1ccc(C)cc1O	876588458	WGIDRFMMXJZCML-UHFFFAOYSA-N	223.272	1.305	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](C)[C@@H](O)C2)c1	897684007	JCLFFDBFUCOINX-GWCFXTLKSA-N	221.300	1.513	10	20	BDCD	
C[C@@H](CO)Sc1ncc([N+](=O)[O-])s1	189691158	PAKVADWNLZQGMF-BYPYZUCNSA-N	220.275	1.524	10	20	BDCD	
CC(C)CCN1CCN(C(=O)CN=[N+]=[N-])CC1	409432383	VEIGQZRDWJGYNC-UHFFFAOYSA-N	239.323	1.487	10	20	BDCD	
CC(C)(F)CCNC(=O)c1cccc(O)c1O	710991796	VSICLWDEOZFHQY-UHFFFAOYSA-N	241.262	1.966	10	20	BDCD	
CN(C)c1ccc(CNC[C@H]2CCN2C)cc1	712581287	LXICOOFIFSKAMO-CQSZACIVSA-N	233.359	1.546	10	20	BDCD	
CN1CC[C@@H](NCc2cccc(Cl)c2O)C1	162861509	KQUSQGYUGUCHFX-SNVBAGLBSA-N	240.734	1.839	10	20	BDCD	
OC[C@H]1C[C@H](NCc2cc(Cl)ccc2O)C1	923006856	GNPPJHCXBAHZGN-JLIMDTESSA-N	241.718	1.906	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)ccc2O)[C@H](C)CN1	300434970	DNWZVPBYUJOPDC-NXEZZACHSA-N	238.306	1.714	10	20	BDCD	
Cc1cccc(CNCCn2cccn2)c1O	124725984	LYDCBXAWBCZRGT-UHFFFAOYSA-N	231.299	1.687	10	20	BDCD	
C[C@@H]1CCN[C@@H](C(=O)NCc2ccccc2O)C1	127714615	SGBABAVXEMQNQV-ZYHUDNBSSA-N	248.326	1.397	10	20	BDCD	
C[C@H]1CN(Cc2c(O)cccc2Cl)CCN1	128331766	QDMNEOBDCVAPLN-VIFPVBQESA-N	240.734	1.839	10	20	BDCD	
C[C@H](O)CCNCc1ccc2c(c1)CCO2	78781345	NXGVFVHKMDZECA-JTQLQIEISA-N	221.300	1.482	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)[C@@H](C)CN1	223342604	XDMVTEMFVWGPDO-QWRGUYRKSA-N	219.332	1.451	10	20	BDCD	
OCCCCCNCc1ccc2c(c1)CCO2	83362454	VZULUNQTNSJHTB-UHFFFAOYSA-N	235.327	1.874	10	20	BDCD	
O=C(CCO)NCCCSc1nccs1	902861388	LJKQSBKUAQSCEU-UHFFFAOYSA-N	246.357	1.124	10	20	BDCD	
O=C(O[C@@H]1CCOC1)c1cccc(O)c1O	837648806	XEVNIAOWHPXDGZ-SSDOTTSWSA-N	224.212	1.044	10	20	BDCD	
CCC[C@@H](O)CCNC(=O)c1cc(O)cs1	832673557	JIOCQHREJNNURV-MRVPVSSYSA-N	243.328	1.735	10	20	BDCD	
Cc1ccc(CN[C@H](C)C[S@@](C)=O)c(O)c1	877311337	VUJHZZQRXFOGIF-QLJPJBMISA-N	241.356	1.557	10	20	BDCD	
Cc1cccc(CN(CCO)CC2CC2)c1O	775662226	SHOIRLKIKSELEA-UHFFFAOYSA-N	235.327	1.905	10	20	BDCD	
Cc1n[nH]cc1C(=O)NCc1ccc(O)c(O)c1	778917139	YXCJYLMUGXCGFI-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)NOC1CCC1	1324684456	BLXUDRDYTQRXIQ-FNORWQNLSA-N	249.266	1.711	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(N)cc2)C[C@H]1O	399920642	PNCBVAKSVJQEBQ-DGCLKSJQSA-N	220.316	1.472	10	20	BDCD	
C[C@@H](CCO)CNCc1ccc2c(c1)CCO2	97439160	NXNBPYJPFIQWCK-NSHDSACASA-N	235.327	1.730	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H](N)C2CCC2)cc1	1342019510	DUHYBRQGADYSEA-GFCCVEGCSA-N	233.315	1.012	10	20	BDCD	
C[C@H](N)C1CCN(Cc2ccc(N)cc2)CC1	1356082932	HZJPLMHFHCAXPF-NSHDSACASA-N	233.359	1.828	10	20	BDCD	
O=C(O)C1(CNCc2cccc(F)c2O)CC1	1601708341	IAJNORLCUNXGFP-UHFFFAOYSA-N	239.246	1.486	10	20	BDCD	
C[C@H](O)C1(NCc2cc(F)cc(F)c2O)CC1	895334447	GRPGOQGRQAIIHU-ZETCQYMHSA-N	243.253	1.673	10	20	BDCD	
CCON(C(=O)c1cccc(O)c1O)C(C)C	844075919	ZUDPNEGNYIOGRL-UHFFFAOYSA-N	239.271	1.900	10	20	BDCD	
OC[C@H](CC1CC1)NCc1cc(F)ccc1O	779099588	LEECHLACNFDGFI-LBPRGKRZSA-N	239.290	1.782	10	20	BDCD	
O=S(=O)(Nc1ccc(O)cc1)c1ccco1	783526503	LMOYNAGKKKFFKQ-UHFFFAOYSA-N	239.252	1.786	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)[C@@H]1CCOC1	135262171	XCLBHFWCVFETKH-GFCCVEGCSA-N	234.299	1.059	10	20	BDCD	
CCOc1ccc(N(C)CC(N)=O)cc1	143177636	QHFQIPOZSKSISI-UHFFFAOYSA-N	208.261	1.007	10	20	BDCD	
CC(=O)C(=O)COc1cc(F)ccc1[N+](=O)[O-]	808012111	KGYXYQNWRSZPQS-UHFFFAOYSA-N	241.174	1.271	10	20	BDCD	
CC[C@@H](C)OCC(=O)NCc1ccc(N)cc1	297239901	PTBYXMHJEVTNHG-SNVBAGLBSA-N	236.315	1.700	10	20	BDCD	
CN(C)c1ccc(CN(C(N)=O)C2CC2)cc1	298859424	OURWAUNMGWKUDZ-UHFFFAOYSA-N	233.315	1.796	10	20	BDCD	
C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cc(F)ccc1O	817977310	HGJYDTGDOHKKSU-UVRHIYEWSA-N	236.290	1.400	10	20	BDCD	
O=C1CC[C@H](C(=O)NCc2ccccc2O)C1	843833871	YJNRGENQLOASEF-VIFPVBQESA-N	233.267	1.378	10	20	BDCD	
Cc1ccc(CN2CCCC[C@@H]2C(N)=O)c(O)c1	876539519	JOISNHINMFTXJH-GFCCVEGCSA-N	248.326	1.540	10	20	BDCD	
CCNC(=O)[C@@H](C)NCc1ccccc1O	36794753	FNGYXNZCTHFGAR-SECBINFHSA-N	222.288	1.006	10	20	BDCD	
CCCNCc1cc([N+](=O)[O-])ccc1O	50273165	HCRMKGTXBNORLK-UHFFFAOYSA-N	210.233	1.800	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)NCCCO)s1	1537963184	YWEPZXLSEVBXHO-UHFFFAOYSA-N	240.288	1.671	10	20	BDCD	
NCC[C@H]1CCCCN1Cc1ccc(N)cc1	1334775502	ZSEOJEBZDCBPKD-CQSZACIVSA-N	233.359	1.972	10	20	BDCD	
CCC1(C(=O)NCc2cccc(O)c2O)CC1	1263894759	UPHFNJFRAUYNFJ-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
C[C@H](CN[C@H](C)c1ccccc1O)C(=O)O	1603193487	WLPQCKSZVQSPEQ-RKDXNWHRSA-N	223.272	1.764	10	20	BDCD	
CC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)OC	302094966	GRYCWRHWXXADKV-GFCCVEGCSA-N	249.310	1.663	10	20	BDCD	
COCCN1CCCc2cc(CN)ccc21	62801579	WBYPQTIJDYIVMC-UHFFFAOYSA-N	220.316	1.544	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@@H](C)C(=O)O)c1	86756620	LVJQJTGWTGVNPE-QMMMGPOBSA-N	239.271	1.306	10	20	BDCD	
C[C@H](N[C@@H](C(=O)O)C1CC1)c1ccccc1O	86758340	ZCRNNBVYGBTDSN-QPUJVOFHSA-N	235.283	1.906	10	20	BDCD	
O=C(CC[C@@H]1CCNC1)NCc1ccccc1O	228423929	JJSWCVSTFAUQFV-LLVKDONJSA-N	248.326	1.398	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H]([C@@H](C)O)C2)c1	272531836	NDLUTXPRJBSOLX-VXGBXAGGSA-N	235.327	1.903	10	20	BDCD	
C[C@H](O)CN(C)Cc1c(O)cccc1Cl	291119794	UTUQNQQEQUKVDO-QMMMGPOBSA-N	229.707	1.858	10	20	BDCD	
O=C(NCC1CCC1)c1c(F)ccc(O)c1O	294756040	DNUVWSFRMVKVMK-UHFFFAOYSA-N	239.246	1.767	10	20	BDCD	
CCOCC[C@@H](O)CNc1ccccc1OC	819393720	HCFOBWYTEGGATQ-LLVKDONJSA-N	239.315	1.895	10	20	BDCD	
CCOCC(=O)NCc1cc(Cl)ccc1O	846480203	SXNNXGZKYLNVQK-UHFFFAOYSA-N	243.690	1.698	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@H]2C[C@@H](O)C2)cc1	873829765	XCNXXVOEMBXYRT-BJHJDKERSA-N	248.326	1.140	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3CC[C@H](C2)N3)c1O	873217819	QYJOLJKFYFYWFP-BETUJISGSA-N	232.327	1.637	10	20	BDCD	
Cc1ccc(CN2C[C@@H]3CCCN[C@@H]3C2)c(O)c1	876743885	KLKPLDCJNHFVNA-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
C[C@@H](N)CNC(=O)N[C@H](C)c1ccccc1O	892104133	VZLQIPPKRYBARI-RKDXNWHRSA-N	237.303	1.100	10	20	BDCD	
C[C@H]1CCOCCN1C(=O)Cc1ccc(N)cc1	1343102519	ADWNXTKUIGWGNG-NSHDSACASA-N	248.326	1.449	10	20	BDCD	
CC(C)C[C@H]1CN(C(=O)CN=[N+]=[N-])CC[C@H]1O	409435401	UKIFTHBFHMVZFN-VHSXEESVSA-N	240.307	1.552	10	20	BDCD	
N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccccc2O)C1	713049728	CDMGUUFJOVWJMU-MISXGVKJSA-N	246.310	1.136	10	20	BDCD	
Nc1ccc(CC(=O)NC2(C3CC3)CC2)cc1	697393343	BTXRNQYNHUVRRL-UHFFFAOYSA-N	230.311	1.870	10	20	BDCD	
NCC1(C(=O)NCc2ccc(N)cc2)CCCC1	1342020055	HPMCHVLHAHLSDX-UHFFFAOYSA-N	247.342	1.404	10	20	BDCD	
C[C@H](CO)N(C)Cc1ccc(N(C)C)cc1	193447890	USNRPKRXNJGVIE-LLVKDONJSA-N	222.332	1.565	10	20	BDCD	
C[C@H]1C[C@H]1C(=O)NCc1ccccc1O	136334899	SKJBFURHGSNPQI-WCBMZHEXSA-N	205.257	1.664	10	20	BDCD	
O=C(O)[C@H]1CCCN1Cc1cc(F)ccc1O	236443032	NVPRHXRPIHPKDL-SNVBAGLBSA-N	239.246	1.580	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H]3CNC[C@H]32)c1	299911337	ACMFXKHFQGHOJL-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)CCN)cc1C	841052636	VGZFMXPNGOMTCN-LLVKDONJSA-N	222.332	1.836	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](CO)CCF)cc1C	846096054	FAPVSRNBRDNVFC-GFCCVEGCSA-N	241.306	1.819	10	20	BDCD	
CNCCCN(C)Cc1cccc(C)c1O	841104103	NNDITGSSTXCVHL-UHFFFAOYSA-N	222.332	1.742	10	20	BDCD	
CN(C(=O)CCCCCN)c1ccc(N)cc1	877077342	DSIVAWJZFSUURM-UHFFFAOYSA-N	235.331	1.751	10	20	BDCD	
Cc1cnn(CC(=O)Nc2ccc(N)cc2)c1	37676811	JKVGWCZNEVNCNI-UHFFFAOYSA-N	230.271	1.412	10	20	BDCD	
COC[C@@H](NCCc1ccc(N)cc1)C1CC1	398029820	NANNEEPTYSHZII-CQSZACIVSA-N	234.343	1.826	10	20	BDCD	
COCCCCC(=O)NCc1ccc(N)cc1	1343567183	NKUSYGMILJZPLE-UHFFFAOYSA-N	236.315	1.702	10	20	BDCD	
C[C@]1(NC(=O)NCc2ccc(N)cc2)CCOC1	1357791579	OCESUZCPKHGICL-ZDUSSCGKSA-N	249.314	1.247	10	20	BDCD	
Cc1ccc(CN[C@@H](C(=O)O)C2CC2)c(O)c1	1600418206	YLJJBHVOZHZUFH-GFCCVEGCSA-N	235.283	1.653	10	20	BDCD	
C/C=C(/C)C(=O)NCCc1ccc(O)c(O)c1	157878256	OZUXRQAYQDJSBY-OQFOIZHKSA-N	235.283	1.723	10	20	BDCD	
N[C@H]1CCN(Cc2cc(Cl)ccc2O)C1	50227704	KRRNFZYQYCCCAB-JTQLQIEISA-N	226.707	1.579	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1CC(=O)C1	119196324	XWNMUNJRJPXLCF-UHFFFAOYSA-N	233.267	1.330	10	20	BDCD	
CC1(C)CNCCN1Cc1ccccc1O	83842439	APTBCKKERODISY-UHFFFAOYSA-N	220.316	1.576	10	20	BDCD	
CC[C@H](C)[C@H](N)C(=O)NCc1ccccc1O	83363571	BOTTZFHPZVBDQA-CABZTGNLSA-N	236.315	1.382	10	20	BDCD	
CCN(CC)c1ccc(OCC(=O)O)cc1	86685134	BXJRVQXQNXFFPF-UHFFFAOYSA-N	223.272	1.996	10	20	BDCD	
C[C@H](O)CCN[C@@H]1CCc2cccc(O)c21	297542393	FCNZENBVOXVPQQ-GXSJLCMTSA-N	221.300	1.740	10	20	BDCD	
CC1(NCc2cc(F)ccc2O)CCNCC1	841065865	UHYBAWRQEDGGPF-UHFFFAOYSA-N	238.306	1.763	10	20	BDCD	
CCc1nc(CNCc2c(C)cccc2O)n[nH]1	877555427	XUYXXNWZLRYFFJ-UHFFFAOYSA-N	246.314	1.671	10	20	BDCD	
CC[C@@H](NC(C)=O)C(=O)N(C)c1ccc(N)cc1	708888010	MFWNPCWOCCLWMI-GFCCVEGCSA-N	249.314	1.146	10	20	BDCD	
C[C@@H](N)C[C@@H](C)NCc1ccc(N)cc1	1336284927	DXKONDUVQGTBMB-NXEZZACHSA-N	207.321	1.484	10	20	BDCD	
Nc1ccc(CN2CC[C@H]3NCC[C@@H]3C2)cc1	1336286522	QZZQPUFJFLKQLD-TZMCWYRMSA-N	231.343	1.453	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](C(=O)O)[C@@H]2C)c1O	1600532810	WRXPQWFWSCIUNR-CMPLNLGQSA-N	249.310	1.996	10	20	BDCD	
C[C@@H](NC(=O)c1cccc(O)c1O)C1CC1	163270969	YDKXEJDMNNVYFM-SSDOTTSWSA-N	221.256	1.626	10	20	BDCD	
OCC1(CN[C@@H]2CCc3cccc(O)c32)CC1	383842225	KOHJYVZSIDRCRA-LLVKDONJSA-N	233.311	1.742	10	20	BDCD	
N[C@H]1CCC[C@H](NCc2ccc3c(c2)CCO3)C1	841055520	PCMNUMAKAJSOSP-KBPBESRZSA-N	246.354	1.981	10	20	BDCD	
CC(C)N(C)CC(=O)N(C)c1ccc(N)cc1	37272251	JOBQIEJFGNXBIQ-UHFFFAOYSA-N	235.331	1.572	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@@H]2CCOC2)c1	131191664	NPVIULSMWWYILP-NXEZZACHSA-N	237.299	1.840	10	20	BDCD	
COCCCN(C)Cc1cccc(OC)c1O	134046089	OBTQPPAHYSNXKH-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
C[C@@H]1[C@H](O)CCN1Cc1cc(F)ccc1O	825104004	KACWMQZYYDWHRY-LDYMZIIASA-N	225.263	1.486	10	20	BDCD	
CC[C@H](NCc1cc(C)ccc1O)[C@H](C)O	386712227	PSBIXMMZGFSQIF-JQWIXIFHSA-N	223.316	1.950	10	20	BDCD	
Nc1ccc(CCNCC2CCNCC2)cc1	843125863	JXNSKHWKVODCDI-UHFFFAOYSA-N	233.359	1.401	10	20	BDCD	
CC(C)[C@@](C)(O)CNC(=O)c1cc(O)cs1	743713772	YFRVNOVEUSEZTD-NSHDSACASA-N	243.328	1.591	10	20	BDCD	
C[C@H]1CN(Cc2cccc(F)c2O)C[C@H](C)N1	843048945	BGZBMWVXYXRMAW-UWVGGRQHSA-N	238.306	1.714	10	20	BDCD	
NCC1CCN(Cc2ccc(N)cc2)CC1	1205053075	JJPQVTOHIOQSGK-UHFFFAOYSA-N	219.332	1.440	10	20	BDCD	
COCCNC(=O)c1ccc(CN=[N+]=[N-])s1	1537962842	GAJQAOKGOXVNFO-UHFFFAOYSA-N	240.288	1.935	10	20	BDCD	
COC[C@H]1CN(c2ccc(N)cc2)C[C@H]1C	409433591	YOKRXZNNSLJWBG-GHMZBOCLSA-N	220.316	1.988	10	20	BDCD	
CS(=O)(=O)CCSc1nccs1	64660935	ZGZYOMGYIHGHSG-UHFFFAOYSA-N	223.344	1.280	10	20	BDCD	
COc1cccc(O)c1CNCc1cc(C)on1	725848626	ZDMLNGHVKNCERF-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
C[C@@]1(CN)CCN(Cc2ccc(N)cc2)C1	1345159314	GBTAMRWOIUBNRV-ZDUSSCGKSA-N	219.332	1.440	10	20	BDCD	
C=CC(=O)N1CCOc2cc(N(C)C)ccc21	1346082304	VMRVFWMKFLKKNA-UHFFFAOYSA-N	232.283	1.664	10	20	BDCD	
CC[C@H](N[C@@H]1CC[C@H]1O)c1ccccc1O	378804939	WJKTZJGHHNNSDC-DMDPSCGWSA-N	221.300	1.956	10	20	BDCD	
COc1ccc(CN[C@H]2C[C@H](CO)C2)cc1C	923006746	DRZBKSSHLHSJHL-JOCQHMNTSA-N	235.327	1.864	10	20	BDCD	
Cc1ccc(CN[C@H](C)C(=O)N(C)C)c(O)c1	877158592	VBJIQQPCHKDIPN-SNVBAGLBSA-N	236.315	1.267	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@@H]2CCNC2)c1	71309760	BZESCHRREFKYOX-LLVKDONJSA-N	236.315	1.195	10	20	BDCD	
C[C@H](NC1CC1)C(=O)NCc1ccccc1O	295220491	QYYNVFBZKYXLHY-VIFPVBQESA-N	234.299	1.149	10	20	BDCD	
Cc1cccc(CN2CC(=O)N(C3CC3)C2)c1O	280461110	MGFVNSSJTRMYQR-UHFFFAOYSA-N	246.310	1.465	10	20	BDCD	
OC/C=C\CN[C@H]1CCc2cccc(O)c21	717531859	IJADYHRJSWGVKJ-BVBSBALXSA-N	219.284	1.518	10	20	BDCD	
O=C(O)[C@@H]1CCCN1Cc1cccc(F)c1O	821509762	VVLALJTVBVPHGC-JTQLQIEISA-N	239.246	1.580	10	20	BDCD	
CC[C@@](C)(O)C(=O)NCc1cc(C)ccc1O	827167096	OBKJHMGFYXRVEB-CYBMUJFWSA-N	237.299	1.478	10	20	BDCD	
Cc1nonc1CN[C@H](C)c1ccccc1O	775129615	GZPQNUDSLYZVLJ-MRVPVSSYSA-N	233.271	1.934	10	20	BDCD	
C/C=C\C(=O)NCc1ccc(OC)cc1O	794387472	JFRGMNWUSFMDOS-ARJAWSKDSA-N	221.256	1.593	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)NCc2ccccc2O)CCO1	271910513	ZBWBPGVRAFXHSS-GHMZBOCLSA-N	249.310	1.824	10	20	BDCD	
CN(Cc1ccccc1O)[C@@H]1CCCNC1=O	766884482	AUAQCUNSNUWEAX-LLVKDONJSA-N	234.299	1.103	10	20	BDCD	
COC[C@@H](C)NCc1ccc(N(C)C)cc1	19904329	UKOMEWOGZKCURW-LLVKDONJSA-N	222.332	1.877	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H](C(N)=O)C2)cc1	157067680	HNNNCGLMDAAQFR-LBPRGKRZSA-N	247.342	1.060	10	20	BDCD	
CC1(C)[C@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@@H]21	262606233	BPCHCWGHZNWWOC-STQMWFEESA-N	244.338	1.926	10	20	BDCD	
COC(=O)CC(=O)N[C@H](C)c1ccccc1O	913763600	LHDGJRLWGABODV-MRVPVSSYSA-N	237.255	1.133	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NCc1c(C)cccc1O	877641030	UTIIDSSIJPOCNV-OLZOCXBDSA-N	221.300	1.968	10	20	BDCD	
Nc1ccc(NC(=O)COCC(F)(F)F)cc1	22212375	NLIYEPUSQJPQFS-UHFFFAOYSA-N	248.204	1.786	10	20	BDCD	
CCN(CCO)Cc1cc(C)c(C)cc1O	127956950	KFJDTOWKOSDZIW-UHFFFAOYSA-N	223.316	1.823	10	20	BDCD	
CCN(CC(=O)NC)Cc1cc(C)ccc1O	132612908	SHDUDEIXEFUSNV-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
C[C@@H]1NCCN(Cc2ccc(N(C)C)cc2)[C@H]1C	379472686	SYFZBMOIWSHATP-STQMWFEESA-N	247.386	1.935	10	20	BDCD	
CC[C@H](NCCCO)c1ccc(F)cc1O	285683144	OAHCATVLYYWEGL-NSHDSACASA-N	227.279	1.954	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)[C@@H]1CO	226908714	SXRJSZRBOYKINN-GXFFZTMASA-N	220.316	1.472	10	20	BDCD	
CN1CC[C@@H](NCc2ccc(N(C)C)cc2)C1	42543751	NVCGVMUIBWXUDU-CYBMUJFWSA-N	233.359	1.546	10	20	BDCD	
CCNC(=O)N(C)Cc1ccc(N(C)C)cc1	48644787	ZWNXVEZETGSUAT-UHFFFAOYSA-N	235.331	1.914	10	20	BDCD	
CC[C@@H](O)CN[C@@H](C)c1cc(F)ccc1O	229970508	ATUQDPYVNRMQIP-WCBMZHEXSA-N	227.279	1.953	10	20	BDCD	
C[C@H](CN)N(C)Cc1cc(Cl)ccc1O	383024968	XSLPJHVSAJEUML-MRVPVSSYSA-N	228.723	1.825	10	20	BDCD	
CN(C(=O)c1c(F)ccc(O)c1O)C1CC1	276546197	GWIDMHNIHZGNRH-UHFFFAOYSA-N	225.219	1.471	10	20	BDCD	
C[C@@H](NC(=O)c1ncn(C)n1)c1ccccc1O	827946961	WDHWJOZIDUQJSN-MRVPVSSYSA-N	246.270	1.012	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@H]2[C@H](C1)C2(F)F	846665105	RNWSWKPBGJLIFT-BQBZGAKWSA-N	245.250	1.791	10	20	BDCD	
C[C@H](CCN)NCc1c(O)cccc1Cl	841052450	XCYCCKJCYKHKGJ-MRVPVSSYSA-N	228.723	1.873	10	20	BDCD	
CCOc1ccc(O)c(CN(CC)CCN)c1	863644928	MHFMUWUHPJORLO-UHFFFAOYSA-N	238.331	1.572	10	20	BDCD	
OCCCN(Cc1cc(F)ccc1O)C1CC1	779021726	YGJLRBZXJHPASQ-UHFFFAOYSA-N	239.290	1.878	10	20	BDCD	
CN(C(=O)[C@H](N)CC(F)F)c1ccc(N)cc1	877077750	SSMMNQPZYHSYPM-SECBINFHSA-N	243.257	1.214	10	20	BDCD	
CCCC(=O)NCc1cccc(O)c1O	1348034568	CHCCITCDADWANF-UHFFFAOYSA-N	209.245	1.514	10	20	BDCD	
C[C@@H]1CCN(C(=O)c2cccc(O)c2O)C1	163272605	OIYDUBINBJAPOG-MRVPVSSYSA-N	221.256	1.580	10	20	BDCD	
O=C(O)CCCNCc1ccc(F)c(F)c1O	703379401	KFIMDPJZXOLYHZ-UHFFFAOYSA-N	245.225	1.625	10	20	BDCD	
C[C@@H](NCc1cnn(C)n1)c1ccccc1O	389821220	FARNCCKCLCVABM-SECBINFHSA-N	232.287	1.372	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2CCCO2)c1	70954896	QOWGNBSCLSWABO-LBPRGKRZSA-N	221.300	1.969	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@@H]1CCOC1)CC2	381496005	BFMOYAIFBIECIT-GHMZBOCLSA-N	219.284	1.758	10	20	BDCD	
Oc1ccc(F)cc1CNCCN1CCC1	381570588	WZJXTSPLEUZLQK-UHFFFAOYSA-N	224.279	1.327	10	20	BDCD	
CC[C@](C)(OC)C(=O)NCc1ccccc1O	234119514	MCNSOXGKJOQSGG-ZDUSSCGKSA-N	237.299	1.824	10	20	BDCD	
CC[C@@H](N)CN[C@H]1CCc2cccc(O)c21	817980647	WFAXKQLJADDYJS-MNOVXSKESA-N	220.316	1.706	10	20	BDCD	
Cc1cccc(CN2CCCN(C=O)CC2)c1O	827871447	APNUSBHOQNFECP-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
C[C@](O)(C(=O)Nc1ccc(N)cc1)C1CCC1	904926868	XZXIAKKMRNMAMH-CYBMUJFWSA-N	234.299	1.758	10	20	BDCD	
C[C@]1(CNC(=O)c2cc(O)cs2)CCCO1	755860213	NZKXODGVDANPDD-LLVKDONJSA-N	241.312	1.753	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2C[C@@H](CO)C2)cc1C	865662648	GZHOOFBTVYMQTB-BJHJDKERSA-N	235.327	1.870	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H](O)C[C@@H]2C)c1	788270961	XPABBELVVIWMFU-ONGXEEELSA-N	237.299	1.356	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H]2COCO2)cc1	894868902	NOLBDLRGXJUIJH-CYBMUJFWSA-N	236.315	1.215	10	20	BDCD	
COc1cc(CN2CCO[C@H]3C[C@@H]32)c(O)cc1C	793621690	ZQQRRUAUIAYKTO-FZMZJTMJSA-N	249.310	1.682	10	20	BDCD	
CN(CCc1cnccn1)Cc1ccccc1O	273818383	ZZSRZBPLGULIKF-UHFFFAOYSA-N	243.310	1.857	10	20	BDCD	
C[C@H](NCC1(CO)COC1)c1ccccc1O	717647173	DGZIAWUUSODKAQ-JTQLQIEISA-N	237.299	1.052	10	20	BDCD	
CCCN(Cc1ccccc1O)c1nnnn1C	1351010087	GKIIEQSRQJHSOA-UHFFFAOYSA-N	247.302	1.332	10	20	BDCD	
COCCN[C@@H](C)c1cc(C)ccc1O	35628472	SSQCQWOLLATKQJ-JTQLQIEISA-N	209.289	1.998	10	20	BDCD	
C[C@H]1CCNC[C@@H]1NCc1ccc(N(C)C)cc1	841059397	RMGNIIKWWRGANC-WFASDCNBSA-N	247.386	1.840	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H](N)CC1CC1	302666579	KGMXIFFUDAPJFB-LBPRGKRZSA-N	248.326	1.478	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1O	126784121	ZQJZFEQYCCMRLU-MFKMUULPSA-N	220.316	1.472	10	20	BDCD	
C[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1	126193161	HFAOFJZAHGWFCP-VIFPVBQESA-N	235.283	1.970	10	20	BDCD	
CCNC(=O)CN(C)Cc1cc(C)ccc1O	133177069	QFIAEGGIVBCXAN-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CC(C)(CO)NCc1cc(F)ccc1O	83347405	RKSDQCICOMQXJT-UHFFFAOYSA-N	213.252	1.392	10	20	BDCD	
CNCCCNCc1cccc(OC)c1O	83353521	MOOJVPRZFHJBOH-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
N[C@@H]1CCC[C@H]2CN(Cc3ccccc3O)C[C@H]12	230125965	QWWVLFDTKNSXHH-FPMFFAJLSA-N	246.354	1.951	10	20	BDCD	
C[C@H](N[C@@H](CN)C1CC1)c1ccc(F)cc1O	817961267	VZZJHPDNXHVHIR-UFBFGSQYSA-N	238.306	1.919	10	20	BDCD	
Oc1cccc2c1[C@@H](NCCNC1CC1)CC2	817952560	FVXXUNYWHXQZHR-LBPRGKRZSA-N	232.327	1.721	10	20	BDCD	
CCC1(C(=O)Nc2ccc(N)cc2)COC1	818556536	YXUHVQPOSGNEQS-UHFFFAOYSA-N	220.272	1.634	10	20	BDCD	
NC[C@@H](NCc1cc(F)ccc1O)C1CC1	841027445	BEFGLMDWNBEVIR-LLVKDONJSA-N	224.279	1.358	10	20	BDCD	
CC[C@H](O)CN[C@H](C)c1cccc(OC)c1O	846171489	SZFVJTDKMJNOGK-ZJUUUORDSA-N	239.315	1.822	10	20	BDCD	
CNCCCNCc1c(O)cccc1OC	841042673	PKQLEDRUHQBVLE-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
CC1(NCc2ccccc2O)CCNCC1	841064769	JHCRURUZONIXPB-UHFFFAOYSA-N	220.316	1.624	10	20	BDCD	
C[C@H](CCO)N(C)C(=O)c1cc(O)cs1	846664103	CRWDSWMAJHAKSS-SSDOTTSWSA-N	229.301	1.297	10	20	BDCD	
CCn1cc(CNCc2c(C)cccc2O)nn1	877627859	XWKMIBHEBSVGGD-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CC[C@H](N)CC2)cc1	870932269	BLXWYQIJQQBAKB-MGCOHNPYSA-N	233.315	1.725	10	20	BDCD	
CC(C)(N)CCC(=O)NCc1ccc(N)cc1	1122445375	QHESTAFMXQEEDI-UHFFFAOYSA-N	235.331	1.403	10	20	BDCD	
C[C@@H](N[C@H]1CC(=O)N(C)C1)c1ccccc1O	272919357	XULWYGVCQKNPKI-ZJUUUORDSA-N	234.299	1.274	10	20	BDCD	
COC[C@@H](CCO)NCc1cccc(C)c1O	224843325	JTOVYEGNYYDGCL-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
Nc1ccc(CNCCn2ccnc2)cc1	1336287251	ZIYTVGVUCXOPOS-UHFFFAOYSA-N	216.288	1.255	10	20	BDCD	
COc1ccc(N(C)CCN2CCNC2=O)cc1	844356817	YDJMOYUGSWKARK-UHFFFAOYSA-N	249.314	1.157	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)cc1	386636215	HPQJVWCGYCMSDP-JHJVBQTASA-N	246.310	1.453	10	20	BDCD	
CCCN(CC(=O)NC)Cc1ccc(N)cc1	35364776	LWRVMNWHBRXSQD-UHFFFAOYSA-N	235.331	1.227	10	20	BDCD	
C[C@@H](NCC(=O)O)c1ccc(N(C)C)cc1	37250883	DWHOFBRLIWORNE-SECBINFHSA-N	222.288	1.488	10	20	BDCD	
COc1cccc(CNCCn2ccnc2)c1O	41119122	OUCLSMRSSPSATM-UHFFFAOYSA-N	247.298	1.387	10	20	BDCD	
CN(C(=O)/C=C/c1cnn(C)c1)c1ccccn1	134520604	HXBIAMSBHUTBSS-VOTSOKGWSA-N	242.282	1.491	10	20	BDCD	
O=C1C[C@@H](NCc2ccccc2O)CCCN1	228415488	CHBZKUSBUJUVSO-NSHDSACASA-N	234.299	1.151	10	20	BDCD	
CCN(CCN)Cc1c(O)cccc1OC	863645251	UCACXGHOMIUNHY-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
CCOCCNC(=O)c1c(F)ccc(O)c1O	276642586	VDGROWHCRLDWQX-UHFFFAOYSA-N	243.234	1.003	10	20	BDCD	
CCCN(CC(N)=O)Cc1ccc(N(C)C)cc1	746137218	MHNTZFDNZJKNOL-UHFFFAOYSA-N	249.358	1.450	10	20	BDCD	
NCC[C@H](NCc1ccccc1O)C(F)F	841073262	GKVDUJYSDMTNNK-VIFPVBQESA-N	230.258	1.464	10	20	BDCD	
CNC[C@@H](C)N[C@H](C)c1ccc(F)cc1O	854231103	DTCFXQOFXRBPGM-RKDXNWHRSA-N	226.295	1.790	10	20	BDCD	
Oc1c(F)cc(F)cc1CN1CCC(O)CC1	893902152	UFVFQQGHMCWRDS-UHFFFAOYSA-N	243.253	1.627	10	20	BDCD	
COC[C@@H](C)NCc1cc([N+](=O)[O-])ccc1O	83367818	YMLVWYFKTIYGOM-MRVPVSSYSA-N	240.259	1.425	10	20	BDCD	
C[C@H](NCc1ccc(N)cc1)c1csnn1	398395736	YVMANLRDYIWTGU-QMMMGPOBSA-N	234.328	1.971	10	20	BDCD	
COCC[C@@H](CO)NCc1cc(F)ccc1O	281375850	VWBFAGWCRUTODP-NSHDSACASA-N	243.278	1.018	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOC[C@@H]2CCC[C@H]21	409429412	RPGLHFFQMUJAAY-DTWKUNHWSA-N	224.264	1.324	10	20	BDCD	
CC[C@H](N[C@H](CO)COC)c1ccccc1O	234035020	KESVOTAXZBYOJP-PWSUYJOCSA-N	239.315	1.440	10	20	BDCD	
CC[C@@H]1C[C@H]1CNC(=O)c1cccc(O)c1O	388027996	GDPULANTKYQJLX-BDAKNGLRSA-N	235.283	1.874	10	20	BDCD	
CN(C)c1ccc(CNCCCC(=O)O)cc1	37417466	BAXIURWMDQSEKI-UHFFFAOYSA-N	236.315	1.707	10	20	BDCD	
O=C(Nc1cncnc1)c1cccc(O)c1O	229418072	JFFYEGNMRNWCCV-UHFFFAOYSA-N	231.211	1.140	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)CCO)c1	132516971	SNCVBTVCDSRCNY-VIFPVBQESA-N	225.288	1.261	10	20	BDCD	
COC[C@@H](CNCc1cc(F)ccc1O)OC	227717467	OGHCDTPEXWNBGQ-LLVKDONJSA-N	243.278	1.282	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@@H](C)C(=O)O)c1	83406940	NGGHMMSWQDMYGA-VIFPVBQESA-N	223.272	1.606	10	20	BDCD	
Cc1cccc(CN2C[C@H]3C[C@H]2C(=O)O3)c1O	294709261	DNDVQBCBIWFGAV-MNOVXSKESA-N	233.267	1.200	10	20	BDCD	
C[C@@H](NC/C=C\CO)c1ccc(N(C)C)cc1	717533752	YJTDVHJFSQIZPD-QMAVJUDZSA-N	234.343	1.952	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CC1(O)CCC1	825480960	DSECPNFSMHXZFU-UHFFFAOYSA-N	249.310	1.656	10	20	BDCD	
CC[C@@H](NCc1cccc(F)c1O)C(=O)O	820419189	PIEAEZZZZJGRSA-SECBINFHSA-N	227.235	1.484	10	20	BDCD	
CN(C)c1ccc(OC[C@@H]2CNC(=O)C2)cc1	902357661	BYVHHALPZANDFA-JTQLQIEISA-N	234.299	1.268	10	20	BDCD	
C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@@H]1O	897684875	YHTRMTLNWXJSSK-PELKAZGASA-N	241.718	1.858	10	20	BDCD	
CCOc1ccc(CNCCCCN)c(O)c1	1326075184	IJHWMZVXNDQJBF-UHFFFAOYSA-N	238.331	1.619	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@]1(F)CCOC1	1323142834	VYGDHQSNNOIXOY-GFCCVEGCSA-N	239.246	1.137	10	20	BDCD	
CC1(C)OC[C@@H]2C[C@]21NCc1ccc(N)cc1	1334753956	KGWMABICENWHJI-FZMZJTMJSA-N	232.327	1.926	10	20	BDCD	
Oc1cc(F)c(Cl)cc1CNC[C@H]1CCN1	1580888780	ZGPRRCZDUGKCPY-MRVPVSSYSA-N	244.697	1.636	10	20	BDCD	
Cc1cccc(CN2CC[C@](C)(C(=O)O)C2)c1O	1594404426	UTBFLYNGBTUYLI-AWEZNQCLSA-N	249.310	1.997	10	20	BDCD	
COc1cccc(CNC2([C@H](C)O)CC2)c1O	827579946	MOIAUYWMGKSNME-VIFPVBQESA-N	237.299	1.404	10	20	BDCD	
CO[C@@H]1COC[C@@H]1N[C@@H]1CCc2cccc(O)c21	840826807	WEQDVSWZTPHSTD-NTZNESFSSA-N	249.310	1.383	10	20	BDCD	
CNC(=O)NCCCSc1nccs1	177550091	CYAMHAOZADLGDI-UHFFFAOYSA-N	231.346	1.554	10	20	BDCD	
COc1cccc(CN[C@@H](C)c2cn[nH]c2)c1O	229884881	ARZDLLFGEDVPAO-VIFPVBQESA-N	247.298	1.975	10	20	BDCD	
CC[C@@H]1CN(Cc2cc(C)ccc2O)C[C@H]1O	271407542	WZSGUNHIKIWNIY-BXUZGUMPSA-N	235.327	1.903	10	20	BDCD	
C[C@H](N)CN[C@@H]1CCc2cccc(O)c21	817971823	HJPICKYIAZJNQD-WCBMZHEXSA-N	206.289	1.316	10	20	BDCD	
CCN(C)c1ccc(CN(C)CCC(N)=O)cc1	815116727	BHOVWACDHRNGCV-UHFFFAOYSA-N	249.358	1.450	10	20	BDCD	
CN(CCCN)Cc1ccc(N(C)C)c(F)c1	843051096	UURQPDMXRLQYSP-UHFFFAOYSA-N	239.338	1.672	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@H]1[C@@H]2CNC[C@@H]21	841078471	RPONUOHFOGOCOX-IAZYJMLFSA-N	238.718	1.353	10	20	BDCD	
Cc1cccc(CN2CCC[C@H]3CNC[C@H]32)c1O	841027033	ITJMSHCUMURVEZ-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
CC[C@@H](CCO)CNC(=O)c1cc(O)cs1	762832798	NSTHGXNNMGCFTA-QMMMGPOBSA-N	243.328	1.592	10	20	BDCD	
Cc1ncsc1/C=C/C(=O)N(C)c1cn[nH]c1	777261651	JTAXPXHLPHWCON-ONEGZZNKSA-N	248.311	1.851	10	20	BDCD	
C[C@H](CN)NCc1ccc(N2CCCC2)cc1	1328681927	PDHDDKJFVADPIF-GFCCVEGCSA-N	233.359	1.724	10	20	BDCD	
C[C@H](NCCN1CCC1)c1cc(F)ccc1O	697393912	NKAGATMZQKUOIW-JTQLQIEISA-N	238.306	1.888	10	20	BDCD	
COc1cccc(O)c1CNC[C@H]1CCN1C	922575769	MZJLDRHJSBZTOK-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
O=C(NCC(F)(F)F)c1cccc(O)c1O	163268699	NVRMJNLEUQXZNV-UHFFFAOYSA-N	235.161	1.390	10	20	BDCD	
CCC[C@H]1C(=O)NCCN1Cc1ccccc1O	179582473	KRJZDHBXPKSMSC-LBPRGKRZSA-N	248.326	1.493	10	20	BDCD	
O=C(CSc1nccs1)N1CCCC1	60759767	MWZCUNURIGKNGL-UHFFFAOYSA-N	228.342	1.858	10	20	BDCD	
CC(C)NC(=O)NCc1ccccc1O	136335468	SVGDBDOXAHBJDF-UHFFFAOYSA-N	208.261	1.600	10	20	BDCD	
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CC1	183462597	NBHYLEJIBLOSST-QMMMGPOBSA-N	235.283	1.555	10	20	BDCD	
CN(CC(C)(C)N)C(=O)Cc1ccc(N)cc1	852842083	PQGZJPGEQXBMHC-UHFFFAOYSA-N	235.331	1.007	10	20	BDCD	
C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)F	194848505	DMRYKWSCCALVAV-ZCFIWIBFSA-N	245.225	1.410	10	20	BDCD	
FC(F)CNCc1ccc2c(c1)CCO2	147330186	YELSVHWEWYSFNU-UHFFFAOYSA-N	213.227	1.976	10	20	BDCD	
C[C@H](C[S@@](C)=O)NCc1cc(F)ccc1O	230392606	ZPIWGRUCNZTYCG-VPTHRUTESA-N	245.319	1.388	10	20	BDCD	
Cc1nnc(COc2ccc(N(C)C)cc2)n1C	289359046	INYBYXCUVRGLFK-UHFFFAOYSA-N	246.314	1.769	10	20	BDCD	
C[C@@H](NC(=O)C1CC(=O)C1)c1ccccc1O	827941922	ZZTICDCIISYXEW-MRVPVSSYSA-N	233.267	1.549	10	20	BDCD	
COC(=O)c1cnc(SC[C@@H](C)CO)s1	829681475	XHZVVICCBDTSBE-LURJTMIESA-N	247.341	1.650	10	20	BDCD	
C[C@@H](NC[C@@H]1CCN1C)c1c(O)cccc1F	903316349	OCHASULLHVTJEC-ZJUUUORDSA-N	238.306	1.886	10	20	BDCD	
Oc1ccccc1CN1CC[C@]2(CCCN2)C1	841105413	KFFISEFLZSBNEY-CQSZACIVSA-N	232.327	1.720	10	20	BDCD	
C[C@@H](NC(=O)c1cc(O)cs1)c1nc[nH]n1	748379584	PUNMZMZGGZSKDE-RXMQYKEDSA-N	238.272	1.063	10	20	BDCD	
CCc1cccc(CN2CCC[C@@H]2CO)c1O	848880717	JAUQUCYTZBHTPT-CYBMUJFWSA-N	235.327	1.911	10	20	BDCD	
CC(=O)c1cc(F)cc(CN(C)CCO)c1O	50134640	MWAOFBNDFYDAII-UHFFFAOYSA-N	241.262	1.158	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H](C)C(=O)O)c1	49353980	IPTYVMQUEVGTEZ-HTQZYQBOSA-N	239.271	1.525	10	20	BDCD	
CCN(C)C(=O)[C@@H](C)NCc1ccccc1O	188472271	SYAAXHBLULUTTP-SNVBAGLBSA-N	236.315	1.349	10	20	BDCD	
COC1[C@H]2C[C@H]1CN(c1ccc(N)cc1)C2	409426486	IGFOEOVIIPYGKT-UWVGGRQHSA-N	218.300	1.740	10	20	BDCD	
CC(F)(F)CNC(=O)Cc1ccc(N)cc1	697599806	FDCOUNLAXDWZCJ-UHFFFAOYSA-N	228.242	1.583	10	20	BDCD	
C[C@H]1CNCCN1Cc1ccc(N(C)C)cc1	107091913	XOEMATUJMZRSBG-LBPRGKRZSA-N	233.359	1.546	10	20	BDCD	
C[C@@H]1COC[C@H]1NCc1ccc2c(c1)CCO2	710894176	UBGSNECJFNWOOJ-ZWNOBZJWSA-N	233.311	1.746	10	20	BDCD	
CC[C@H](CO)NCc1c(C)cccc1O	877138409	YPLQFHPILULZCK-SNVBAGLBSA-N	209.289	1.561	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCCNCC2)c1O	841058579	SYXUCLUWFTZHDM-CYBMUJFWSA-N	234.343	1.932	10	20	BDCD	
O=C(CC[C@H]1CCCO1)NCc1ccccc1O	133757958	SICDVJRFDJHFCL-GFCCVEGCSA-N	249.310	1.968	10	20	BDCD	
C[C@H](NCc1cc[nH]n1)c1ccccc1O	41014121	XPRVGRJUPIZNFH-VIFPVBQESA-N	217.272	1.966	10	20	BDCD	
COCC[C@@H](CO)N[C@@H](C)c1ccccc1O	281541122	IQXSFCLNWLHEFE-QWRGUYRKSA-N	239.315	1.440	10	20	BDCD	
C[C@H](CO)N(C)Cc1c(O)ccc(Cl)c1F	809744948	AGZCASJPHUNKRM-SSDOTTSWSA-N	247.697	1.997	10	20	BDCD	
C=Cn1cc(/C=C2\SC(=S)NC2=O)cn1	588597103	NEFDNDUCDYLXKI-CLTKARDFSA-N	237.309	1.472	10	20	BDCD	
C[C@@H](CCN)NCc1c(O)cccc1Cl	841052451	XCYCCKJCYKHKGJ-QMMMGPOBSA-N	228.723	1.873	10	20	BDCD	
CC[C@@H](C(=O)O)N(C)Cc1cc(C)ccc1O	86803403	BZTRXLJIPBINRM-NSHDSACASA-N	237.299	1.996	10	20	BDCD	
Cc1cccc(CNC[C@H]2C[C@@H](O)C2)c1O	720934529	CYAUKCIUWAERDP-KLPPZKSPSA-N	221.300	1.561	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)[C@H](C(N)=O)C1	1337838295	NHWXLNKQJIZWLW-MFKMUULPSA-N	247.342	1.355	10	20	BDCD	
CC(C)(C)C(=O)NCCc1ccc(O)c(O)c1	11639059	VWYOELKIAGDDBT-UHFFFAOYSA-N	237.299	1.803	10	20	BDCD	
CCN(CC(=O)O)Cc1c(C)cccc1O	1596224886	HZKALMZJRRNBIJ-UHFFFAOYSA-N	223.272	1.607	10	20	BDCD	
O=C(NCC1=CCCOC1)c1cccc(O)c1O	380166956	LZYWDYXDRJZFTP-UHFFFAOYSA-N	249.266	1.174	10	20	BDCD	
COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]2C)c1	114543231	IPCRGUJBKKEIDR-GZMMTYOYSA-N	235.283	1.673	10	20	BDCD	
C[C@H](N)[C@@H]1CCN(Cc2cc(F)ccc2O)C1	220341116	VTFCCNWUMBNNPC-VHSXEESVSA-N	238.306	1.700	10	20	BDCD	
COc1ccc(CN[C@@H](C)C(=O)O)cc1C	49357710	SHHRDAGTJAEWNC-VIFPVBQESA-N	223.272	1.566	10	20	BDCD	
OC[C@H](NCc1cc(Cl)ccc1O)C1CC1	381631388	QRKKMFUSSAGLPW-NSHDSACASA-N	241.718	1.906	10	20	BDCD	
CO[C@H]1CCCN(Cc2ccc(N)cc2)C1	230226493	XGZDGUFAMPJFCB-ZDUSSCGKSA-N	220.316	1.880	10	20	BDCD	
OCC1(CNCc2cccc(Cl)c2O)CC1	162869865	LXZMTWPFTQOBCU-UHFFFAOYSA-N	241.718	1.908	10	20	BDCD	
CCN(Cc1cc(F)ccc1O)[C@H](C)CO	292774764	KUHOYCZOSQKNIA-SECBINFHSA-N	227.279	1.734	10	20	BDCD	
CCN(C)c1ccc(CN(C)[C@H](C)CO)cc1	815114096	ORPIVNCWNYVVCN-GFCCVEGCSA-N	236.359	1.955	10	20	BDCD	
C[C@@H](NC[C@H](N)C1CC1)c1ccccc1O	817964729	GJAJFKWPQPJNHI-SKDRFNHKSA-N	220.316	1.780	10	20	BDCD	
CC(=O)C(=O)COc1nccc(C(F)(F)F)n1	842548468	WIUBJSIFXSDNQK-UHFFFAOYSA-N	248.160	1.032	10	20	BDCD	
COc1cccc([C@H](C)NC/C=C\CO)c1O	850510220	VZCLDENULHUBDD-XOULXFPDSA-N	237.299	1.600	10	20	BDCD	
CC[C@H](OC(=O)c1cccc(O)c1O)C(C)=O	873380503	QQHIWXKHSROZBG-JTQLQIEISA-N	238.239	1.622	10	20	BDCD	
Cc1ccc(CN2CCc3nn[nH]c3C2)c(O)c1	877641628	CECBWTAKLJSNCZ-UHFFFAOYSA-N	244.298	1.377	10	20	BDCD	
Cc1cccc(O)c1CN1CCCNC(=O)C1	876640584	YPBWWMWGRCYKKD-UHFFFAOYSA-N	234.299	1.023	10	20	BDCD	
CO[C@H]1CN(Cc2ccccc2O)CCO1	895968590	DPEFHLMSTUJIBK-GFCCVEGCSA-N	223.272	1.197	10	20	BDCD	
C[C@@H](NCc1c[nH]cn1)c1ccccc1O	84080958	IXMBOCDFUKMDMD-SECBINFHSA-N	217.272	1.966	10	20	BDCD	
COc1cccc(O)c1CNC[C@@H](O)C1CC1	734844750	UFHRGSRCAPHZSD-GFCCVEGCSA-N	237.299	1.261	10	20	BDCD	
COC[C@@H](CCO)NCc1cc(C)ccc1O	219128032	IIUGZHSGRNGFHP-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
O=C(N[C@@]12CCC[C@@H]1C2)c1cccc(O)c1O	693829131	IYVQLDSTMXQSDC-AMIZOPFISA-N	233.267	1.770	10	20	BDCD	
Cc1cccc(CNCC(C)(C)O)c1O	162864028	YSGYSRLZVOIBCY-UHFFFAOYSA-N	209.289	1.561	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](CO)CC(F)F)c1	717823489	IFNLSTNXYGUBRP-SNVBAGLBSA-N	245.269	1.806	10	20	BDCD	
COC(=O)C[C@@H]1CCCN1Cc1ccccc1O	180195746	LUBIUSZYQRYTRW-LBPRGKRZSA-N	249.310	1.920	10	20	BDCD	
C[C@@]1(NCc2ccccc2O)CCOC1=O	289746923	HYWXJBLVMBEBBS-GFCCVEGCSA-N	221.256	1.187	10	20	BDCD	
CC[C@H](CO)NCc1cc(F)ccc1O	83347399	LOVBIAIPAWFUHV-SNVBAGLBSA-N	213.252	1.392	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCc2ncc[nH]2)c1	80581906	YTPLYKRLRTYERP-SECBINFHSA-N	247.298	1.975	10	20	BDCD	
CC(C)(C)[C@H](N)C(=O)Nc1ccc(N)cc1	294646261	BLTXIAUFVXHBKH-SNVBAGLBSA-N	221.304	1.581	10	20	BDCD	
CCc1cccc(CN2C[C@H]3C[C@H]2C(=O)O3)c1O	848916499	VQBKSIUEXKYKJJ-NEPJUHHUSA-N	247.294	1.454	10	20	BDCD	
CN(Cc1ncnn1CCF)c1ccc(N)cc1	863558710	ULZDDTAZCOOMDS-UHFFFAOYSA-N	249.293	1.466	10	20	BDCD	
O=C1OC[C@H](COC(=O)c2cc(O)cs2)O1	763973892	VPXNLVKYFVCLNG-LURJTMIESA-N	244.224	1.146	10	20	BDCD	
CN(Cc1cn[nH]c1)Cc1cc(F)ccc1O	779020512	MPWVITOWIPBUDD-UHFFFAOYSA-N	235.262	1.886	10	20	BDCD	
COc1ccc(O)c(CN(C)Cc2cn[nH]c2)c1	775700265	LYPIZXKVYHKXHC-UHFFFAOYSA-N	247.298	1.756	10	20	BDCD	
CCONC(=O)NCc1ccc(OC)cc1O	792774795	WLUNGILJDXBOLN-UHFFFAOYSA-N	240.259	1.152	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCc2ncn[nH]2)c1	37919246	QIUBJTRTLFSIIE-QMMMGPOBSA-N	248.286	1.370	10	20	BDCD	
O[C@H]1C[C@@H](CNCc2ccc3c(c2)CCO3)C1	720992196	JTBRYVFVJPUQTH-BJHJDKERSA-N	233.311	1.482	10	20	BDCD	
CC[C@@H](NCc1cc(F)c(F)cc1O)C(=O)O	1603915885	VOMVOBDNFHBVQK-SECBINFHSA-N	245.225	1.623	10	20	BDCD	
CCOc1cccc(CN[C@H](C)COC)c1O	19904645	HDZXXOYPISHPSE-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
Cc1ccc([C@H](C)NCCN(C)C)c(O)c1	20083636	QHSHPJAWVRHAMP-NSHDSACASA-N	222.332	1.913	10	20	BDCD	
CC1(NC(=O)c2cccc(O)c2O)CC=CC1	702192134	ZREZNTYKAKTPAD-UHFFFAOYSA-N	233.267	1.936	10	20	BDCD	
CN(Cc1cc[nH]n1)c1ccc2c(c1)OCO2	180759119	BHJCHONFVCUKRG-UHFFFAOYSA-N	231.255	1.775	10	20	BDCD	
C[C@@]1(NCc2cc(F)ccc2O)CCOC1	226617975	AYWIXZYERFAXMN-GFCCVEGCSA-N	225.263	1.800	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CC[C@H]2O)c1	382046961	ZTFHVJJXPDVIAJ-ZYHUDNBSSA-N	207.273	1.314	10	20	BDCD	
Cc1cnc(CNCc2ccccc2O)o1	231788137	NSGWYJZBRTUUJA-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
C[C@]1(C(N)=O)CCN(Cc2ccccc2O)C1	235747695	KOOVJLXEHONQIN-ZDUSSCGKSA-N	234.299	1.090	10	20	BDCD	
CC(C)[C@H](O)C(=O)N(C)Cc1ccccc1O	292058485	GAIBCFRQMJEYPB-LBPRGKRZSA-N	237.299	1.368	10	20	BDCD	
CCc1cccc(CN(C)C[C@H](C)O)c1O	848902968	VWKULVCQGJIOBM-JTQLQIEISA-N	223.316	1.767	10	20	BDCD	
CC(C)(N)CNCc1c(O)cccc1Cl	841031598	XOYFVJNVJPNHDK-UHFFFAOYSA-N	228.723	1.873	10	20	BDCD	
Cc1ccc(CN(C)[C@H](C)CCO)c(O)c1	877615532	SOWNAMNWWHHBIZ-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)O)c1	49353969	IPTYVMQUEVGTEZ-YUMQZZPRSA-N	239.271	1.525	10	20	BDCD	
C[C@@H](CO)N[C@H](C)c1ccc(F)c(F)c1O	187737991	IMSDUUJUUBYCHQ-NKWVEPMBSA-N	231.242	1.702	10	20	BDCD	
CCOC[C@@H]1CCCCN1C(=O)CN=[N+]=[N-]	409425650	GJBGFBPPISLBMW-VIFPVBQESA-N	226.280	1.714	10	20	BDCD	
COc1cccc(CN[C@@H]2CCCOC2)c1O	109543592	AGHJHHRDMGKAPF-LLVKDONJSA-N	237.299	1.669	10	20	BDCD	
CC[C@@H]1CN(Cc2ccccc2O)CC[C@H]1N	251901745	WXJLLGPQUSDMTL-DGCLKSJQSA-N	234.343	1.951	10	20	BDCD	
Cc1nonc1CN(C)Cc1ccccc1O	265128921	MICYUNACJAKCLT-UHFFFAOYSA-N	233.271	1.716	10	20	BDCD	
CC(=O)C(=O)COc1cc([N+](=O)[O-])ccc1C	289532918	DYBTWPXKITZVNF-UHFFFAOYSA-N	237.211	1.440	10	20	BDCD	
CCOc1ccc(O)c(CNCCC(=O)O)c1	818244789	QFCFMGBHGKDASN-UHFFFAOYSA-N	239.271	1.355	10	20	BDCD	
C[C@]1(CNCCc2ccc(N)cc2)CCCNC1	904353630	PJZUTIWMAUMXBB-HNNXBMFYSA-N	247.386	1.791	10	20	BDCD	
CC[C@H](NCC1(N)CC1)c1ccccc1O	902408626	ZRSDXVQBWMIQRV-NSHDSACASA-N	220.316	1.924	10	20	BDCD	
CC[C@H](COC)NC(=O)c1cc(O)cs1	738550279	ZPJBFYTWAWLJTL-SSDOTTSWSA-N	229.301	1.609	10	20	BDCD	
OC[C@H](CCF)NCc1cccc(Cl)c1O	846102202	YXMLKAYHJIXNDX-VIFPVBQESA-N	247.697	1.856	10	20	BDCD	
CN(C[C@H]1CCOC1)C(=O)c1cc(O)cs1	749545740	WWLQBKZRVJEJJE-MRVPVSSYSA-N	241.312	1.562	10	20	BDCD	
c1csc(Sc2nccn3nnnc23)n1	747821543	GSILHOVMYWJENC-UHFFFAOYSA-N	236.285	1.127	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H]1CCOC1	876929294	HIXRPUXJAAYDNI-NSHDSACASA-N	221.300	1.827	10	20	BDCD	
Cc1cc(O)c(CN2C[C@H](O)C[C@@H]2C)cc1C	788271150	ZFINUBFKVCKIBR-WCQYABFASA-N	235.327	1.964	10	20	BDCD	
C[C@@](O)(CNCc1ccccc1O)C1CC1	390366977	UMWBUQDXAOESSG-CYBMUJFWSA-N	221.300	1.643	10	20	BDCD	
C[C@@H]1[C@H](C(=O)NCc2ccc(N)cc2)CCN1C	1263303661	DDCINMRPDFUTMG-ZWNOBZJWSA-N	247.342	1.225	10	20	BDCD	
CC(C)C(=O)NCc1cccc(O)c1O	1349079821	SALHAQCEPZQDPE-UHFFFAOYSA-N	209.245	1.370	10	20	BDCD	
CC[C@H](O)CSc1ncc(C(=O)O)s1	1595331677	IOZVFBXAPMLQKM-YFKPBYRVSA-N	233.314	1.704	10	20	BDCD	
CC1(C)NCC[C@@H]1NC(=O)Cc1ccc(N)cc1	841858083	YKXLSNMNQRSVEK-LBPRGKRZSA-N	247.342	1.068	10	20	BDCD	
CN(Cc1ccc(N)cc1)C(C)(C)CC(=O)O	1598519464	RLDKUYUBSJTHAT-UHFFFAOYSA-N	236.315	1.954	10	20	BDCD	
CC(C)(C)C(=O)NCc1ccc(O)c(O)c1	116902113	YSYPKVKPFRQONQ-UHFFFAOYSA-N	223.272	1.760	10	20	BDCD	
COCC(=O)NCc1ccc(N(C)C)cc1C	115281074	SAEXPEUSPTZFDZ-UHFFFAOYSA-N	236.315	1.324	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2ccoc2)c1	114541187	FTYGVCNUXBCYFX-UHFFFAOYSA-N	247.250	1.924	10	20	BDCD	
C[C@H](Cn1cccn1)NCc1ccccc1O	37154847	YRWXLBVHCCMDJV-LLVKDONJSA-N	231.299	1.767	10	20	BDCD	
CCN(CCCO)Cc1ccc(N(C)C)cc1	263882911	JXUQYVVCCHUNPN-UHFFFAOYSA-N	236.359	1.957	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cc(C)ccc1C	808488862	SKNGHFHBVPVLQR-UHFFFAOYSA-N	234.251	1.618	10	20	BDCD	
C[C@H](CCO)CCNC(=O)c1cc(O)cs1	833221150	DRHXKIJRXFXEOT-QMMMGPOBSA-N	243.328	1.592	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)CN	841066911	RIHTWBCWANFFEH-NSHDSACASA-N	221.348	1.498	10	20	BDCD	
CN(C)c1ccc(CNC/C=C\CO)cc1F	850357209	BBVJNSODNRTLCL-ARJAWSKDSA-N	238.306	1.530	10	20	BDCD	
COC(=O)[C@@H](NCc1ccc(C)cc1O)C1CC1	877471476	TUPORNNIZYKZNN-ZDUSSCGKSA-N	249.310	1.742	10	20	BDCD	
Cc1ccc(CN[C@H](CCO)C2CC2)c(O)c1	877058788	GHOJODXPCKLMLR-CYBMUJFWSA-N	235.327	1.951	10	20	BDCD	
CCS(=O)(=O)N(C)Cc1ccccc1O	77898247	MHOHDSQPTVEZMZ-UHFFFAOYSA-N	229.301	1.174	10	20	BDCD	
CN(C)c1ccc(CN2CCNC(C)(C)C2)cc1	84571212	CELCXNRGHVMZSU-UHFFFAOYSA-N	247.386	1.936	10	20	BDCD	
Cn1ccc(C2CCN(CCN=[N+]=[N-])CC2)n1	409423797	AMDWKCBEYVUGJQ-UHFFFAOYSA-N	234.307	1.910	10	20	BDCD	
C[C@@H](CNCc1ccccc1O)N(C)C1CC1	105488252	VBNXYEUSZNCLRU-NSHDSACASA-N	234.343	1.965	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CCCC[C@H]2O)cc1	51988697	SOKSGBLFUXVKJS-CHWSQXEVSA-N	248.326	1.231	10	20	BDCD	
C=CC(=O)NCc1ccc(N2CCOCC2)cc1	115288913	YXTCILMWZMJWEJ-UHFFFAOYSA-N	246.310	1.325	10	20	BDCD	
CCC(=O)N1CCOc2cc(N(C)C)ccc21	173191387	OAAHJQOLEONGKY-UHFFFAOYSA-N	234.299	1.888	10	20	BDCD	
Cc1ccc(O)c(CN2CCNC(=O)[C@@H]2C)c1	123511121	RNRSQYCFBRMNHT-JTQLQIEISA-N	234.299	1.021	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCCN)c1	37712456	FHIYHFGNJWNNRJ-QMMMGPOBSA-N	210.277	1.010	10	20	BDCD	
Cc1cccc(CNCCn2ccnc2)c1O	124663350	UTHQSMLBCOFCHY-UHFFFAOYSA-N	231.299	1.687	10	20	BDCD	
O=C(NOC1CCCC1)c1cccc(O)c1O	126611524	WFJDKRSYFJPIHT-UHFFFAOYSA-N	237.255	1.702	10	20	BDCD	
C[C@H](CC[S@@](C)=O)NCc1ccccc1O	131298106	RIHUFTMVZIWJMN-HWPZZCPQSA-N	241.356	1.639	10	20	BDCD	
Cc1nnc(N(C)Cc2ccccc2O)n1C	290417072	NFSSQWRGOTUGJC-UHFFFAOYSA-N	232.287	1.466	10	20	BDCD	
CC[C@@H](C(=O)O)N(C)Cc1ccccc1O	83414709	CULVRXMFQQFEOZ-JTQLQIEISA-N	223.272	1.687	10	20	BDCD	
CN(C)CCN[C@H]1CCc2cccc(O)c21	297197752	FVCXVOTYSVJPMR-NSHDSACASA-N	220.316	1.531	10	20	BDCD	
C[C@@H](N[C@@H]1CCNC1)c1cc(F)ccc1O	817945300	ZBPSFXMPMBJCFF-PSASIEDQSA-N	224.279	1.544	10	20	BDCD	
NC[C@H]1CCCC[C@H]1NCCc1ccc(N)cc1	817958166	SQJQIEPUJHZVRD-UKRRQHHQSA-N	247.386	1.918	10	20	BDCD	
CCON(CC)C(=O)c1cc(O)cs1	831459260	YJWJCOMOUFWVPJ-UHFFFAOYSA-N	215.274	1.867	10	20	BDCD	
CCN(CCCN)Cc1ccc(N(C)C)cc1	841005498	AADVGYWESOSUPT-UHFFFAOYSA-N	235.375	1.923	10	20	BDCD	
C[C@H]1CNCCN1Cc1cccc(F)c1O	843046874	CUMYLOWIZDPXHQ-VIFPVBQESA-N	224.279	1.325	10	20	BDCD	
CNC[C@@H](C)NCc1c(O)cccc1Cl	853249545	RCLPBMGNDACWKH-MRVPVSSYSA-N	228.723	1.743	10	20	BDCD	
Cc1cccc(O)c1CNCCC(=O)N(C)C	876989905	JZZMNGBGILMMJE-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CCO[C@@H]1CN(c2ccc(N)cc2)C[C@H]1OC	409432743	LTYRVCWUHFJDOP-CHWSQXEVSA-N	236.315	1.509	10	20	BDCD	
C[C@H](O)[C@H](C)Sc1ncc([N+](=O)[O-])s1	194946399	JCKJOVBYYNPLFS-WHFBIAKZSA-N	234.302	1.913	10	20	BDCD	
Cc1cc(O)c(CNCC2(N)CC2)cc1Cl	1579638069	QEJLMLNMSLFNPV-UHFFFAOYSA-N	240.734	1.935	10	20	BDCD	
COc1cccc(CN[C@H]2CO[C@H](C)C2)c1O	402031065	ILITWIHOKCJPOM-MWLCHTKSSA-N	237.299	1.668	10	20	BDCD	
C[C@]1(CN)CCN(Cc2ccccc2O)C1	309411902	IZKPWVZLCZBCAW-CYBMUJFWSA-N	220.316	1.563	10	20	BDCD	
Oc1cccc(Cl)c1CNC[C@@H](O)C1CC1	83599857	IFZQPOGBJMMXQG-GFCCVEGCSA-N	241.718	1.906	10	20	BDCD	
CC[C@H](O)CNCc1ccc(N(C)C)c(F)c1	291735696	OJXLJFPCPMIEGK-NSHDSACASA-N	240.322	1.752	10	20	BDCD	
Cc1cc(CN(C)CCC(N)=O)ccc1N(C)C	293571187	NABOXUPKSFJZAP-UHFFFAOYSA-N	249.358	1.368	10	20	BDCD	
CCC[C@@](C)(N)C(=O)Nc1ccc(N)cc1	294699605	GPQNSQWNUDBQOK-GFCCVEGCSA-N	221.304	1.725	10	20	BDCD	
Cc1cnc(C(=O)N(C)Cc2ccccc2O)o1	813805132	AIWMJZAENRKKJW-UHFFFAOYSA-N	246.266	1.961	10	20	BDCD	
C[C@@H](CSc1nccs1)S(C)(=O)=O	829100361	QMMKIZJGYZXPFI-LURJTMIESA-N	237.371	1.668	10	20	BDCD	
CC[C@H](NCc1cc(F)ccc1O)[C@H](C)O	386728551	ARUAUBDJMVGVLL-KWQFWETISA-N	227.279	1.780	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@@H]1CCNC1	841045468	WDGVSQDHAIAOHO-SNVBAGLBSA-N	226.707	1.497	10	20	BDCD	
COCCCC(=O)NCc1cc(C)ccc1O	862758549	CPDYOJPRXNEOQX-UHFFFAOYSA-N	237.299	1.743	10	20	BDCD	
Cc1ccc(CNCC(C)(C)O)c(O)c1	877041792	OHPXMGCAKSMTFF-UHFFFAOYSA-N	209.289	1.561	10	20	BDCD	
C[C@@H](CO)N[C@H](C)c1c(O)cccc1F	886532760	OIOYBVBETSUOGR-JGVFFNPUSA-N	213.252	1.563	10	20	BDCD	
CC[C@H](CO)NCc1cccc(C)c1O	83345886	UYJRLGQFXMVXBF-LLVKDONJSA-N	209.289	1.561	10	20	BDCD	
CN1CC[C@H]1CNCc1ccc2c(c1)CCO2	712583052	SQAHKYJJVNQPTB-ZDUSSCGKSA-N	232.327	1.415	10	20	BDCD	
CN1CC[C@H]1CNCc1cc(F)cc(F)c1O	712583094	WZDANEXUJNUIOS-JTQLQIEISA-N	242.269	1.464	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H]2C[C@@H](O)C2)c1	825257064	SSBAMZHCRLBOTD-BBBLOLIVSA-N	237.299	1.575	10	20	BDCD	
CN1C[C@@H](N[C@H]2CCc3cccc(O)c32)CC1=O	297509524	CLBFIDQYEITBBP-QWRGUYRKSA-N	246.310	1.200	10	20	BDCD	
CC1(NC(=O)Cc2ccc(N)cc2)CCOCC1	229890186	SLDXTCXTRCXGCU-UHFFFAOYSA-N	248.326	1.497	10	20	BDCD	
O=C(NC1CCC1)c1cccc(O)c1O	163273484	OEQMRPIFWBCBDR-UHFFFAOYSA-N	207.229	1.380	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CCCCCN2)cc1	364475683	BZHWCHCRMUVELR-LBPRGKRZSA-N	233.315	1.740	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cc(C)cc(C)c1	808488820	QLDZBJZGUWHPKA-UHFFFAOYSA-N	234.251	1.618	10	20	BDCD	
CNCCCN[C@@H](C)c1cc(F)ccc1O	817940878	ONYIQMLIRZGBDR-VIFPVBQESA-N	226.295	1.791	10	20	BDCD	
Cc1cc(CN2CCN(C)CC2)ccc1N(C)C	815013954	SPMJWZCECQTSQH-UHFFFAOYSA-N	247.386	1.808	10	20	BDCD	
CNCCCN(C)Cc1cccc(F)c1O	841103301	GFKJLZCMFUNLCJ-UHFFFAOYSA-N	226.295	1.573	10	20	BDCD	
CO[C@H](C)CNC(=O)NCc1ccc(N)cc1	1120664105	GFUORAFNCXCONN-SECBINFHSA-N	237.303	1.103	10	20	BDCD	
CN(CCN1CCCC1=O)Cc1ccccc1O	109770384	PQBPKWLCFBXUAQ-UHFFFAOYSA-N	248.326	1.446	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@]23CCC[C@@H]2C3)cc1	693218516	RRWFHMPGHJZCJB-BXUZGUMPSA-N	230.311	1.870	10	20	BDCD	
COC(=O)[C@H](C)NCc1c(O)cccc1OC	793183176	PFEOOHZQEORAAW-QMMMGPOBSA-N	239.271	1.052	10	20	BDCD	
CCC[C@@](C)(N)C(=O)NCc1ccc(N)cc1	1343472466	HQLBDCPCZMXPRG-CYBMUJFWSA-N	235.331	1.403	10	20	BDCD	
COC[C@H]1CCN(Cc2cc(F)ccc2O)C1	226565064	JUQBDERIMXIGSV-JTQLQIEISA-N	239.290	2.000	10	20	BDCD	
C[C@@H](CCCN)NCc1ccc(N(C)C)cc1	310490081	FTQCVVYOTVAVRO-LBPRGKRZSA-N	235.375	1.970	10	20	BDCD	
Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCO	20596943	HWDQENKAAFHSPS-ZJUUUORDSA-N	221.300	1.831	10	20	BDCD	
Oc1ccc(F)cc1CN1CCC(O)CC1	179886155	QFFJDHSEMOWESK-UHFFFAOYSA-N	225.263	1.488	10	20	BDCD	
COC(=O)[C@H](C)N[C@H](C)c1ccccc1O	37074089	HAFQKTKSEYRFPV-BDAKNGLRSA-N	223.272	1.604	10	20	BDCD	
O=C(CC1CCNCC1)NCc1ccccc1O	228422842	KYFXPOMSFGSVGL-UHFFFAOYSA-N	248.326	1.398	10	20	BDCD	
C[C@@H](C[S@@](C)=O)NCc1cc(F)ccc1O	230392604	ZPIWGRUCNZTYCG-ZKANADHPSA-N	245.319	1.388	10	20	BDCD	
C[C@H]1C[C@@H](O)CCN1Cc1cccc(F)c1O	292885464	YDRNMHQESFDQKM-ONGXEEELSA-N	239.290	1.877	10	20	BDCD	
C[C@H](NC[C@@H](N)C1CC1)c1ccc(F)cc1O	817965931	XCTLLZKVBKZMII-QPUJVOFHSA-N	238.306	1.919	10	20	BDCD	
C[C@@H](N)CN[C@H](C)c1cc(F)cc(F)c1O	817971847	HTTHQUSQVAMYDZ-RNFRBKRXSA-N	230.258	1.668	10	20	BDCD	
C[C@@H](N[C@@H]1CC[C@H]1O)c1cc(F)cc(F)c1O	818358048	QCRNKLYOLHIIND-DIMCTHFVSA-N	243.253	1.844	10	20	BDCD	
COc1cccc(CN[C@@H]2CCCNC2)c1O	841043662	UWQLBEXCZCHNDR-LLVKDONJSA-N	236.315	1.242	10	20	BDCD	
CC(C)CNCC(=O)Nc1ccc(N)cc1	1118256544	VUNRVCCXNFINTF-UHFFFAOYSA-N	221.304	1.453	10	20	BDCD	
CCOCC(=O)COC(=O)c1cc(O)cs1	777053321	GUGVQBJHZVHEEZ-UHFFFAOYSA-N	244.268	1.216	10	20	BDCD	
O=C(O)C1CN(Cc2cc(Cl)ccc2O)C1	83415821	UBFIWOCBPCBPEI-UHFFFAOYSA-N	241.674	1.562	10	20	BDCD	
O=C(O)CN(Cc1cccc(F)c1O)C1CC1	1602059365	WONCPGWGSNMWQN-UHFFFAOYSA-N	239.246	1.580	10	20	BDCD	
C[C@H]1C[C@H](CN)CN1C(=O)Cc1ccc(N)cc1	834361292	HLSQBNXQQPUVST-CMPLNLGQSA-N	247.342	1.007	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CO[C@H](C)C2)c1	402023694	GDNVGJUMKWBRPY-MWLCHTKSSA-N	237.299	1.668	10	20	BDCD	
Cn1cc(NCc2cc3c(cc2O)OCO3)cn1	42879748	SLCLGJUIJIKRLA-UHFFFAOYSA-N	247.254	1.467	10	20	BDCD	
Nc1ccc(CC(=O)NCCC2CC2)cc1	83893237	BBZHHPORLYCHSF-UHFFFAOYSA-N	218.300	1.728	10	20	BDCD	
C[C@@H]1C[C@H](NCCO)c2c(O)ccc(F)c21	381259261	RNMDJPJGVGWXFE-APPZFPTMSA-N	225.263	1.662	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCCCCN1	228420886	JHLBFFKNJANTGW-LBPRGKRZSA-N	248.326	1.541	10	20	BDCD	
CCN(C)C(=O)COC(=O)c1cc(O)cs1	732353667	JQYWEVXMLFXMMD-UHFFFAOYSA-N	243.284	1.089	10	20	BDCD	
Cc1cccc(CN2CC[C@](C)(CN)C2)c1O	843115710	JJGKIILUCOCJOU-CQSZACIVSA-N	234.343	1.871	10	20	BDCD	
CCCN(Cc1ccccc1O)C[C@@H](C)N	843358437	QHVPDIINLWLDOE-LLVKDONJSA-N	222.332	1.951	10	20	BDCD	
CN(Cc1cc(Cl)ccc1O)[C@H]1CCNC1	70892273	AGUXRCLMENXSKH-NSHDSACASA-N	240.734	1.839	10	20	BDCD	
Cc1ccc(CNC[C@H](O)C2CC2)c(O)c1	877526132	PWPFLBAMHKOIHU-ZDUSSCGKSA-N	221.300	1.561	10	20	BDCD	
CO[C@@H](C)CC(=O)NCc1ccc(O)c(O)c1	778919497	FXPYBSHCBNFJHF-QMMMGPOBSA-N	239.271	1.139	10	20	BDCD	
C[C@H](CC(N)=O)N[C@H](C)c1c(O)cccc1F	886543168	LIVPPSBYLVVUBP-HTQZYQBOSA-N	240.278	1.446	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)C[C@H]1CN	1205317941	QXLSHAPMSMURMJ-DGCLKSJQSA-N	233.359	1.686	10	20	BDCD	
O=C1NCCCC[C@H]1NCc1ccccc1O	36976902	JYRBKNHMSUBPGE-LLVKDONJSA-N	234.299	1.151	10	20	BDCD	
CC(C)(O)CCNCc1cc(F)ccc1O	274923139	MRKZADDCWHYADK-UHFFFAOYSA-N	227.279	1.782	10	20	BDCD	
N[C@@H](CCO)c1cccc(Br)c1O	95638747	XAIMPYPCULCQJG-QMMMGPOBSA-N	246.104	1.537	10	20	BDCD	
[N-]=[N+]=NCCn1nc(-c2ccccn2)cc1N	409438607	MGBMTTGRFOIRDL-UHFFFAOYSA-N	229.247	1.838	10	20	BDCD	
Nc1ccc(CNC(=O)NC[C@@H]2CCCO2)cc1	1335362557	ZXSVVBFLAHLGMM-LBPRGKRZSA-N	249.314	1.247	10	20	BDCD	
CCOCSc1ncc(C(=O)O)s1	1605641147	TUEOIPKJVMKGJO-UHFFFAOYSA-N	219.287	1.927	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1CCCO1)CCO2	1503075	IEYPWNCLKNXLKY-ZDUSSCGKSA-N	233.311	1.890	10	20	BDCD	
CCN1CC[C@H](N(C)Cc2ccccc2O)C1=O	851841494	UBISZYARWFDVJO-LBPRGKRZSA-N	248.326	1.445	10	20	BDCD	
Cc1cccc(CN(C)C2CNC2)c1O	309630860	KLIMJGPFYLQOKP-UHFFFAOYSA-N	206.289	1.104	10	20	BDCD	
C[C@H]1C[C@@H](C(=O)N(C)Cc2ccccc2O)CO1	383727402	LKIAHTADMCSODS-CMPLNLGQSA-N	249.310	1.776	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@H](C)N1	153355491	YVNZGEKEOVWSKM-PHIMTYICSA-N	247.342	1.020	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@@H]2CCOC2)cc1	125155735	FHPYBABUNUFDJW-GFCCVEGCSA-N	248.326	1.405	10	20	BDCD	
CCOCCN(C)C(=O)c1cccc(O)c1O	126492888	VLKYLDQBYPJIDZ-UHFFFAOYSA-N	239.271	1.206	10	20	BDCD	
Cc1cccc(CN2CCC[C@@H](O)C2)c1O	132479765	HGUGINYYIJHURZ-GFCCVEGCSA-N	221.300	1.657	10	20	BDCD	
Cc1cc(O)c(CN2CCC[C@H]2CO)cc1C	92455743	FXJMCFLFQDTULY-ZDUSSCGKSA-N	235.327	1.966	10	20	BDCD	
CC[C@@H](NCc1cc(F)ccc1O)[C@@H](C)O	386728552	ARUAUBDJMVGVLL-LDYMZIIASA-N	227.279	1.780	10	20	BDCD	
C[C@@H](NC(=O)C1(C)COC1)c1ccccc1O	827940553	FQHUTODZFXPNJF-SECBINFHSA-N	235.283	1.606	10	20	BDCD	
Cc1cccc(CN(C)[C@@H](C)C(=O)O)c1O	821111929	BLUULXBKLCBFHF-VIFPVBQESA-N	223.272	1.606	10	20	BDCD	
CC(=O)CCC(=O)NCc1ccc(O)cc1O	910957185	LYESWYHADJMQIF-UHFFFAOYSA-N	237.255	1.083	10	20	BDCD	
CC(C)[C@@H](N)CNCc1ccc(N(C)C)cc1	841028881	JVHIRSOODRLMKL-AWEZNQCLSA-N	235.375	1.826	10	20	BDCD	
Cc1noc(C)c1-c1ccn(CC(=O)O)c(=O)c1	864608106	FFKMURZMCQANDO-UHFFFAOYSA-N	248.238	1.205	10	20	BDCD	
Cc1ccc(CN[C@H]2C[C@H](O)C2(C)C)c(O)c1	877430721	POQAZVNFQOALQQ-STQMWFEESA-N	235.327	1.950	10	20	BDCD	
CO[C@@]1(C(F)(F)F)CCN(CCN=[N+]=[N-])C1	409432609	LJBWPWHEIBSEJW-ZETCQYMHSA-N	238.213	1.950	10	20	BDCD	
CC[C@@H](NC)C(=O)N(C)Cc1ccccc1O	709305195	NASPVMHXRACYAU-LLVKDONJSA-N	236.315	1.349	10	20	BDCD	
O=C(Nc1cncc(F)c1)c1cccc(O)c1O	305986484	SQEUGTMRUKJDBE-UHFFFAOYSA-N	248.213	1.884	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@@H]1CC[C@H]1O	378739397	OJEMXRBYPCTCCO-MWLCHTKSSA-N	227.691	1.659	10	20	BDCD	
COCCN(C)c1ccc(OC)cc1OC	131826523	JUOSGEXXJLGPCQ-UHFFFAOYSA-N	225.288	1.786	10	20	BDCD	
C[C@@H](NC(=O)NCCc1ccc(N)cc1)C1CC1	841506326	SCLRCTPKPMUNDO-SNVBAGLBSA-N	247.342	1.909	10	20	BDCD	
CC[C@H](NCc1cc(C)ccc1O)[C@@H](C)O	386712234	PSBIXMMZGFSQIF-PWSUYJOCSA-N	223.316	1.950	10	20	BDCD	
Nc1ccc(NC(=O)[C@]23CCC[C@@H]2CNC3)cc1	294773256	MYFHCZINZOGIBC-YGRLFVJLSA-N	245.326	1.597	10	20	BDCD	
CCNCCN[C@@H](C)c1cc(F)ccc1O	817951979	MJQRQAZMDYCTIT-VIFPVBQESA-N	226.295	1.791	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCc2n[nH]cc21	819948295	CAFHWKKXTFRNQO-UHFFFAOYSA-N	249.295	1.770	10	20	BDCD	
CC(C)(N)CCC(=O)NCCc1ccc(N)cc1	843343149	ULEWGRZUCUDPON-UHFFFAOYSA-N	249.358	1.445	10	20	BDCD	
CC[C@@H](C)NC(=S)NCc1cccn1C	743062186	UQUAWTKHAJJEFB-SECBINFHSA-N	225.361	1.788	10	20	BDCD	
CCN(Cc1cc(F)cc(F)c1O)[C@H](C)CO	894831519	OIXAYVOUMDRMTH-MRVPVSSYSA-N	245.269	1.873	10	20	BDCD	
Oc1c(Cl)cccc1CNC[C@H]1COCO1	894875528	FRKOQJRGKPTFFA-VIFPVBQESA-N	243.690	1.508	10	20	BDCD	
Cc1cccc(CN[C@@H]2C(=O)NCC2(C)C)c1O	895317498	WLWUOPPKKIMOCB-GFCCVEGCSA-N	248.326	1.315	10	20	BDCD	
C[C@@H]1CN(c2ccc(N)cc2)C[C@H]1CO	409433735	ZBTSKTOTORIABK-ZJUUUORDSA-N	206.289	1.333	10	20	BDCD	
OCCn1ccn2nc(-c3cccnc3)cc12	409437039	BUJONPGOJJXTBK-UHFFFAOYSA-N	228.255	1.190	10	20	BDCD	
CCO[C@@H]1CN(CCN=[N+]=[N-])C[C@H]1OCC	409430451	IOUKTVSZWMZCFZ-NXEZZACHSA-N	228.296	1.423	10	20	BDCD	
CN(C)c1ccc(CN(C)[C@H]2CCNC2=O)cc1	771525664	KFMPQJKMZCQDFG-ZDUSSCGKSA-N	247.342	1.073	10	20	BDCD	
Oc1ccc(F)cc1CNCCCn1cccn1	226584097	XNIZSMDHIPKEOF-UHFFFAOYSA-N	249.289	1.908	10	20	BDCD	
C[C@@H](O)C[C@@H](C)NCc1ccc2c(c1)CCO2	228074526	OSKJWSZOUHNROG-GHMZBOCLSA-N	235.327	1.871	10	20	BDCD	
COc1ccc(CN[C@H](C(=O)O)C2CC2)cc1C	86758445	YSHCRMLZSNXJLQ-ZDUSSCGKSA-N	249.310	1.956	10	20	BDCD	
C[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1	272530479	WTIKVFIOPQZJBT-RXNUUUNCSA-N	247.294	1.979	10	20	BDCD	
CN(C)c1ccc(Cn2nccc2[N+](=O)[O-])cc1	292795807	ZWUGZDRKYHZGHF-UHFFFAOYSA-N	246.270	1.906	10	20	BDCD	
C[C@@H](NCC1CNC1)c1cc(Cl)ccc1O	817966052	ZVIGAVMDUOPHNA-MRVPVSSYSA-N	240.734	1.916	10	20	BDCD	
CC(C)(O)C(=O)NCc1cc(Cl)ccc1O	846474308	UIUCCEFGSJUFLW-UHFFFAOYSA-N	243.690	1.433	10	20	BDCD	
CC(C)(C)[C@@H](CN)NCc1cccc(F)c1O	841087665	POTLGYODQJDGJN-LLVKDONJSA-N	240.322	1.994	10	20	BDCD	
CC(C)(C)NCCNCCc1ccc(N)cc1	841037947	DLHCREWJAPVBJV-UHFFFAOYSA-N	235.375	1.789	10	20	BDCD	
C[C@@H](N)c1cn(Cc2ccc(N(C)C)cc2)nn1	881270877	CZBMCGCGYSTACA-SNVBAGLBSA-N	245.330	1.412	10	20	BDCD	
C[C@@H](NCC(C)(C)O)c1c(O)cccc1F	886525954	BOPYAEAEXFKLTD-MRVPVSSYSA-N	227.279	1.953	10	20	BDCD	
CO[C@@H](C)COC(=O)c1cc(O)cs1	782333822	AYIYBTJEAHRWNC-LURJTMIESA-N	216.258	1.645	10	20	BDCD	
CO[C@H](C)C(=O)N(C)Cc1ccccc1O	79621571	VDNUIRDSXQQNII-SECBINFHSA-N	223.272	1.386	10	20	BDCD	
CO[C@@H]1CCC[C@H]1C(=O)NCc1ccc(N)cc1	1263303744	HCEFYZBCNKIVQU-CHWSQXEVSA-N	248.326	1.700	10	20	BDCD	
C[C@H](NC(=O)c1cc(O)cs1)C(F)F	1548717465	IRGTYUJJCZVOCA-BYPYZUCNSA-N	221.228	1.837	10	20	BDCD	
C[C@H]1[C@@H](C)NCCN1Cc1ccccc1O	379445587	WWYVHIASCSBOMC-MNOVXSKESA-N	220.316	1.574	10	20	BDCD	
OC[C@H]1C[C@H](NCc2c(O)cccc2Cl)C1	923004120	QGHMBCUTNLUQPE-KYZUINATSA-N	241.718	1.906	10	20	BDCD	
CN(C[C@@H]1CCOC1)c1ccc(N)cc1	58478078	ULBXWULEMZBLLM-JTQLQIEISA-N	206.289	1.742	10	20	BDCD	
CC1(C)C(=O)NCCN1Cc1ccccc1O	179570308	SUKWNDSXTJGVAJ-UHFFFAOYSA-N	234.299	1.103	10	20	BDCD	
O=C(CC[C@@H]1CCCN1)NCc1ccccc1O	310876089	VHCHFBPNTYRYTE-LBPRGKRZSA-N	248.326	1.541	10	20	BDCD	
CCCN(Cc1ccccc1O)[C@H]1CCNC1	71314717	CNQSVLXFNOKJTI-ZDUSSCGKSA-N	234.343	1.966	10	20	BDCD	
CCN1CCc2cc([C@@H](N)CO)ccc21	72198027	HAVQZUGUHLDTBY-NSHDSACASA-N	206.289	1.061	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CCO1	194157296	CZKUHPQWGQPNTD-GFCCVEGCSA-N	234.343	1.973	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)COCC1CC1	298793927	MYMSFUQEDTZDHY-UHFFFAOYSA-N	249.310	1.777	10	20	BDCD	
CC[C@H](NCCNC)c1ccc(C)cc1O	817953290	YUFDFXMVLAVGMP-LBPRGKRZSA-N	222.332	1.961	10	20	BDCD	
COc1cccc(O)c1CN1CC2(CCOC2)C1	816672147	RCIFTLPWBDAUQP-UHFFFAOYSA-N	249.310	1.623	10	20	BDCD	
C[C@H]1NCC[C@H]1C(=O)Nc1ccc(N)cc1	832244147	LWHABRWHCIXCKS-LDYMZIIASA-N	219.288	1.205	10	20	BDCD	
C[C@H]1[C@@H](C)NCCN1Cc1cccc(F)c1O	843057229	GXSVQLWCTJRGIF-ZJUUUORDSA-N	238.306	1.714	10	20	BDCD	
Nc1ccc(CCNCc2cnc(N)s2)cc1	843125728	GIRQSNZQZBYOHG-UHFFFAOYSA-N	248.355	1.640	10	20	BDCD	
NC[C@H](NCc1cccc(Cl)c1O)C1CC1	841029677	YDXTWMFSLHUHNI-NSHDSACASA-N	240.734	1.873	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H](C)N(C)C	877149613	DPZRFPXBHVNTQL-NSHDSACASA-N	222.332	1.740	10	20	BDCD	
Cc1ccc(CN2C[C@H]3C[C@@]3(CO)C2)c(O)c1	877461716	JLJXSVJWXOLFLU-OCCSQVGLSA-N	233.311	1.515	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)CCN1	83813945	DDUVRVQHSFRSIB-JTQLQIEISA-N	206.289	1.186	10	20	BDCD	
C[C@@H]1OCC[C@@H]1C(=O)N(C)Cc1ccccc1O	92500825	PVVWFDUAWMGQHE-JQWIXIFHSA-N	249.310	1.776	10	20	BDCD	
CC(C)(C)[C@H](N)CC(=O)NCc1ccc(N)cc1	1343495071	LTEDAHCNOUMHFK-GFCCVEGCSA-N	249.358	1.649	10	20	BDCD	
CCn1cc(CN[C@H](C)c2ccccc2O)nn1	404505074	LBGIEHFYDLMDPH-SNVBAGLBSA-N	246.314	1.854	10	20	BDCD	
C[C@@H]1C[C@H](NCc2cc(F)cc(F)c2O)CO1	708483531	DVXZMKNGTZZYSS-XCBNKYQSSA-N	243.253	1.937	10	20	BDCD	
C[C@@H](CCO)CNCc1cc(F)cc(F)c1O	708481164	AAVOTUKMGRWWBK-QMMMGPOBSA-N	245.269	1.779	10	20	BDCD	
CCc1cccc(CNCc2cc[nH]n2)c1O	691483379	OPMVHXZNCVCHMA-UHFFFAOYSA-N	231.299	1.968	10	20	BDCD	
C[C@@H](NC(=O)NC1CC1)c1ccccc1O	864425209	WMIKSSGSLYJURC-MRVPVSSYSA-N	220.272	1.915	10	20	BDCD	
COC(=O)[C@]1(C)CCN(Cc2ccccc2O)C1	179582942	WCFBBGSXOXONKM-CQSZACIVSA-N	249.310	1.777	10	20	BDCD	
C[C@@H]1CN(c2ccc(N)cc2)CC[C@@H]1O	126768055	VLDZSYJUOOYEJH-SKDRFNHKSA-N	206.289	1.476	10	20	BDCD	
COc1cccc([C@H](C)NCCO)c1O	38417064	ZQOXRMFLOCGTSQ-QMMMGPOBSA-N	211.261	1.044	10	20	BDCD	
C[C@H](NCCN)c1ccc(N(C)C)cc1	37712896	BLLWKDDEPSYKPD-JTQLQIEISA-N	207.321	1.362	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CCC[C@@H](N)C2)cc1	294779904	NSHMIMSSHGMWOI-MWLCHTKSSA-N	233.315	1.725	10	20	BDCD	
Cc1cc(C)c([C@@H](C)NCC2CNC2)c(O)c1	817964926	JIYVYXMXAIFJOG-LLVKDONJSA-N	234.343	1.879	10	20	BDCD	
COC/C=C\C(=O)N[C@H](C)c1ccccc1O	827916803	JZJCSAOZSLATAM-DAGBOUIGSA-N	235.283	1.772	10	20	BDCD	
CN(C)c1ccc([C@H](N)CNC(=O)C2CC2)cc1	832286135	WPKWOFLQFMSWPN-CYBMUJFWSA-N	247.342	1.279	10	20	BDCD	
Cc1cc(O)c([C@H]2NC(=O)CN2C)cc1Cl	849184112	YGIFVRXPNUJVMJ-NSHDSACASA-N	240.690	1.414	10	20	BDCD	
Oc1c(F)cccc1CN[C@H]1CCCNCC1	841057117	IIWGIKRDQRQXJH-NSHDSACASA-N	238.306	1.763	10	20	BDCD	
CN1CCC[C@H](Sc2nccs2)C1=O	778557136	NQZDLYCEUKPVLX-ZETCQYMHSA-N	228.342	1.856	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@H](O)C1)c1c(O)cccc1F	886650641	ZZHAMMLOZKIRTP-OPRDCNLKSA-N	239.290	1.953	10	20	BDCD	
COc1cc(C)cc(CNC/C=C/CO)c1O	895249063	ZLPZWTRGRCIKPE-ONEGZZNKSA-N	237.299	1.347	10	20	BDCD	
CNCCCNCc1ccc(N2CCCC2)cc1	1325268093	PRWFSGLAHHWGNT-UHFFFAOYSA-N	247.386	1.986	10	20	BDCD	
[N-]=[N+]=NC1CN(CC(=O)NC2CCCC2)C1	409422657	HGHYCLDQAINUFS-UHFFFAOYSA-N	223.280	1.040	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](CO)C1)c1ccc(F)cc1O	707597451	YBRKJSHWYGBWAS-KKZNHRDASA-N	239.290	1.953	10	20	BDCD	
CCCn1nnnc1N(C)Cc1ccccc1O	1332486472	BGUYOIUQOIIXLK-UHFFFAOYSA-N	247.302	1.425	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1C[C@@H](O)C1	825257059	SMJONYQAXQIIJP-DTORHVGOSA-N	223.272	1.014	10	20	BDCD	
Cc1ccc(CN[C@H](CF)C(=O)O)c(O)c1	1607783114	QEGOFOLZOVNGRQ-SECBINFHSA-N	227.235	1.213	10	20	BDCD	
C[C@@H](CC(=O)O)NCc1ccc2c(c1)CCCO2	1120249070	DWUUSPFSYOIRCK-JTQLQIEISA-N	249.310	1.964	10	20	BDCD	
CNC(=O)[C@@H]1CCCN(Cc2ccccc2O)C1	179574328	RNKOTJNGXFBYQS-GFCCVEGCSA-N	248.326	1.350	10	20	BDCD	
NC1CCN(Cc2c(O)cccc2Cl)CC1	128314004	LWBZJXQERJHQKH-UHFFFAOYSA-N	240.734	1.969	10	20	BDCD	
CC[C@@H](COC)NC(=O)Nc1ccc(N)cc1	79769055	ZIVJSFUFELBBEN-JTQLQIEISA-N	237.303	1.815	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C2(C)CC2)c1	133457943	UBDFLYUSAKANJJ-UHFFFAOYSA-N	235.283	1.817	10	20	BDCD	
C[C@H]1C[C@H]1CNC(=O)Cc1ccc(N)cc1	136316505	APRVFHMROWSQMG-ONGXEEELSA-N	218.300	1.584	10	20	BDCD	
OC/C=C/CN[C@@H]1CCc2cccc(O)c21	717531863	IJADYHRJSWGVKJ-FMBMQGQPSA-N	219.284	1.518	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C1(CO)CCC1	827904042	UKKLRDWJAJBVBY-UHFFFAOYSA-N	239.290	1.878	10	20	BDCD	
CC(C)[C@H](NC(=O)c1cc(O)cs1)C(=O)O	736384865	KCHNRXCVTABBCP-QMMMGPOBSA-N	243.284	1.293	10	20	BDCD	
CCc1cccc(CN(CC)CCO)c1O	848875586	ALOBSMKDQDLFNQ-UHFFFAOYSA-N	223.316	1.769	10	20	BDCD	
Cc1ccc(CN[C@H](CO)C(C)C)c(O)c1	877074514	MWFNNOSJTLBTAJ-GFCCVEGCSA-N	223.316	1.807	10	20	BDCD	
C[C@@H]1C[C@@H](C(=O)NCc2ccc(N)cc2)CCO1	1341922895	GPVQFZUWEUVJJI-PWSUYJOCSA-N	248.326	1.700	10	20	BDCD	
CCN(Cc1cc(C)ccc1O)[C@@H]1CCNC1=O	281894265	YOBBMOJXIACCRI-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H]3COC[C@H]3C2)c1	718148378	TWYQHLXQKANNIU-TXEJJXNPSA-N	249.310	1.479	10	20	BDCD	
C/C=C(\C)C(=O)NCc1cccc(O)c1O	1521852321	UWDGPRGFKCZJSP-FPYGCLRLSA-N	221.256	1.680	10	20	BDCD	
Cc1cccc(CN[C@H]2CO[C@H](C)C2)c1O	402145571	NKGUQNRZVJWDFQ-ZYHUDNBSSA-N	221.300	1.968	10	20	BDCD	
COc1cccc(O)c1CN[C@@H]1CCSC1	309886468	YQYBRBBVXMLRKL-SECBINFHSA-N	239.340	1.996	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2ccco2)c1	114542273	ZXKPOWPKTBFJHU-UHFFFAOYSA-N	247.250	1.924	10	20	BDCD	
CC[C@@H](NCCN(C)C)c1ccccc1O	21962846	IRKQVCLJRCIFPI-GFCCVEGCSA-N	222.332	1.995	10	20	BDCD	
COC(=O)[C@H](C)NCc1ccc2c(c1)CCO2	37363395	JTTVVYYHCMLMCP-VIFPVBQESA-N	235.283	1.273	10	20	BDCD	
CO[C@H](C)CCC(=O)NCc1ccc(N)cc1	228490599	IAQWKRQGEKVSJY-SNVBAGLBSA-N	236.315	1.700	10	20	BDCD	
CCCCN(CC(N)=O)Cc1ccccc1O	132865661	JUTJQXNFLVMYKK-UHFFFAOYSA-N	236.315	1.480	10	20	BDCD	
CO[C@H](CNCc1ccccc1O)C1CC1	292884429	CHPLSSKSPCZIBL-CYBMUJFWSA-N	221.300	1.907	10	20	BDCD	
O=C(O)/C=C/c1ccc(N2CCC2)c([N+](=O)[O-])c1	384977655	MLPVJAGODSEREL-HWKANZROSA-N	248.238	1.903	10	20	BDCD	
C[C@@H](CN)CN[C@H](C)c1cc(F)cc(F)c1O	817961663	BXTVQJUKHQXSBW-JGVFFNPUSA-N	244.285	1.916	10	20	BDCD	
CC[C@](C)(O)C(=O)NCc1cc(C)ccc1O	827167108	OBKJHMGFYXRVEB-ZDUSSCGKSA-N	237.299	1.478	10	20	BDCD	
CO[C@@H](CNC(=O)c1cc(O)cs1)C(C)C	829415131	KLQQJEIGBXFSEY-VIFPVBQESA-N	243.328	1.855	10	20	BDCD	
COC1CCN(C(=O)c2cc(O)cs2)CC1	731865630	NNRRIZXTSQPRBZ-UHFFFAOYSA-N	241.312	1.705	10	20	BDCD	
CN(C)c1ccc(CNC(=O)CCCCN)cc1	70203198	KXRLUWPCJVNPQR-UHFFFAOYSA-N	249.358	1.498	10	20	BDCD	
COC/C(C)=C\C(=O)NCc1cc(C)ccc1O	862755133	OKAUJBXMOVSOEN-XFFZJAGNSA-N	249.310	1.910	10	20	BDCD	
Cc1cccc(O)c1CN1CCC2(C1)OCCO2	876684510	PHNBGHLGMVFNSZ-UHFFFAOYSA-N	249.310	1.649	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](O)[C@H](C)C2)c(O)c1	877434746	TZKCBRDXGPDEQK-DGCLKSJQSA-N	235.327	1.903	10	20	BDCD	
CC[C@H]1NCC[C@@H]1C(=O)NCc1ccc(N)cc1	1122535813	IIEQYOQRWWPYLP-QWHCGFSZSA-N	247.342	1.273	10	20	BDCD	
CCOC(=O)N1CC(Oc2ccc(N)cc2)C1	409423470	BVVMCGQLMMULPS-UHFFFAOYSA-N	236.271	1.488	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@H](O)[C@@H](CC2CC2)C1	409435130	SMRNRWQBUDHJHO-UWVGGRQHSA-N	238.291	1.306	10	20	BDCD	
Nc1ccc(CCNC(=O)C2CC2)cc1	32010287	OVLCJQYZWWTUAS-UHFFFAOYSA-N	204.273	1.338	10	20	BDCD	
OC[C@H](CC(F)(F)F)NCc1ccccc1O	717788450	BMUBNVWPYOOSOS-VIFPVBQESA-N	249.232	1.795	10	20	BDCD	
OCCN(Cc1ccccc1O)CC1CC1	128551093	MZXZANILEJNQDJ-UHFFFAOYSA-N	221.300	1.597	10	20	BDCD	
C[C@H](NCc1c(O)cccc1Cl)C(=O)O	127313013	IBILXFRRKAXJCW-LURJTMIESA-N	229.663	1.608	10	20	BDCD	
COc1ccc(N(C)CCOCCO)cc1F	121782197	GZRLOSUHDQNKEK-UHFFFAOYSA-N	243.278	1.279	10	20	BDCD	
COC[C@@H](C)N(C)Cc1cc(OC)ccc1O	132677714	JYUNMHOYPDMNQM-SNVBAGLBSA-N	239.315	1.868	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H](CO)C2)cc1	92762962	MKXNAWXBSGRZGY-ZDUSSCGKSA-N	234.343	1.567	10	20	BDCD	
NOCCCN[C@H]1CCc2cccc(O)c21	902415066	KIGWFXJSZVTJTO-JTQLQIEISA-N	222.288	1.250	10	20	BDCD	
CN(C)c1ccc(CNCC2(N)CC2)cc1F	904448899	DQDFKBQMYQKUGV-UHFFFAOYSA-N	237.322	1.473	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCNC2)c1	841045293	RWMBHNISLYVOCP-LLVKDONJSA-N	206.289	1.152	10	20	BDCD	
C[C@@H](N)C[C@@H](C)NCc1ccccc1O	843129252	OOXYJMCUIMRRDC-NXEZZACHSA-N	208.305	1.608	10	20	BDCD	
C[C@@H](NC(=O)C[C@H]1CCOC1)c1ccccc1O	827937119	LIGQNYJJKFIONR-GHMZBOCLSA-N	249.310	1.996	10	20	BDCD	
COC[C@@H](O)CN[C@@H](C)c1ccccc1O	70589892	GCLLXKUDJSCVBT-UWVGGRQHSA-N	225.288	1.050	10	20	BDCD	
CCCN(CC(N)=O)Cc1ccc(C)cc1O	877547654	FGQNDCBOMBXMOS-UHFFFAOYSA-N	236.315	1.398	10	20	BDCD	
COc1ccc(CNCCCF)c(O)c1OC	893124291	WBLOKQJSFZWKNC-UHFFFAOYSA-N	243.278	1.859	10	20	BDCD	
CNC[C@@H](C)CNCc1cc(C)ccc1O	1328676215	ACUPVBGOBKEZEZ-LLVKDONJSA-N	222.332	1.646	10	20	BDCD	
CCN1CCc2cc(CNCC(=O)O)ccc21	1776877581	VYVFUTHYPWMORG-UHFFFAOYSA-N	234.299	1.243	10	20	BDCD	
C[C@H]1CCN(C(=O)c2cccc(O)c2O)C1	163272699	OIYDUBINBJAPOG-QMMMGPOBSA-N	221.256	1.580	10	20	BDCD	
CC[C@@H](C)[C@H](N)C(=O)NCc1ccccc1O	166201749	BOTTZFHPZVBDQA-SKDRFNHKSA-N	236.315	1.382	10	20	BDCD	
C[C@H](O)CCNCc1cc(F)ccc1O	226609664	GFGREOGAZQLDMR-QMMMGPOBSA-N	213.252	1.392	10	20	BDCD	
CN(C)CCCNCc1cc(F)cc(F)c1O	708480111	DNLKJIDMVMYLRX-UHFFFAOYSA-N	244.285	1.712	10	20	BDCD	
CN(CCC(N)=O)Cc1cccc(Cl)c1O	289913619	XFINIYXYNQLLLW-UHFFFAOYSA-N	242.706	1.353	10	20	BDCD	
CNCCCN[C@H](C)c1ccccc1O	238337832	HKHYDJIPMOPOGX-SNVBAGLBSA-N	208.305	1.652	10	20	BDCD	
CC[C@H](C)N(OC)C(=O)c1cccc(O)c1O	279828568	MYCMFVWNMYZUNW-QMMMGPOBSA-N	239.271	1.900	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@H]2CO)cc1C	902629464	DRGJIBYZUYPCJL-LBPRGKRZSA-N	221.300	1.576	10	20	BDCD	
CC1(OCC(=O)NCc2ccc(N)cc2)CCC1	837302829	ISFLUUHRZGFNHR-UHFFFAOYSA-N	248.326	1.844	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@@H]1CCCNC1	841043843	XIJVCPFKTOKFHU-SNVBAGLBSA-N	240.734	1.887	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@H](CN)C2)cc1C	843048552	GZTFFYQYJPKGMJ-GFCCVEGCSA-N	234.343	1.790	10	20	BDCD	
CCCN1CC(=O)N[C@@H]1c1cccc(F)c1O	840825693	ZJDJTPIOJGYCQX-LBPRGKRZSA-N	238.262	1.372	10	20	BDCD	
CCOc1ccc(CNc2nnco2)c(O)c1	795797243	UXJLGOFQLZZTAK-UHFFFAOYSA-N	235.243	1.786	10	20	BDCD	
CCCNC(=O)CN[C@H](C)c1ccccc1O	36780986	NGGBGOYUONPNOH-SNVBAGLBSA-N	236.315	1.569	10	20	BDCD	
CC[C@H](CCO)NCc1ccccc1O	77453140	BKRSPJAPGICHIO-LLVKDONJSA-N	209.289	1.643	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)CN(C)C)c1	168537300	AXLSXXQBODIGJM-JTQLQIEISA-N	238.331	1.441	10	20	BDCD	
CCN(CCO)Cc1cc(Cl)ccc1O	127958941	ZMOOCVMQRUEHNO-UHFFFAOYSA-N	229.707	1.860	10	20	BDCD	
CCNC(=O)CNCc1cccc(CC)c1O	691506947	QTARKHYMNPRTHW-UHFFFAOYSA-N	236.315	1.180	10	20	BDCD	
C[C@]1(CNC(=O)Cc2ccc(N)cc2)CCOC1	397178046	HLYLKCQDMRQSLG-CQSZACIVSA-N	248.326	1.354	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@H]2CCNC2)c1	70955797	AGFUNFGXPZCGEQ-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
C[C@H](CN)N(C)Cc1ccc(N(C)C)cc1	382973148	HBDCMDUNTCSMBS-LLVKDONJSA-N	221.348	1.532	10	20	BDCD	
C[C@H](N)CCN[C@H](C)c1cc(F)ccc1O	817952776	MKKIPYFWHAJXRO-DTWKUNHWSA-N	226.295	1.919	10	20	BDCD	
CC[C@@](C)(CCO)NC(=O)c1cc(O)cs1	831784134	HSCYJMICEWIFRW-NSHDSACASA-N	243.328	1.735	10	20	BDCD	
CCNC(=O)NCc1cc(Cl)ccc1O	844282365	UNLVWTXIFVDHQG-UHFFFAOYSA-N	228.679	1.865	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CC2(F)F)c1	862755499	UKEFIWNMUZJLLU-VIFPVBQESA-N	241.237	1.972	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H]1COCCO1	876951207	HBDGDLLRAMSWAD-LLVKDONJSA-N	237.299	1.206	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H](O)[C@H](C)C1	897684682	VDMZRTZDZTXBSP-BXKDBHETSA-N	237.299	1.213	10	20	BDCD	
N[C@H](CC(=O)O)c1ccc(Cl)cc1O	75069546	ROPXXEPTKZPVRV-SSDOTTSWSA-N	215.636	1.520	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)CCC(F)(F)F)C1	409424693	XMDCHCZNRNNIFO-UHFFFAOYSA-N	222.170	1.850	10	20	BDCD	
CSCCC(=O)NCc1cccc(O)c1O	1548790723	FDUJMJGPJNTHGI-UHFFFAOYSA-N	241.312	1.467	10	20	BDCD	
Cc1ccc(O)c(CNc2nnc(C)n2C)c1	158692536	NKHBXDKDIHFOKU-UHFFFAOYSA-N	232.287	1.750	10	20	BDCD	
Cc1ccc(O)c(CN(C)C[C@H](C)N)c1	309054495	SCFWGULZULCIJU-JTQLQIEISA-N	208.305	1.480	10	20	BDCD	
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(N)cc2)O1	397943346	IMWHEBRMZNPMBS-CABZTGNLSA-N	249.314	1.958	10	20	BDCD	
Cc1cccc(CN[C@@H]2CC[C@H]2O)c1O	822503669	KNBAVLBDDUWWRR-GHMZBOCLSA-N	207.273	1.314	10	20	BDCD	
COCC(C)(C)NC(=O)Cc1ccc(N)cc1	156909372	ZQZDWWQEVQXVQO-UHFFFAOYSA-N	236.315	1.353	10	20	BDCD	
CC(C)[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O	43431330	LFSQKJCPABNEQC-CYBMUJFWSA-N	249.310	1.820	10	20	BDCD	
CN1CCC[C@H]1CNC(=O)Cc1ccc(N)cc1	82284152	QQGPYNYEPOLHHY-ZDUSSCGKSA-N	247.342	1.022	10	20	BDCD	
C[C@@H](N)[C@@H]1CCN(Cc2cc(F)ccc2O)C1	220341043	VTFCCNWUMBNNPC-NXEZZACHSA-N	238.306	1.700	10	20	BDCD	
C[C@@H](CN(C)C)NCc1cc(F)ccc1O	235110856	OMRCXKHIBIEEFU-VIFPVBQESA-N	226.295	1.571	10	20	BDCD	
COC(=O)c1cnc(SC[C@H](C)O)s1	295433649	ZIDBTWDYLOQILZ-YFKPBYRVSA-N	233.314	1.403	10	20	BDCD	
CNCCCN[C@H](C)c1cc(F)cc(F)c1O	817940459	MTAXKBGKAVSHKL-MRVPVSSYSA-N	244.285	1.931	10	20	BDCD	
NC1(CNCc2cccc(F)c2O)CC1	904450637	SFCNYVFQRUXWIL-UHFFFAOYSA-N	210.252	1.112	10	20	BDCD	
Cc1cccc(CN2CCNC[C@H]2C)c1O	843047821	XEVWUVNRSUHHCQ-LLVKDONJSA-N	220.316	1.494	10	20	BDCD	
CC[C@@H](C(=O)O)N(C)Cc1cccc(F)c1O	844938520	VJERCQJMMANBPS-JTQLQIEISA-N	241.262	1.826	10	20	BDCD	
N=C(N)NCc1cccc(Br)c1O	849105561	UWKHUEWSLWHHNA-UHFFFAOYSA-N	244.092	1.138	10	20	BDCD	
COc1cccc([C@@H](C)N[C@H](C)CCO)c1O	846148454	ZQIAZJMAXXYUFA-NXEZZACHSA-N	239.315	1.822	10	20	BDCD	
N[C@H](CNCc1cccc(Cl)c1O)C1CC1	841048045	BKAFASKGXAMUJI-LLVKDONJSA-N	240.734	1.873	10	20	BDCD	
C[C@@H](N)CN1CCCc2cc(CN)ccc21	843350375	NXWJBWZIMZXQBD-SNVBAGLBSA-N	219.332	1.245	10	20	BDCD	
Cc1cccc(CN(C)CCOCCN)c1O	863649582	ASKWZEFUOXVTKB-UHFFFAOYSA-N	238.331	1.108	10	20	BDCD	
Cc1ccc(CNCCN2CCCC2)c(O)c1	877141569	ABXAGEVGFNJNGR-UHFFFAOYSA-N	234.343	1.886	10	20	BDCD	
CC(C)NC(=O)NCc1ccc(N)cc1	37666351	LCZNZDUBVWQLLL-UHFFFAOYSA-N	207.277	1.476	10	20	BDCD	
CN1CC(=O)N[C@H]1c1ccc(N2CCCC2)cc1	1248746717	JJNDELSROZGWDC-CQSZACIVSA-N	245.326	1.347	10	20	BDCD	
COC1CC(C(=O)NCc2ccc(N)cc2)C1	703504891	XBBAGIIDYDMWJJ-UHFFFAOYSA-N	234.299	1.310	10	20	BDCD	
C[C@@H]1CN(Cc2cc(F)cc(F)c2O)CCO1	708414364	RJXAYBCQUCUALX-MRVPVSSYSA-N	243.253	1.891	10	20	BDCD	
Cc1nc([C@@H](C)NCc2ccccc2O)no1	1261186872	RSDCHECWXRWTOU-MRVPVSSYSA-N	233.271	1.934	10	20	BDCD	
COc1ccc(CNC(=O)[C@@H]2C[C@@H]2F)c(O)c1	1521550146	QXTCLVXABVDDNM-ZJUUUORDSA-N	239.246	1.375	10	20	BDCD	
CC(=O)C(=O)CSc1nc(C(=O)O)cs1	1589021143	LWGNWXMSOJCKJZ-UHFFFAOYSA-N	245.281	1.092	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@@H]1C[C@@H]1C(=O)O	1593303166	DGQRJLQGOSIMFY-LSJOCFKGSA-N	235.283	1.591	10	20	BDCD	
Cc1cc(O)c(CN2CCNCC2)cc1C	83017933	VXHUSTQCVTYRHB-UHFFFAOYSA-N	220.316	1.414	10	20	BDCD	
O=C(NCc1ccccc1O)C1CCNCC1	82280620	CBUSYKFDNHNFQO-UHFFFAOYSA-N	234.299	1.008	10	20	BDCD	
CN(C)CCN[C@@H]1CCc2cccc(O)c21	297197749	FVCXVOTYSVJPMR-LLVKDONJSA-N	220.316	1.531	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](O)C1)c1cc(F)ccc1O	295907312	IYUCEQYNSRSHPF-QNSHHTMESA-N	225.263	1.705	10	20	BDCD	
Nc1ccc(OCc2cn(C3CC3)nn2)cc1	864629354	KDDITHFNHNIPHV-UHFFFAOYSA-N	230.271	1.774	10	20	BDCD	
C[C@H](NC[C@@H]1C[C@H](F)CN1)c1ccccc1O	817976847	VLXBKAZERBGAKS-DCAQKATOSA-N	238.306	1.743	10	20	BDCD	
C[C@@H](NCCCON)c1ccc(N(C)C)cc1	902421098	NOLCRXQNWGMZBN-LLVKDONJSA-N	237.347	1.684	10	20	BDCD	
C[C@H]1C[C@@H](N)CCN1Cc1cccc(F)c1O	846701862	DUANCMORAXKYFR-ONGXEEELSA-N	238.306	1.843	10	20	BDCD	
Cc1ccc(CNCC(C)(C)CO)c(O)c1	877117687	PFCBIIFSKXMXPP-UHFFFAOYSA-N	223.316	1.809	10	20	BDCD	
Cc1cccc(O)c1CNCCc1ccnn1C	877362920	LFXQHHYHVPYXLG-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
Cc1ccc(CNCCc2ccn(C)n2)c(O)c1	877353236	PNBJKYFYGGDQPS-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
COc1cccc(O)c1CNc1cnn(C)c1	731449921	FVWVINPGDBWYRO-UHFFFAOYSA-N	233.271	1.746	10	20	BDCD	
CC[C@@H](NCc1ccccc1O)[C@@H](C)O	395372180	VAVRPNFYCPEUKL-MWLCHTKSSA-N	209.289	1.641	10	20	BDCD	
Nc1ccc(CNC[C@@H](O)C(F)(F)F)cc1	716303932	YAGOXMRULWWFMS-SECBINFHSA-N	234.221	1.282	10	20	BDCD	
C[C@H](NC[C@H]1C[C@@H](O)C1)c1cc(F)ccc1O	720908040	TVRWWJFQSJCONN-ATZCPNFKSA-N	239.290	1.953	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)CC(N)=O)c1	160802833	OHVJGYJRIDASNN-VIFPVBQESA-N	222.288	1.054	10	20	BDCD	
C[C@@H](N[C@@H](CN)C1CC1)c1ccccc1O	817959440	FYNNPADIMNHZSS-SKDRFNHKSA-N	220.316	1.780	10	20	BDCD	
OC[C@@H]1CC[C@H](NCc2cc(F)ccc2O)C1	294968596	FNVXGJWCPISELL-SKDRFNHKSA-N	239.290	1.782	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H](O)C1CCC1	315809645	XKCWAUGVBWXAIB-CYBMUJFWSA-N	239.290	1.782	10	20	BDCD	
Nc1ccc(CCNC(=O)NC2CC2)cc1	54456833	QUJQIGCLMLEOJO-UHFFFAOYSA-N	219.288	1.273	10	20	BDCD	
C[C@H](NCCCOCCO)c1ccccc1O	183721903	MRRCKOZMCXTWMD-NSHDSACASA-N	239.315	1.442	10	20	BDCD	
COc1ccc(CN[C@@H]2CC[C@H]2O)cc1C	378684476	BPFRJTRAWSBAFF-VXGBXAGGSA-N	221.300	1.617	10	20	BDCD	
COCCOCCN[C@H](C)c1ccccc1O	44693513	SMVIPYYKWBPBOO-LLVKDONJSA-N	239.315	1.706	10	20	BDCD	
Cc1ccc([C@@H](C)NC[C@H](C)CO)c(O)c1	83219204	DMCHHMIEBFEDPQ-WDEREUQCSA-N	223.316	1.980	10	20	BDCD	
C[C@](O)(CNCc1ccccc1O)c1ccco1	266141049	HECCGBIFXHXCAW-AWEZNQCLSA-N	247.294	1.983	10	20	BDCD	
C[C@@H](CN)N(C)Cc1ccc(N(C)C)c(F)c1	843052582	VWEJZHGSNXXFLH-JTQLQIEISA-N	239.338	1.671	10	20	BDCD	
COc1cccc(O)c1CNC[C@@H](N)C(C)C	841028902	KQWJTUHUWBQFQU-LLVKDONJSA-N	238.331	1.474	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H](CN)C2)cc1C	843048553	GZTFFYQYJPKGMJ-LBPRGKRZSA-N	234.343	1.790	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H](O)[C@H](C)C1	877433986	LCLVUBDQFLSKHU-YPMHNXCESA-N	235.327	1.903	10	20	BDCD	
CC[C@@H](OC(=O)c1cc(O)cs1)C(C)=O	873359069	GWMXZAJYFNROCN-MRVPVSSYSA-N	228.269	1.978	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H](N)CC2CC2)cc1	884028908	VZHIMHPVLSEQRF-CYBMUJFWSA-N	247.342	1.055	10	20	BDCD	
COc1cccc(CNCC2(C)COC2)c1O	83523064	SITXACGSATZLBO-UHFFFAOYSA-N	237.299	1.527	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2CCCCN2)cc1	169815802	PSLDNPMCGZJEGE-GFCCVEGCSA-N	233.315	1.027	10	20	BDCD	
CO[C@H](C)CC(=O)NCc1ccccc1O	749941095	FBEPPTCDKFMAOK-SECBINFHSA-N	223.272	1.433	10	20	BDCD	
CN1CCC[C@@H](N(C)Cc2ccccc2O)C1=O	778949491	JEKHFSJBIOWKSU-GFCCVEGCSA-N	248.326	1.445	10	20	BDCD	
Cc1cccc(CNCCC[S@@](C)=O)c1O	162663358	PMNJWRTZAFMWDM-INIZCTEOSA-N	241.356	1.559	10	20	BDCD	
Cc1c[nH]nc1CNCc1ccccc1O	309419771	AIQWGUNJKFXZIB-UHFFFAOYSA-N	217.272	1.714	10	20	BDCD	
O=C(NCC12CC(CO1)C2)c1cccc(O)c1O	529872620	NUPORMYHSKAAQB-UHFFFAOYSA-N	249.266	1.007	10	20	BDCD	
Nc1ccc(CNC(=O)C2CCC2)cc1	37666207	NRDDKBLMQFQTEV-UHFFFAOYSA-N	204.273	1.685	10	20	BDCD	
CC[C@@H](NCc1ncn(C)n1)c1ccccc1O	157006652	PMUZBLOWXBRWHQ-LLVKDONJSA-N	246.314	1.762	10	20	BDCD	
O=C(O)CCCNCc1cc(F)ccc1O	236425338	YIVIPRSEAJAFTR-UHFFFAOYSA-N	227.235	1.486	10	20	BDCD	
Cc1ccc(C(=O)NC2CCC2)c(O)c1O	272708392	CCFMXYUINDOAPU-UHFFFAOYSA-N	221.256	1.689	10	20	BDCD	
Nc1ccc(NC(=O)C[C@@H]2CCC[C@H]2N)cc1	294871511	WTCIISJQPWCNQW-JOYOIKCWSA-N	233.315	1.725	10	20	BDCD	
C[C@H]1C[C@@H](C(=O)N[C@H](C)c2ccccc2O)CO1	827946512	KONAMBMXTCCMEZ-HBNTYKKESA-N	249.310	1.994	10	20	BDCD	
Nc1ccc(CCNC(=O)CCNC2CC2)cc1	848394631	NGNVQUWOLWTVGG-UHFFFAOYSA-N	247.342	1.070	10	20	BDCD	
Cc1ccc(CN[C@@H]2CO[C@@H](C)C2)c(O)c1	877608210	RMPDYCVKXDRFNL-JQWIXIFHSA-N	221.300	1.968	10	20	BDCD	
O=C(O)[C@H]1C[C@@H](NCc2ccccc2O)C1	874047370	WUDIGSNZALAUKE-AOOOYVTPSA-N	221.256	1.345	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCCNCC2)cc1	1120269703	ZJIZDJFDUXNREN-CYBMUJFWSA-N	219.332	1.501	10	20	BDCD	
N=C(NCc1ccccc1O)NCC1CC1	887348563	OANUNGXWGGZFGZ-UHFFFAOYSA-N	219.288	1.416	10	20	BDCD	
CC[C@H](NCc1ccccc1O)[C@@H](C)O	395372179	VAVRPNFYCPEUKL-KOLCDFICSA-N	209.289	1.641	10	20	BDCD	
C[C@H](CC(N)=O)NCc1cc(F)cc(F)c1O	708453186	FKOTWSVREGPVQM-ZCFIWIBFSA-N	244.241	1.024	10	20	BDCD	
COC(=O)[C@H]1CCN(Cc2ccc(N)cc2)[C@H]1C	1335290427	WJWKAZAPSZOMAY-GWCFXTLKSA-N	248.326	1.652	10	20	BDCD	
COCCN[C@@H](C)c1ccc(F)cc1O	62744696	STNRTYCKGNRJTQ-QMMMGPOBSA-N	213.252	1.828	10	20	BDCD	
COc1cccc(CN(C)[C@H]2CCNC2)c1O	71309235	KYDFPZDDAAUKNY-NSHDSACASA-N	236.315	1.195	10	20	BDCD	
C[C@@H](Sc1nccs1)C(=O)NC1CC1	48874444	UAQQDMCGWRKFOK-ZCFIWIBFSA-N	228.342	1.902	10	20	BDCD	
Cc1cccc(CN(C)CC[C@H](C)O)c1O	132508540	ANZBVOHVNQILHB-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
CC(=O)C(=O)COC(=O)Cc1ccccc1C	808490183	NQRUCMDCNYIBRE-UHFFFAOYSA-N	234.251	1.239	10	20	BDCD	
Cc1cc(CN[C@H](CO)C2CC2)ccc1N(C)C	815090161	JIAUDQMCTFIRQL-CQSZACIVSA-N	248.370	1.922	10	20	BDCD	
Oc1ccc(F)cc1CN(C1CC1)C1COC1	824471429	BJCNKTQNNBTLKL-UHFFFAOYSA-N	237.274	1.895	10	20	BDCD	
CN(C[C@@H]1CCC(=O)O1)c1ccc2c(c1)OCO2	821396037	FQFMDOMISKTXIW-JTQLQIEISA-N	249.266	1.557	10	20	BDCD	
OC[C@H]1CCN1Cc1cc2c(cc1O)CCCC2	902630400	AUARUIYIWYVZFK-CQSZACIVSA-N	247.338	1.838	10	20	BDCD	
Cc1ncc(C(=O)NCc2ccccc2O)[nH]1	731872351	GLIJPJDBFXOWGC-UHFFFAOYSA-N	231.255	1.354	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C1CCNCC1	843045106	IIHVSBJFDRUEMZ-UHFFFAOYSA-N	238.306	1.715	10	20	BDCD	
COC[C@](C)(O)CNCc1ccc(C)cc1O	877028018	UXQXPCZKDGKHNR-CYBMUJFWSA-N	239.315	1.188	10	20	BDCD	
CC[C@@H]1CC[C@H](C(=O)NCc2ccc(N)cc2)O1	1343566066	DJOBKXRHCOYTQO-CHWSQXEVSA-N	248.326	1.843	10	20	BDCD	
CCOc1cccc(CNC2CSC2)c1O	701972947	LJZSJZOLNPKWAA-UHFFFAOYSA-N	239.340	1.996	10	20	BDCD	
Nc1ccc(N2CC[C@@H]3COC[C@@H]3C2)cc1	409432403	VGPWAEKNWKIKCS-MNOVXSKESA-N	218.300	1.742	10	20	BDCD	
Oc1c(F)cc(F)cc1CN1CCCOCC1	708413766	NTNORTGCCRABGP-UHFFFAOYSA-N	243.253	1.893	10	20	BDCD	
Nc1ccc(CNC(=O)C2(N)CCCCC2)cc1	1346222049	VPDFAQRRXGUXQH-UHFFFAOYSA-N	247.342	1.547	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C(F)F	234287163	OWHZWLQPQYHERQ-UHFFFAOYSA-N	215.199	1.616	10	20	BDCD	
C[C@H](CN)C(=O)N(C)Cc1ccc(N(C)C)cc1	54340668	POGIIAFBTQUWHZ-LLVKDONJSA-N	249.358	1.306	10	20	BDCD	
CN[C@H]1CCCN(Cc2ccccc2O)C1	53201578	QRDBOWAMQSERFB-LBPRGKRZSA-N	220.316	1.576	10	20	BDCD	
C#CCN(C)c1ccc(OC)c(OC)c1	63616892	DLUHIGZYGCATSC-UHFFFAOYSA-N	205.257	1.773	10	20	BDCD	
C[C@@H](C1CC1)N(C)C(=O)c1cccc(O)c1O	126262723	WDBIDGKUEXMHPX-QMMMGPOBSA-N	235.283	1.968	10	20	BDCD	
COC(=O)CN(Cc1ccccc1O)C1CC1	271468420	YKIGZNZVEIBIRI-UHFFFAOYSA-N	235.283	1.530	10	20	BDCD	
CC[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(C)cc1O	817977230	FDZSPMGZRZYSRG-COMQUAJESA-N	246.354	1.959	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@H](C)C(=O)O)cc1C	818849176	BMASBOYEXBGFGK-SNVBAGLBSA-N	237.299	1.914	10	20	BDCD	
COc1cccc(CNC[C@H](N)C(C)C)c1O	841028809	HVPAINWJSJCTJG-NSHDSACASA-N	238.331	1.474	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCCNCC1	843045588	VSQKIHXFMCFOST-UHFFFAOYSA-N	247.386	1.856	10	20	BDCD	
COc1ccc(O)c(CNC(=O)OCCF)c1	859007576	BCNQYQKKYRSOCS-UHFFFAOYSA-N	243.234	1.597	10	20	BDCD	
COC/C=C\C(=O)NCc1ccc(N(C)C)cc1	864573081	FMKKEDGUKIGRHR-PLNGDYQASA-N	248.326	1.571	10	20	BDCD	
Cc1cccc(O)c1CNCCC(C)(C)O	877422724	XSJIZSYAPKXIKK-UHFFFAOYSA-N	223.316	1.951	10	20	BDCD	
Oc1c(F)cc(F)cc1CN1CCC[C@H](O)C1	893871214	IEWKJBODAPFRBX-JTQLQIEISA-N	243.253	1.627	10	20	BDCD	
C[C@]1(C(=O)NCc2ccc(N)cc2)CCOC1	687356140	DPEVGADFMQHMNC-ZDUSSCGKSA-N	234.299	1.312	10	20	BDCD	
O=C(N[C@H]1C=CCCC1)c1cccc(O)c1O	185835969	VSKDLYIKKJCMMB-VIFPVBQESA-N	233.267	1.936	10	20	BDCD	
C[C@@H](CN)N(C)Cc1cccc(F)c1O	309500764	UXAZAHKWMFDJRP-QMMMGPOBSA-N	212.268	1.310	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCOCC12CC2	802292315	ICJUDAGBCYEZKV-UHFFFAOYSA-N	249.266	1.103	10	20	BDCD	
CN[C@@H]1CCN(Cc2cc(F)ccc2O)C1	219383500	DJVYJILVSFCEDN-LLVKDONJSA-N	224.279	1.325	10	20	BDCD	
CO[C@H](C)CC(=O)NCCc1ccc(N)cc1	152587339	NKKGWIVYQONJKT-SNVBAGLBSA-N	236.315	1.353	10	20	BDCD	
CC[C@@H](CO)NCc1ccc(OC)c(C)c1	35052480	QLYMTGCCTHJOGC-LBPRGKRZSA-N	223.316	1.864	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cc(C)ccc1O	70955401	QLWCAORVNVAZEE-SECBINFHSA-N	223.272	1.352	10	20	BDCD	
CN(C)C(=O)CSc1ncc(C(=O)O)s1	379804941	NNPVZCDOLAZGGK-UHFFFAOYSA-N	246.313	1.022	10	20	BDCD	
CN(C)c1ccc(CNCCCNC2CC2)cc1	228411451	BIBANIBZVUBXFZ-UHFFFAOYSA-N	247.386	1.984	10	20	BDCD	
NC1CCC(NCc2cc(F)ccc2O)CC1	220816759	MLJJDTCLIBSINL-UHFFFAOYSA-N	238.306	1.891	10	20	BDCD	
Nc1ccc(CNC[C@H]2CCCCO2)cc1	42825300	JLZUPUMLLOIWIK-CYBMUJFWSA-N	220.316	1.928	10	20	BDCD	
CN(C)c1ccc(CN(C)C2CNC2)cc1	85257271	MJNUSLNZHKQZGS-UHFFFAOYSA-N	219.332	1.156	10	20	BDCD	
C[C@H]1CCCN1C(=O)c1c(F)ccc(O)c1O	294857540	FZRRHMXFMULDDZ-ZETCQYMHSA-N	239.246	1.861	10	20	BDCD	
CC[C@@H](NCC1CNC1)c1ccc(C)cc1O	817964946	KLJDHENJVYEQOO-CYBMUJFWSA-N	234.343	1.961	10	20	BDCD	
CCC[C@H](O)C(=O)NCc1cc(C)ccc1O	827166295	GUJDEGJCZRZKII-LBPRGKRZSA-N	237.299	1.478	10	20	BDCD	
CC1=NO[C@H](C(=O)NCCc2ccc(N)cc2)C1	911782220	FDPFUEXTXMMHEW-LBPRGKRZSA-N	247.298	1.092	10	20	BDCD	
CNC[C@H](C)NCc1c(O)ccc(Cl)c1F	853249156	NWZCTDXPJFERKT-ZETCQYMHSA-N	246.713	1.882	10	20	BDCD	
N[C@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1	843046832	DZBJHNDGBSPLKC-ZETCQYMHSA-N	244.697	1.718	10	20	BDCD	
CCOc1cccc(CN[C@H](C)CNC)c1O	853248084	AKKSPAXJUNPWMU-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC(O)CC1	768924359	AXIAWLFMAKXGJS-UHFFFAOYSA-N	227.285	1.051	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CC[C@@H](N)CC2)cc1	870932268	BLXWYQIJQQBAKB-AOOOYVTPSA-N	233.315	1.725	10	20	BDCD	
C[C@H]1[C@@H](C)N(C)CCN1Cc1ccccc1O	775985862	PGZKXTOGCMQLMF-NEPJUHHUSA-N	234.343	1.917	10	20	BDCD	
COCC1CN(Cc2cccc(OC)c2O)C1	895970626	GEBRVAVEAMSBAD-UHFFFAOYSA-N	237.299	1.479	10	20	BDCD	
Cc1ccc(O)c(CNCC[C@@H](C)O)c1	78780374	PAIFFKDBCXKHLW-SNVBAGLBSA-N	209.289	1.561	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@H](F)[C@H](F)C1	1331184858	PAHWXFQPXWYOPN-KNVOCYPGSA-N	233.239	1.586	10	20	BDCD	
CC[C@@H](CO)NCc1cc(Cl)ccc1O	20195362	YGMAKENSWRMOLK-JTQLQIEISA-N	229.707	1.906	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H](O)C2CC2)c1	862755382	GGKVOYQCJLIBGF-LBPRGKRZSA-N	235.283	1.088	10	20	BDCD	
O=C1CC[C@@H]2CN(Cc3ccccc3O)CCN12	211633305	IHCNKIPXRWHITO-GFCCVEGCSA-N	246.310	1.199	10	20	BDCD	
C[C@H](CO)CNCc1c(O)cccc1Cl	83552153	RFRDYXZNKKLEBY-QMMMGPOBSA-N	229.707	1.764	10	20	BDCD	
CO[C@H]1CCC[C@H]1C(=O)NCc1ccccc1O	1353617679	IZHPWCHNKGOHAV-YPMHNXCESA-N	249.310	1.824	10	20	BDCD	
COc1ccc(O)c(CNCC(C)(C)OC)c1	164747055	YSUYNUFLRSNHJB-UHFFFAOYSA-N	239.315	1.915	10	20	BDCD	
C[C@H]1C[C@H](C(=O)N(C)Cc2ccccc2O)CO1	383727403	LKIAHTADMCSODS-JQWIXIFHSA-N	249.310	1.776	10	20	BDCD	
Cc1ncccc1/C=C1\SC(=S)NC1=O	171417390	AHWVWMIVQNHUHA-YVMONPNESA-N	236.321	1.879	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@H](C(F)F)C1	409433081	XFSXVJBKGXBXRR-YFKPBYRVSA-N	204.180	1.410	10	20	BDCD	
Nc1ccc(CC(=O)NCC2(N)CCCC2)cc1	852852438	XJIOUZBZCROYBB-UHFFFAOYSA-N	247.342	1.199	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H]3CCCN[C@@H]3C2)c1	219811731	MVBLCUFGRLZEMT-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
CONC(=O)NCc1ccc(N(C)C)c(F)c1	194660795	KGYDZDBKOMAZEH-UHFFFAOYSA-N	241.266	1.252	10	20	BDCD	
CN(CCCN)Cc1c(O)cccc1Cl	227742787	YQIPICICSZLOGV-UHFFFAOYSA-N	228.723	1.826	10	20	BDCD	
Nc1ccc(CC(=O)NCC2CCOCC2)cc1	83887413	LBXOPYXDEQECDL-UHFFFAOYSA-N	248.326	1.354	10	20	BDCD	
CC[C@H](O)CN[C@H](C)c1cc(F)ccc1O	229970523	ATUQDPYVNRMQIP-SCZZXKLOSA-N	227.279	1.953	10	20	BDCD	
CC1(C)C[C@@H]1C(=O)NCc1ccc(N)cc1	232834392	FIJCXSPZGVEYQN-LLVKDONJSA-N	218.300	1.931	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@H]1C[C@@H](O)C1)CC2	296013473	RHOLVERVFLHICK-OUAUKWLOSA-N	219.284	1.492	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1O	271353990	QACQIIMMPJLHIZ-UKRRQHHQSA-N	248.370	1.955	10	20	BDCD	
CC(=O)C(=O)COC(=O)CCc1ccccc1	808487503	NDWDYICQBJXUHT-UHFFFAOYSA-N	234.251	1.321	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c(O)c1	817977581	KXCIJTQRZCSISJ-PQFRYHKHSA-N	232.327	1.569	10	20	BDCD	
O=C(NC[C@@H](O)C1CCC1)c1cc(O)cs1	839790260	PQLJUKRMVLWSLP-SECBINFHSA-N	241.312	1.345	10	20	BDCD	
Cc1cccc(CN2CCN[C@H](C)[C@H]2C)c1O	843058279	QSMRZGWLHWAIGT-VXGBXAGGSA-N	234.343	1.883	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@](F)(CO)C1	877505019	WONZMQHLNZWZFK-CYBMUJFWSA-N	239.290	1.607	10	20	BDCD	
Cc1cccc(O)c1CN(C)[C@H]1CCNC1=O	876816400	YIDGTCXQEBCHJU-NSHDSACASA-N	234.299	1.021	10	20	BDCD	
C[C@@H](O)c1cn(Cc2ccc(N(C)C)cc2)nn1	881272016	JBNOAOQIELZRNF-SNVBAGLBSA-N	246.314	1.446	10	20	BDCD	
CCNC(=O)[C@H](C)N[C@@H](C)c1ccccc1O	36795284	XTLQJXHIAIUBPV-UWVGGRQHSA-N	236.315	1.567	10	20	BDCD	
C[C@H](CCN(C)C)NC(=O)Cc1ccc(N)cc1	49551418	TTZAWGDEGZMWKG-LLVKDONJSA-N	249.358	1.268	10	20	BDCD	
C[C@H]1C[C@@H](NCc2ccccc2O)CCN1C	90721244	ULPUYZMYDUJNPC-AAEUAGOBSA-N	234.343	1.965	10	20	BDCD	
Cc1occc1C(=O)NCc1ccc(O)c(O)c1	158872626	HDXSROBAASAZAA-UHFFFAOYSA-N	247.250	1.929	10	20	BDCD	
CN1CC[C@@H]1CNCc1ccc2c(c1)CCCO2	922574361	KSEKXCLMBKUICT-CQSZACIVSA-N	246.354	1.805	10	20	BDCD	
CC(C)(CO)CN[C@H]1CCc2cccc(O)c21	310465466	GNYNVGHMDSQHIE-NSHDSACASA-N	235.327	1.988	10	20	BDCD	
C[C@@H]1C[C@H](CN)CN1Cc1ccccc1O	126769759	DGUZVOCCOSGBTH-GHMZBOCLSA-N	220.316	1.561	10	20	BDCD	
CN(CCn1cncn1)c1ccc2c(c1)OCO2	270369351	TVFYDSBSWSSMJS-UHFFFAOYSA-N	246.270	1.143	10	20	BDCD	
O=C(CCCF)NCc1ccccc1O	830526283	IBSDKWSILMRXCX-UHFFFAOYSA-N	211.236	1.758	10	20	BDCD	
Cc1cc(O)c(CN(C)CCCN)cc1C	843051057	UGLLFHQMSCPSLG-UHFFFAOYSA-N	222.332	1.790	10	20	BDCD	
CC(F)(F)CNC(=O)c1cccc(O)c1O	697987115	ICSVRWIGLQEONG-UHFFFAOYSA-N	231.198	1.483	10	20	BDCD	
Cc1ccc(CN(C)CCOCCO)c(O)c1	877502949	WWCQDMPRCYYWNL-UHFFFAOYSA-N	239.315	1.141	10	20	BDCD	
CO[C@H](C)CNCc1ccc(C)cc1O	877465311	SWUAWPOBVKGJEA-SNVBAGLBSA-N	209.289	1.825	10	20	BDCD	
O=C(OCC(F)F)c1cccc(O)c1O	779466045	MBVIXGBQCCEWCO-UHFFFAOYSA-N	218.155	1.520	10	20	BDCD	
O=C(NCC(F)F)c1c(F)ccc(O)c1O	789991440	XQSQZOKBEIDAKJ-UHFFFAOYSA-N	235.161	1.232	10	20	BDCD	
COCC1CN(Cc2ccccc2O)C1	895971267	KMUQSNLBUIRPPD-UHFFFAOYSA-N	207.273	1.470	10	20	BDCD	
CN(C)c1ccc(CNCC2(C(=O)O)CC2)cc1	901506241	CUECSDODPLZUMQ-UHFFFAOYSA-N	248.326	1.707	10	20	BDCD	
C[C@H](O)[C@@H](C)Sc1ncc([N+](=O)[O-])s1	194946369	JCKJOVBYYNPLFS-CRCLSJGQSA-N	234.302	1.913	10	20	BDCD	
O=C(NCCC(F)F)c1cc(O)cs1	1348235575	QGHRCIOPFPOEIC-UHFFFAOYSA-N	221.228	1.839	10	20	BDCD	
CC1(C)[C@@H](N)C[C@@H]1NCc1cccc(F)c1O	1576380058	GHZHYDPRQFBPFX-QWRGUYRKSA-N	238.306	1.747	10	20	BDCD	
CN(C/C=C/C(=O)O)c1ccc2c(c1)OCCO2	258919617	NEQLCKYGPJFZMS-NSCUHMNNSA-N	249.266	1.535	10	20	BDCD	
Cc1nc(C(=O)NCc2ccccc2O)c(C)o1	815833684	ZHEQTKCWMKQNLY-UHFFFAOYSA-N	246.266	1.927	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CO[C@@H](C)C2)c1	402023689	GDNVGJUMKWBRPY-GXSJLCMTSA-N	237.299	1.668	10	20	BDCD	
CC[C@@H]1NCC[C@@H]1C(=O)NCc1ccccc1O	700654382	RLXHPQGFYKVQKE-RYUDHWBXSA-N	248.326	1.397	10	20	BDCD	
COc1ccc(CN[C@@H](C)CN)cc1C	841064281	XXQRAPJQXZJGCP-JTQLQIEISA-N	208.305	1.440	10	20	BDCD	
Cc1ccc(C(=O)NCc2ccoc2)c(O)c1O	179453836	DTFGKMHSMMZMKX-UHFFFAOYSA-N	247.250	1.929	10	20	BDCD	
CC[C@H](C(=O)OC)N(C)Cc1ccccc1O	173359184	VXFLIOGTTNYIAI-LLVKDONJSA-N	237.299	1.776	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@H](N)C1CC1	123859664	HQYYEGYORJWPDJ-LBPRGKRZSA-N	248.326	1.478	10	20	BDCD	
CNC[C@H]1CCCN1Cc1cc(C)ccc1O	133039893	QGAWFIQZLPUHPP-CYBMUJFWSA-N	234.343	1.884	10	20	BDCD	
CCN(CC)C(=O)NCCc1ccc(N)cc1	91961355	JDHQAEMEITVXIA-UHFFFAOYSA-N	235.331	1.863	10	20	BDCD	
CC(C)[C@H](NCc1cc(F)ccc1O)C(=O)O	232748667	VKECOBDYAXXSRH-NSHDSACASA-N	241.262	1.730	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1	250257375	RJQILCDUHNKRHY-WDNDVIMCSA-N	244.338	1.974	10	20	BDCD	
C[C@H](NC[C@H](C)CN)c1ccc(N(C)C)cc1	817962956	PSYGJIQEARGIKX-NEPJUHHUSA-N	235.375	1.998	10	20	BDCD	
C[C@@H]1CN(C(=O)c2cc(O)cs2)CCCO1	732284610	URXHUNCUEZVGQV-MRVPVSSYSA-N	241.312	1.705	10	20	BDCD	
Cc1ccc(C(=O)OCCCCO)c(O)c1O	733476207	MQSXJSQRIRSSHA-UHFFFAOYSA-N	240.255	1.336	10	20	BDCD	
COC/C(C)=C/C(=O)N(C)Cc1ccccc1O	845790758	CWITVGDBFMVPLF-DHZHZOJOSA-N	249.310	1.943	10	20	BDCD	
COc1cccc([C@@H](C)N[C@H](C)CO)c1O	846145176	OZECMJFTQYRFQV-RKDXNWHRSA-N	225.288	1.432	10	20	BDCD	
O=C(N[C@@H]1C=C[C@H](CO)C1)c1cc(O)cs1	748362250	DGZXBEJQTYKKGL-JGVFFNPUSA-N	239.296	1.121	10	20	BDCD	
Cc1cc(CN(C)[C@H](C)CN)ccc1N(C)C	923289047	DISMOLTYOWTDFQ-GFCCVEGCSA-N	235.375	1.840	10	20	BDCD	
COCC1(NCc2ccc3c(c2)CCO3)CC1	697484983	IHGVBGJGJWRFAC-UHFFFAOYSA-N	233.311	1.890	10	20	BDCD	
Cc1cccc(O)c1CNCC1(CO)CC1	877078548	UJCNZEPACRERNO-UHFFFAOYSA-N	221.300	1.563	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H]([C@@H](C)O)C1	877184004	JYSGMWKGCRDJID-VXGBXAGGSA-N	235.327	1.903	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1C[C@@H]1C(=O)O	37835649	OTWNDXTWODGLKE-UWVGGRQHSA-N	249.266	1.071	10	20	BDCD	
NC(=O)C[C@@H]1CCCN(Cc2ccc(N)cc2)C1	1336116555	GDEZHSMCMZSBJP-LBPRGKRZSA-N	247.342	1.356	10	20	BDCD	
CC(C)[C@H](N)CNCc1ccc(N)cc1	1336284796	DEXRZBJVZYSAIU-GFCCVEGCSA-N	207.321	1.342	10	20	BDCD	
Cc1cccc(CN[C@H](CF)C(=O)O)c1O	1607852261	DMTOZNLWOJBREK-SECBINFHSA-N	227.235	1.213	10	20	BDCD	
CON(C)CCN[C@H](C)c1ccc(F)cc1O	850479432	SUGQYOWMYOEIFV-SECBINFHSA-N	242.294	1.675	10	20	BDCD	
C[C@@H](NC(=O)C(C)(C)O)c1ccccc1O	827940352	BQSYUMSZNLVPNU-MRVPVSSYSA-N	223.272	1.340	10	20	BDCD	
Cn1ccc(CNc2ccc(N)cc2)n1	124679080	VGXJLKVXSAKLQE-UHFFFAOYSA-N	202.261	1.614	10	20	BDCD	
Cc1cccc(CN2CCN[C@H](C)C2)c1O	132481773	QPMAAKRBXZQNEA-LLVKDONJSA-N	220.316	1.494	10	20	BDCD	
CC(C)(N)CCC(=O)NCc1ccccc1O	228424176	XXXPWMARYVATFN-UHFFFAOYSA-N	236.315	1.526	10	20	BDCD	
C[C@H](O)CCN[C@H](C)c1ccc(F)cc1O	82992696	VCDALLODMMEJHN-DTWKUNHWSA-N	227.279	1.953	10	20	BDCD	
CC(=O)N1CCN(Cc2ccccc2O)CC1	84857710	GSICHAZTBDNJIK-UHFFFAOYSA-N	234.299	1.056	10	20	BDCD	
O=C(NOC/C=C\Cl)c1cccc(O)c1O	812407834	OMQJOHQBYDLLKY-DJWKRKHSSA-N	243.646	1.512	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H](C)N(C)C)c1	824904599	SLCNISGHMRLGGU-SNVBAGLBSA-N	236.315	1.267	10	20	BDCD	
CCC[C@H](O)C(=O)N[C@H](C)c1ccccc1O	828539569	QNRYGWFEUMDOIX-SKDRFNHKSA-N	237.299	1.730	10	20	BDCD	
CN(C)c1ccc(CNCC[N+](=O)[O-])cc1	905023352	HKVAJDSKCCELBD-UHFFFAOYSA-N	223.276	1.119	10	20	BDCD	
CC[C@H](COC)NCCc1ccc(N)cc1	841034583	HXSGKCLZDYVNHO-CYBMUJFWSA-N	222.332	1.826	10	20	BDCD	
Cc1c[nH]cc1C(=O)NCc1ccccc1O	748345127	JFESZLAOTRBUDC-UHFFFAOYSA-N	230.267	1.959	10	20	BDCD	
O=C(COC(F)(F)F)NCc1ccccc1O	934935523	JBWUOWPJCUJPJI-UHFFFAOYSA-N	249.188	1.545	10	20	BDCD	
C[C@@H](NC(=O)[C@]1(C)CCNC1)c1ccccc1O	870988772	ZDAFYLQGHORIFP-QMTHXVAHSA-N	248.326	1.569	10	20	BDCD	
C[C@@H](N)CC(=O)N(C)Cc1ccc(N(C)C)cc1	37801175	XDPNLXRBDXNTCW-LLVKDONJSA-N	249.358	1.448	10	20	BDCD	
C[C@H](N)[C@H]1CCN(Cc2ccccc2O)C1	168515031	KXMIPCKVRURRCB-QWRGUYRKSA-N	220.316	1.561	10	20	BDCD	
C[C@H]1C[C@H](NCc2ccc(N(C)C)cc2)CCN1	692161735	QPMROOJYOUYADP-GXTWGEPZSA-N	247.386	1.983	10	20	BDCD	
Cc1nccc(C(=O)NCc2ccccc2O)n1	396910449	ODGXMUNNBMWJML-UHFFFAOYSA-N	243.266	1.421	10	20	BDCD	
CCN(CC)C(=O)c1cccc(O)c1O	39096869	KLIZIGYAPYXTBK-UHFFFAOYSA-N	209.245	1.580	10	20	BDCD	
C[C@H](NCCN(C)C)c1ccc(N(C)C)cc1	37184062	AMNJYGSYAICQGZ-LBPRGKRZSA-N	235.375	1.965	10	20	BDCD	
OCC(F)(F)CNCc1cc(F)ccc1O	185661692	JLDQEFWNTSYVQR-UHFFFAOYSA-N	235.205	1.249	10	20	BDCD	
CC[C@H](NC[C@@H](O)COC)c1ccccc1O	71269702	CBJJIYBUZVNTMR-PWSUYJOCSA-N	239.315	1.440	10	20	BDCD	
N[C@@H]1CCC[C@H]2CN(Cc3ccccc3O)C[C@@H]12	228534727	QWWVLFDTKNSXHH-IACUBPJLSA-N	246.354	1.951	10	20	BDCD	
CC[C@@H](N[C@@H](C)C(=O)NC)c1ccccc1O	42560616	GMEZAELQMJKUES-GXSJLCMTSA-N	236.315	1.567	10	20	BDCD	
C[C@@H](NCC(C)(C)O)c1ccccc1O	83461043	DBRYTHBIAFUBQP-SECBINFHSA-N	209.289	1.814	10	20	BDCD	
Cc1cccc(CN2CCNC(=O)C[C@@H]2C)c1O	368132323	FSHZBPKCQXQLPP-NSHDSACASA-N	248.326	1.411	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@@H]1CCCNC1)CC2	817941956	USIHIAPPXGQHCV-VXGBXAGGSA-N	232.327	1.721	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)[C@H]1CCCO1	817957880	QIRNHEGRXCKETH-SMDDNHRTSA-N	234.343	1.968	10	20	BDCD	
Cc1cccc(CN(C)[C@@H](C)CCO)c1O	846112717	WXJIXOCLGKJAJL-NSHDSACASA-N	223.316	1.903	10	20	BDCD	
O=C(N[C@H]1C=CCC1)c1cc(O)cs1	855432990	OSSXGEMZBXPQFS-ZETCQYMHSA-N	209.270	1.902	10	20	BDCD	
CCc1cccc(CN(C)CCC(N)=O)c1O	692108789	JBIFUCGRVXRJDX-UHFFFAOYSA-N	236.315	1.262	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)C[S@@](C)=O	877310524	NQQGBSLUTOYRMO-MGPLVRAMSA-N	241.356	1.557	10	20	BDCD	
C/C=C\C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1	773740173	AGNRDPXMSRUDGT-TYRPZCRBSA-N	235.283	1.721	10	20	BDCD	
CN(C)c1ccc(CN2C[C@H]3COC[C@H]3C2)cc1	872267442	ZXASMBZCYXAMQJ-OKILXGFUSA-N	246.354	1.831	10	20	BDCD	
CC[C@@H](F)C(=O)N(C)c1ccc(N)cc1	1122174122	NOQUASYVXDOZTE-SNVBAGLBSA-N	210.252	1.980	10	20	BDCD	
CN[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1	53201412	UCNVMAMRPWKUEV-CQSZACIVSA-N	247.386	1.936	10	20	BDCD	
CN(CC(=O)N(C)C1CC1)c1ccc(N)cc1	49305762	LQVHJYLYMCTDMW-UHFFFAOYSA-N	233.315	1.326	10	20	BDCD	
CN(C(=O)C[C@@H](N)C(C)(C)C)c1ccc(N)cc1	1340845913	AZDOZAVCNRYUGI-GFCCVEGCSA-N	249.358	1.995	10	20	BDCD	
CCN[C@H](C)CNCc1ccc(N)cc1	1345159095	BADPSEMCVPEBHB-SNVBAGLBSA-N	207.321	1.356	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCCCO)c1	20188109	QSASMZUUAVLDHX-VIFPVBQESA-N	225.288	1.434	10	20	BDCD	
CC1=CCN(C(=O)c2cccc(O)c2O)CC1	167731512	SIWCGPOOWDFWTH-UHFFFAOYSA-N	233.267	1.890	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@@H]1CC[C@H]1O)CC2	818358282	SRRYNPUUXFDBGR-GMTAPVOTSA-N	219.284	1.492	10	20	BDCD	
COc1ccc(N(C)C[C@@H](C)O)cc1OC	49820096	DENFMTMCHCMYTK-SECBINFHSA-N	225.288	1.521	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)Cc1nnc[nH]1	179789877	VKHNICFTEGIUBY-UHFFFAOYSA-N	245.330	1.503	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2C[C@@H](O)C2)c1	294818521	KHOOVWSYPQGHCL-AOOOYVTPSA-N	223.272	1.014	10	20	BDCD	
COC1(C)CN(Cc2cc(F)ccc2O)C1	813332367	XABVGZDLXCAVBV-UHFFFAOYSA-N	225.263	1.752	10	20	BDCD	
C[C@@H]1C[C@H](O)CN(C(=O)c2cc(O)cs2)C1	839793365	QFBTUTPQJPNZDH-SFYZADRCSA-N	241.312	1.297	10	20	BDCD	
C[C@H](NC(=O)CCO)c1ccc(N(C)C)cc1	902923231	GYNTYYYYEWAZMK-JTQLQIEISA-N	236.315	1.312	10	20	BDCD	
CC(C)(CO)CCNC(=O)c1cc(O)cs1	833634684	XQTTYLLKGHEWNA-UHFFFAOYSA-N	243.328	1.592	10	20	BDCD	
CS[C@H](C)C(=O)NCc1ccc(O)cc1O	910952765	XWLVQUJTUHKUNB-SSDOTTSWSA-N	241.312	1.466	10	20	BDCD	
Nc1ccc(CCNC(=O)N2CC(F)C2)cc1	841960444	QMTGUQQAMJPUJX-UHFFFAOYSA-N	237.278	1.175	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)C2)c1	862755510	UQTSNIROANKIKO-SNVBAGLBSA-N	247.294	1.686	10	20	BDCD	
CC(=O)COC(=O)/C=C\c1ccc(O)c(O)c1	772777624	WLNGXKXCFCYCGV-HYXAFXHYSA-N	236.223	1.243	10	20	BDCD	
Cc1cccc(CN2CCCNC(=O)C2)c1O	775663688	NFOLRIJFTHJTMF-UHFFFAOYSA-N	234.299	1.023	10	20	BDCD	
COc1ccc(CNC(=O)NC(C)C)c(O)c1	792763674	QUFCOVNGYBPPQQ-UHFFFAOYSA-N	238.287	1.608	10	20	BDCD	
C[C@@H](CCCCN)NCc1ccc(N)cc1	1262488245	VUZZVDJESZCYDA-NSHDSACASA-N	221.348	1.876	10	20	BDCD	
NCC[C@@H]1CCCN(Cc2ccc(N)cc2)C1	1352791648	YVVGHIIGAXBEGX-LBPRGKRZSA-N	233.359	1.830	10	20	BDCD	
COCCOc1ccccc1NC[C@H](C)O	819428369	ZSKCPMHULHUXIY-JTQLQIEISA-N	225.288	1.505	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCCCN2)cc1	160338128	AUXBWFKJZCBIBL-LLVKDONJSA-N	219.288	1.349	10	20	BDCD	
Cn1cc(CN[C@H]2CCc3cccc(O)c32)cn1	295836007	FHRHUNZCSPCBHF-LBPRGKRZSA-N	243.310	1.903	10	20	BDCD	
C[C@H](CO)CSc1ncc(C(=O)O)s1	308460118	FJZLARGCUGIYEW-RXMQYKEDSA-N	233.314	1.562	10	20	BDCD	
O=C(NCC1CC=CC1)c1cccc(O)c1O	529708691	AXRSULCMKKOBTG-UHFFFAOYSA-N	233.267	1.794	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H](CN)C2)cc1	50245222	AVHGSBPQJOVSIQ-ZDUSSCGKSA-N	233.359	1.533	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)C(=O)O)c1	70955408	LJWTYFYDXODITE-MRVPVSSYSA-N	209.245	1.263	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H](C(=O)O)C2)cc1	86789463	CBIQDJPATCDLRM-GFCCVEGCSA-N	248.326	1.659	10	20	BDCD	
CCC[C@@H](N)C(=O)NCCc1ccc(N)cc1	262465458	XRJDECQNEPDFMS-GFCCVEGCSA-N	235.331	1.055	10	20	BDCD	
CN(CC(=O)O)Cc1cccc(F)c1O	820568729	BFHIGVWSKVKDMX-UHFFFAOYSA-N	213.208	1.048	10	20	BDCD	
O=C(OC[C@@H]1CCCO1)c1cccc(O)c1O	758562284	QBYQJNOFKQNKQU-QMMMGPOBSA-N	238.239	1.434	10	20	BDCD	
COc1cccc([C@H](C)NC/C=C/CO)c1O	850510217	VZCLDENULHUBDD-FSIBCCDJSA-N	237.299	1.600	10	20	BDCD	
Nc1ccc(CNC(=O)[C@H]2[C@H]3C(=O)CC[C@H]32)cc1	1122540973	YBKFUETWJVSJHP-RAIGVLPGSA-N	244.294	1.110	10	20	BDCD	
COCCN[C@@H](C)c1c(O)cccc1F	886489569	MBNWKAPWMGVZOG-QMMMGPOBSA-N	213.252	1.828	10	20	BDCD	
Nc1ccc(CNC(=O)NOC2CCCC2)cc1	1120529618	QAYKGSKWMPIGNT-UHFFFAOYSA-N	249.314	1.942	10	20	BDCD	
CCO[C@H]1CN(CCN=[N+]=[N-])C[C@H]1OC	409435867	XAJJCDFTJKYKIA-BDAKNGLRSA-N	214.269	1.032	10	20	BDCD	
C[C@H](N)CN[C@@H](C)c1cc(C(=O)O)ccc1O	1604260773	YRZSNSJWUZYLEF-YUMQZZPRSA-N	238.287	1.088	10	20	BDCD	
CN(C)c1ccc(CNCCCO)cc1	5569688	SHCKXJGSQBJHDT-UHFFFAOYSA-N	208.305	1.225	10	20	BDCD	
CN(C(=O)c1cccc(O)c1O)C1CCC1	163279840	ADXFJQGULCCBSM-UHFFFAOYSA-N	221.256	1.722	10	20	BDCD	
CCC(CC)(CN)NC(=O)Cc1ccc(N)cc1	262577735	LONKYUOEBSSRSE-UHFFFAOYSA-N	249.358	1.445	10	20	BDCD	
C[C@H](CCO)CNCc1cc(F)cc(F)c1O	708481160	AAVOTUKMGRWWBK-MRVPVSSYSA-N	245.269	1.779	10	20	BDCD	
OC[C@H]1C[C@H](NCc2cc(F)cc(F)c2O)C1	923005188	LBCPTKKQRVXUJH-GVJMRKKJSA-N	243.253	1.531	10	20	BDCD	
O=S(=O)(Nc1ccc(O)cc1)C1CC1	70909213	PJYCWLMCJDVJIS-UHFFFAOYSA-N	213.258	1.296	10	20	BDCD	
CN(CC1OCCO1)c1ccc2c(c1)OCO2	272241754	JKXVQARBDPOOGR-UHFFFAOYSA-N	237.255	1.224	10	20	BDCD	
CN1CC[C@@H]2CN(Cc3ccccc3O)C[C@@H]21	824893111	KGKVPNFOPYEGLX-YPMHNXCESA-N	232.327	1.528	10	20	BDCD	
Cc1cc(CNC(=O)c2cc(O)cs2)no1	731872093	YFESRTJJEDXEIL-UHFFFAOYSA-N	238.268	1.680	10	20	BDCD	
C[C@@]1(CNCc2ccccc2O)CCC(=O)N1	835059829	DXAFVEJOFDEYCU-ZDUSSCGKSA-N	234.299	1.151	10	20	BDCD	
CC(C)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1	832284804	MSFTVTFPJIOEIO-CYBMUJFWSA-N	249.358	1.525	10	20	BDCD	
CNC[C@H](C)N[C@@H](C)c1cc(F)ccc1O	854231700	JYUAWASRADADPQ-IUCAKERBSA-N	226.295	1.790	10	20	BDCD	
CN(C)c1ccc(CNC2(C)COC2)cc1	877691773	WCOJYAPQAQURDM-UHFFFAOYSA-N	220.316	1.631	10	20	BDCD	
CN(C(=O)[C@]1(C)CCCNC1)c1ccc(N)cc1	877077754	SUJSTOZSXNYRKD-CQSZACIVSA-N	247.342	1.621	10	20	BDCD	
C[C@H](C(=O)NCc1ccc(N(C)C)cc1)N(C)C	873829338	OYSVVALYYSGUKS-LLVKDONJSA-N	249.358	1.319	10	20	BDCD	
C[C@@H](NCCCCO)c1c(O)cccc1F	886601107	JZEJGFWCZOWVEP-SECBINFHSA-N	227.279	1.954	10	20	BDCD	
C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1O	897684643	UKYCONJMBNVKLS-QPUJVOFHSA-N	241.718	1.858	10	20	BDCD	
CC1(C)CN(c2ccc(N)cc2)C[C@@H]1CO	409432766	LUXUPSAYTKZSMS-SNVBAGLBSA-N	220.316	1.724	10	20	BDCD	
CCN1CC[C@H](N[C@H](C)c2ccccc2O)C1=O	708663943	BBPZLOTTYKWTCE-PWSUYJOCSA-N	248.326	1.664	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H]3CN(C)C[C@@H]3C2)c1	194543369	SQJLIRLPOQMRFR-OKILXGFUSA-N	246.354	1.694	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@H]1CC12CC2	1350299511	BRGDKNSPYRKQHZ-SECBINFHSA-N	233.267	1.514	10	20	BDCD	
CN1CCN(Cc2ccccc2O)C(C)(C)C1=O	179579658	KVLXUHVASGVFIH-UHFFFAOYSA-N	248.326	1.445	10	20	BDCD	
C[C@H](C(=O)O)C(=O)N(C)Cc1ccccc1O	229343269	CTQGCJNIPAJHLF-QMMMGPOBSA-N	237.255	1.071	10	20	BDCD	
Nc1ccc(CNC(=O)COC2CCCC2)cc1	297257313	RGBHKYVLAVORCG-UHFFFAOYSA-N	248.326	1.844	10	20	BDCD	
COCCN(C)C(=O)c1ccc(C)c(O)c1O	272830957	PXAMKHCROWADGX-UHFFFAOYSA-N	239.271	1.125	10	20	BDCD	
COc1ccc(N(C#N)CC(=O)C(C)=O)cc1	289734710	SWUPDXBZNSNJRZ-UHFFFAOYSA-N	232.239	1.141	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1cc(OC)ccc1O	295072624	HMQQSVVNLLFLGT-NSHDSACASA-N	239.315	1.604	10	20	BDCD	
CN(Cc1cnns1)c1ccc2c(c1)OCO2	290046279	OIQSQTDCJXOKLF-UHFFFAOYSA-N	249.295	1.903	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)C1CNC1	817895027	SVXNKSFUAVEUSG-LBPRGKRZSA-N	247.386	1.759	10	20	BDCD	
COC1(C)CN(Cc2ccccc2O)C1	813332317	VBOBZAPTGRPSEK-UHFFFAOYSA-N	207.273	1.613	10	20	BDCD	
OCCC[C@@H]1CCN(Cc2ccccc2O)C1	825338940	WXWQCBCVYFMAOP-GFCCVEGCSA-N	235.327	1.987	10	20	BDCD	
CCn1nncc1CN(C)c1ccc(OC)cc1	844354868	JCJXLDDOVHQSIM-UHFFFAOYSA-N	246.314	1.943	10	20	BDCD	
Nc1ccc(NC[C@@]23CNC[C@H]2C3)cc1	853246856	VIAKOCKKIUMRLO-BXKDBHETSA-N	203.289	1.290	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C(C)(C)O)c(O)c1	876996295	RJOHMPNQQUZQIS-JTQLQIEISA-N	223.316	1.950	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)C[S@](C)=O	877310523	NQQGBSLUTOYRMO-HWPZZCPQSA-N	241.356	1.557	10	20	BDCD	
Cc1cccc(O)c1CN(C)CCN(C)C	877523356	ITAIBVLYFDEWLG-UHFFFAOYSA-N	222.332	1.694	10	20	BDCD	
CC(=O)C1=NN(c2cc(C)cc(C)c2)C(=O)C1	871939353	ADWJHCZZBNQKEW-UHFFFAOYSA-N	230.267	1.985	10	20	BDCD	
Cc1cccc(O)c1CN1CCC(O)CC1	876541057	SFETVYZIBXOWCU-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
C[C@@H](N[C@@H]1CCOC1)c1c(O)cccc1F	886554749	BICCFANHUVTQOJ-RKDXNWHRSA-N	225.263	1.971	10	20	BDCD	
Nc1ccc(-n2nc(Cl)ccc2=O)cc1	82289731	UYPBGIYBIYHTNN-UHFFFAOYSA-N	221.647	1.468	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1CCOC1	111235624	FQXUJVDNVKZTOZ-LLVKDONJSA-N	221.300	1.861	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](C(=O)O)[C@H]2C)c1O	1600532813	WRXPQWFWSCIUNR-ZYHUDNBSSA-N	249.310	1.996	10	20	BDCD	
CC(C)(C)OC(=O)N[C@H]1COCC[C@@H]1N=[N+]=[N-]	222551578	ONIFJYIOJUHWRX-YUMQZZPRSA-N	242.279	1.979	10	20	BDCD	
COC[C@@](C)(O)CN[C@H](C)c1ccccc1O	382548966	GWHJOWAVEJKDJA-MFKMUULPSA-N	239.315	1.440	10	20	BDCD	
O=C(N[C@@H]1C[C@H]2CC[C@@H]1O2)c1cccc(O)c1O	126491273	CGJIBNTZTPVVPA-ZOFUNIGCSA-N	249.266	1.148	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@@H](C)CO)c(O)c1	35602319	VXJYERNHSDQEKW-VHSXEESVSA-N	209.289	1.732	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H]2COCCO2)c1	71408219	SQLZITMIRKRLON-LBPRGKRZSA-N	237.299	1.206	10	20	BDCD	
COC[C@H](CO)N[C@@H](C)c1ccc(C)cc1O	234824074	VASWKLQCASEKSW-QWRGUYRKSA-N	239.315	1.359	10	20	BDCD	
C[C@H](C[S@@](C)=O)N(C)Cc1ccccc1O	185225798	ZTYJFTVAIDKKCO-QLJPJBMISA-N	241.356	1.591	10	20	BDCD	
C[C@H](N[C@H]1CCNC1)c1cc(F)ccc1O	817945303	ZBPSFXMPMBJCFF-WPRPVWTQSA-N	224.279	1.544	10	20	BDCD	
CO[C@@H](C)[C@@H](C)NCCc1ccc(N)cc1	817956321	WJAPVKXGDPGUNU-MNOVXSKESA-N	222.332	1.824	10	20	BDCD	
COCCNCCN[C@@H](C)c1ccccc1O	817965749	ZQCVKABJQUCHKS-NSHDSACASA-N	238.331	1.279	10	20	BDCD	
CO[C@@H](CNC(=O)c1cc(O)cs1)C1CC1	832895021	WBYOQCSSURTLSI-VIFPVBQESA-N	241.312	1.609	10	20	BDCD	
O=C(NCc1ccccc1O)c1cc[nH]c1	731873080	WJOYMQSKUWZDSG-UHFFFAOYSA-N	216.240	1.650	10	20	BDCD	
C[C@@H](CN)CNCc1cccc(F)c1O	841047945	FEHLEGZDIDGLPT-QMMMGPOBSA-N	212.268	1.216	10	20	BDCD	
CNCCNCc1ccc(N2CCCC2)cc1	1118018715	JCOZLFUXYFYTKW-UHFFFAOYSA-N	233.359	1.596	10	20	BDCD	
CC1(O)CN(Cc2cc(Cl)c(F)cc2O)C1	877580931	KABPCOIXQLIWGD-UHFFFAOYSA-N	245.681	1.751	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@]1(C)CCOC1	687411358	BWMPPLRJMUEPQZ-AWEZNQCLSA-N	249.310	1.777	10	20	BDCD	
C[C@H]1C[C@@H](NCc2ccc(N)cc2)CCN1	1246168538	FKPTUKBFTVHBBK-GWCFXTLKSA-N	219.332	1.499	10	20	BDCD	
Cc1nc(C(=O)N(C)Cc2ccccc2O)co1	776335783	NEYNFMANKNRJKV-UHFFFAOYSA-N	246.266	1.961	10	20	BDCD	
CN(C[C@@H]1CCCNC1)c1ccc(N)cc1	1118896832	HAZPKJQXDSKDNZ-LLVKDONJSA-N	219.332	1.705	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CCCCN2)c1O	841033623	YCLKGVALSPZMEM-ZDUSSCGKSA-N	234.343	1.932	10	20	BDCD	
Cc1ccc(CN2CCC[C@@H]2C(=O)O)c(O)c1	1594358496	BJSSWTSRALGPAZ-LLVKDONJSA-N	235.283	1.750	10	20	BDCD	
COc1cccc(O)c1CNCCOCCF	853091462	JSPGUVHBARRGBX-UHFFFAOYSA-N	243.278	1.477	10	20	BDCD	
C[C@@H](N)CCC(=O)NCc1ccc(N(C)C)cc1	70317433	YTGGVRKYMGHXJT-LLVKDONJSA-N	249.358	1.496	10	20	BDCD	
CC(=O)C(=O)CSc1cc(C)cc(C)n1	808032868	ALUVQBZZJPROID-UHFFFAOYSA-N	223.297	1.949	10	20	BDCD	
COC(=O)C1(C(=O)Nc2ccc(N)cc2)CC1	818556332	MOAZYFDCGZSBJN-UHFFFAOYSA-N	234.255	1.161	10	20	BDCD	
Cc1cc(CN2CC(=O)N(C)C2)ccc1N(C)C	815083931	JBUJFQNKZSPWIU-UHFFFAOYSA-N	247.342	1.293	10	20	BDCD	
COC(=O)[C@H](C)N(C)C(=O)c1cc(O)cs1	839750457	NAHJSUKWJXXHJY-LURJTMIESA-N	243.284	1.087	10	20	BDCD	
COc1cccc(CN[C@H](CO)CCF)c1O	846097236	OEWUJXZGYOYTGF-JTQLQIEISA-N	243.278	1.211	10	20	BDCD	
CCO/C=C/C(=O)NCc1ccc(N(C)C)cc1	841017158	ATRPXHNUPCPZRQ-MDZDMXLPSA-N	248.326	1.919	10	20	BDCD	
COc1ccc(CNC[C@H](O)C2CC2)cc1C	71302175	MRRLUMLJTYJNSY-ZDUSSCGKSA-N	235.327	1.864	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1C[C@H]1F	1521254367	APICYPHFDPICMA-VHSXEESVSA-N	223.247	1.709	10	20	BDCD	
CN(C)c1ccc(CNCCCCN)cc1F	1345103411	DMYLHPSLWRSGLU-UHFFFAOYSA-N	239.338	1.720	10	20	BDCD	
CC(C)[C@](C)(CN)NC(=O)Cc1ccc(N)cc1	262608795	CQLLWHMDDUOCPI-AWEZNQCLSA-N	249.358	1.301	10	20	BDCD	
CC[C@@H](OC)C(=O)NCc1ccccc1O	299585169	RUBGNKLOHGSPIN-LLVKDONJSA-N	223.272	1.433	10	20	BDCD	
CO[C@@H]1COC[C@H]1N[C@@H](C)c1ccccc1O	842912091	QFSQDXWWDBEWHG-UFGOTCBOSA-N	237.299	1.457	10	20	BDCD	
Cc1ccc(O)c(CN(C)CC(=O)NC2CC2)c1	120365267	HRVZHKUYOVJIAK-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
CN(CCN1CCCC1)Cc1ccccc1O	89912290	NBSCNHSSQCAJFX-UHFFFAOYSA-N	234.343	1.920	10	20	BDCD	
CC(C)NCCC(=O)NCc1ccccc1O	228423194	FZTKGPVZAZFHSU-UHFFFAOYSA-N	236.315	1.397	10	20	BDCD	
CCC(=O)N[C@@H](C)c1cc(OC)ccc1O	728984487	QLBQWMYKYXUHFF-QMMMGPOBSA-N	223.272	1.988	10	20	BDCD	
C[C@@H](NCC1(N)CC1)c1ccccc1O	902413455	LUNYUARXBGEEPQ-SECBINFHSA-N	206.289	1.534	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCOC2)c1	827165858	BSEBPTNBIAVOGT-SNVBAGLBSA-N	235.283	1.353	10	20	BDCD	
CC(C)(N)CNCc1cccc(F)c1O	841031591	XJJVZIPATCXRJV-UHFFFAOYSA-N	212.268	1.358	10	20	BDCD	
Cc1cccc(CN[C@H](C)C[C@H](C)N)c1O	843129555	PPFDTAJXUVKKSN-WDEREUQCSA-N	222.332	1.916	10	20	BDCD	
Nc1ccc(CN[C@H]2CCC[C@@H](N)C2)cc1	1120370689	DMIFOOCYBKCMMR-OLZOCXBDSA-N	219.332	1.628	10	20	BDCD	
C[C@H]1C[C@H](O)CN1Cc1cc(F)ccc1O	788270029	OIUGDDMGNQZWJU-KWQFWETISA-N	225.263	1.486	10	20	BDCD	
CC(=O)OC[C@@H](C)NCc1ccccc1O	892792710	UEXRAYXWEDQQHN-SECBINFHSA-N	223.272	1.433	10	20	BDCD	
COc1cccc(O)c1CN1CCN(C)CC1	771926013	FRWPPGCDDCQFSI-UHFFFAOYSA-N	236.315	1.148	10	20	BDCD	
CCN(C)C(=O)NCc1ccc(N(C)C)cc1	101604159	YYNQHCZDQKPKRG-UHFFFAOYSA-N	235.331	1.914	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)Cc2ccccc2F)C1	409423480	OPJHKDPJXGAVNO-UHFFFAOYSA-N	234.234	1.889	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)[C@@H](C(N)=O)C1	1337838297	NHWXLNKQJIZWLW-ZWNOBZJWSA-N	247.342	1.355	10	20	BDCD	
CN(CC[C@H]1CCNC1=O)Cc1ccccc1O	821390930	FYUMQBVBOPXJAQ-LLVKDONJSA-N	248.326	1.350	10	20	BDCD	
COc1ccc(CNCc2cncn2C)c(O)c1	388358382	KWSZTOOPXBEWEM-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
CCn1nncc1CNCc1cc(C)ccc1O	527728146	PPGKJWSRVUCGED-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
CCC[C@@H](N)C(=O)NCc1ccc(N(C)C)cc1	40825887	ADPIDCGBVSPNNC-CYBMUJFWSA-N	249.358	1.496	10	20	BDCD	
C[C@@H](CN)N(C)Cc1cc(Cl)ccc1O	383024969	XSLPJHVSAJEUML-QMMMGPOBSA-N	228.723	1.825	10	20	BDCD	
CC[C@@H](CCO)NCc1cc(F)ccc1O	226611012	MSFYBZIGSWIZRT-NSHDSACASA-N	227.279	1.782	10	20	BDCD	
CC1(C)CN(Cc2ccccc2O)CC[C@@H]1O	275838246	GNNPGQXEHTXDGN-ZDUSSCGKSA-N	235.327	1.985	10	20	BDCD	
C[C@@H](NC(=O)C(=O)O)c1ccc(N(C)C)cc1	810542219	KTLMBXXYRGYZFO-MRVPVSSYSA-N	236.271	1.014	10	20	BDCD	
C[C@@H]1C[C@H](NCCc2ccc(N)cc2)CCN1C	817956273	VNRNFJXPDVJFOF-IUODEOHRSA-N	247.386	1.884	10	20	BDCD	
C[C@]1(CN)CCN(Cc2cccc(F)c2O)C1	843116306	KIPXASARFMCLMW-CYBMUJFWSA-N	238.306	1.702	10	20	BDCD	
C[C@](O)(CNCc1ccccc1O)C1CC1	390366979	UMWBUQDXAOESSG-ZDUSSCGKSA-N	221.300	1.643	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](C)[C@H](O)C2)c1	897684008	JCLFFDBFUCOINX-GXFFZTMASA-N	221.300	1.513	10	20	BDCD	
C[C@@H](O)[C@H]1CCN(C(=O)c2cc(O)cs2)C1	780803149	IPTYAFWLGCEAAZ-SFYZADRCSA-N	241.312	1.297	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2ccc(N)cc2)CCN1	1246168548	FKPTUKBFTVHBBK-MFKMUULPSA-N	219.332	1.499	10	20	BDCD	
Cc1cccc(CNC2CCOCC2)c1O	162828417	MJXOOGSDSFUGDG-UHFFFAOYSA-N	221.300	1.969	10	20	BDCD	
C[C@H](CN)N(C)Cc1cccc(Cl)c1O	309504504	VOIKYISXMGILMJ-MRVPVSSYSA-N	228.723	1.825	10	20	BDCD	
CC[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(N)=O	379212072	FJHDJWYREYHCFS-GXFFZTMASA-N	249.358	1.667	10	20	BDCD	
C[C@@H]1CC[C@H](CNC(=O)Nc2ccc(N)cc2)O1	397943344	IMWHEBRMZNPMBS-BXKDBHETSA-N	249.314	1.958	10	20	BDCD	
Nc1ccc(NC(=O)CO[C@@H]2CCOC2)cc1	110525544	BPZVSMCCBADBRO-LLVKDONJSA-N	236.271	1.013	10	20	BDCD	
C[C@H](N[C@@H](C)c1ccccc1O)C(=O)N(C)C	36794363	CQIVYBDWPLYURD-UWVGGRQHSA-N	236.315	1.520	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C(=O)N(C)C)c1	71407091	MDOKMNHAIAELEP-JTQLQIEISA-N	236.315	1.267	10	20	BDCD	
[N-]=[N+]=NCCN1CCC(O)(C(F)(F)F)CC1	380887443	JVMRFFZNWOHXFD-UHFFFAOYSA-N	238.213	1.686	10	20	BDCD	
Cc1ncoc1C(=O)NCc1ccccc1O	135839049	WRJAEDXMMTUZGY-UHFFFAOYSA-N	232.239	1.619	10	20	BDCD	
C[C@H](NCC(C)(C)O)c1ccc(F)cc1O	83461080	YQCOTEKADQZOKC-QMMMGPOBSA-N	227.279	1.953	10	20	BDCD	
CC[C@H](O)CN[C@H](C)c1ccccc1O	162197974	LYTVOLGQKZRPPR-ZJUUUORDSA-N	209.289	1.814	10	20	BDCD	
COC1CC(C(=O)N[C@H](C)c2ccccc2O)C1	827956404	LPPGBUQQCMGSGT-KPPDAEKUSA-N	249.310	1.994	10	20	BDCD	
Cc1cccc(O)c1CNC/C=C/CO	877624792	RWSZOXLBBNWJBU-NSCUHMNNSA-N	207.273	1.339	10	20	BDCD	
Cc1cccc(O)c1CN1CCCN(C)CC1	876511087	WAKDACVXSGKCPT-UHFFFAOYSA-N	234.343	1.838	10	20	BDCD	
Cc1cccc(O)c1CN1CCC[C@H](CO)C1	876510396	UXCBGUKERKCISX-LBPRGKRZSA-N	235.327	1.905	10	20	BDCD	
C[C@@H](O)CNCc1ccc2c(c1)CCCN2C	50286480	BEHMIXQSJCJYLQ-LLVKDONJSA-N	234.343	1.539	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C1CC(N)C1	395011850	UWAVZIFFURJKAS-UHFFFAOYSA-N	224.279	1.453	10	20	BDCD	
C[C@H](N[C@H](C)c1ncn(C)n1)c1ccccc1O	275622493	AGEAIVBPEAGZBE-VHSXEESVSA-N	246.314	1.933	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@H]2CCC[C@@H]2O)cc1	89151024	XFTZOHMUFBZEKM-YPMHNXCESA-N	248.326	1.089	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2cccc(F)c2)C1	409424470	VNEWVPCLGMAQLO-UHFFFAOYSA-N	220.207	1.960	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@H](O)[C@H](CC2CC2)C1	409435673	WCXFHVGHUYOPOK-MNOVXSKESA-N	224.308	1.780	10	20	BDCD	
CN=c1nc(Nc2ccc(N)cc2)cc[nH]1	409431269	ZRQFUQMXQMYPHW-UHFFFAOYSA-N	215.260	1.266	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@H](O)C1)c1cc(F)ccc1O	720951951	TVRWWJFQSJCONN-FXPVBKGRSA-N	239.290	1.953	10	20	BDCD	
C[C@@H](NCc1ccc(N)cc1)[C@H]1CCCNC1	1336285372	LHVQVLZPAQVWKW-YPMHNXCESA-N	233.359	1.747	10	20	BDCD	
Oc1ccccc1CNc1cncc2ncnn12	782947227	HXISRHWCDHZGLZ-UHFFFAOYSA-N	241.254	1.442	10	20	BDCD	
COc1cccc(CN(C)C2CC2)c1O	153783838	WVXRLUYWEUWAIE-UHFFFAOYSA-N	207.273	1.995	10	20	BDCD	
CN(Cc1cc(F)cc(F)c1O)C[C@H]1CCN1	1578486240	SOTCERNFSYBWJU-SNVBAGLBSA-N	242.269	1.464	10	20	BDCD	
CNC(=O)CCCN(C)Cc1ccc(N)cc1	68818944	MFQBPTZLDVLJDH-UHFFFAOYSA-N	235.331	1.227	10	20	BDCD	
C[C@H](Sc1ncc(Cl)s1)C(N)=O	849997963	IGAMFJMJNYOBSK-VKHMYHEASA-N	222.722	1.762	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H](O)C2)cc1F	126331619	JGLDZUNBJMBOIK-LLVKDONJSA-N	238.306	1.458	10	20	BDCD	
C[C@H](NCCC(=O)N(C)C)c1ccccc1O	37751511	ZCSNYMUAZPIYKV-JTQLQIEISA-N	236.315	1.521	10	20	BDCD	
CN(C)c1ccc(CNC(=O)CNC2CC2)cc1	40419354	PJUQBSPENQGAQN-UHFFFAOYSA-N	247.342	1.121	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cccc(C)c1	808489199	HZOWAPKWPUIYOB-UHFFFAOYSA-N	220.224	1.310	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H]1CC[C@H]1O	822504540	ULNFGQBIXOYGCD-ZIAGYGMSSA-N	234.343	1.674	10	20	BDCD	
C[C@@H](NCC1(N)CC1)c1cc(F)ccc1O	902404865	GEWMWNPMNDTBOL-MRVPVSSYSA-N	224.279	1.673	10	20	BDCD	
CC[C@H](CNCc1cc(C)ccc1O)C(=O)O	903706653	ZQQLIJOCCAFVCZ-SNVBAGLBSA-N	237.299	1.901	10	20	BDCD	
CO[C@H]1CCCN(C(=O)c2cc(O)cs2)C1	732285611	KBSAMOWTBCVMIW-VIFPVBQESA-N	241.312	1.705	10	20	BDCD	
CN(CC(F)F)C(=O)c1cc(O)cs1	732287351	VCEWAOLXUHUOSI-UHFFFAOYSA-N	221.228	1.791	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCOC1	854410325	URXBGGYHMYZVBU-UHFFFAOYSA-N	213.258	1.274	10	20	BDCD	
CNC(=O)[C@H](C)N[C@H](C)c1cc(F)ccc1O	94617866	KXPHJGDPIXJZDD-SFYZADRCSA-N	240.278	1.316	10	20	BDCD	
C[C@H](O)[C@@H]1CCCN1c1ccc(N)cc1	409426774	IRHNDIUKANLSKC-CABZTGNLSA-N	206.289	1.618	10	20	BDCD	
CNC[C@H](C)CNCc1ccccc1O	1327415620	KQQXUIAWCGPCBL-JTQLQIEISA-N	208.305	1.337	10	20	BDCD	
O=C1CCC[C@H]([C@H]2CCCCCN2)C1=O	164514926	FFXRYYXWSUOTDV-NXEZZACHSA-N	209.289	1.457	10	20	BDCD	
C[C@@H](O)[C@@H]1CCN(Cc2ccc(N)cc2)C1	161633160	JNWIGMWTZLGXSS-ZYHUDNBSSA-N	220.316	1.472	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](CO)CC2CC2)c1	754835930	YGJLBEFMQQXVEP-CYBMUJFWSA-N	235.327	1.951	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](O)C2)c1	128168684	MZBRNXNWXONPHB-NSHDSACASA-N	207.273	1.267	10	20	BDCD	
CN(C(=O)/C=C\c1cnn(C)c1)c1cccnc1	733968981	ZJEIHLHXESJIKG-WAYWQWQTSA-N	242.282	1.491	10	20	BDCD	
CCOC1CN(Cc2c(O)cccc2OC)C1	839132030	IQYADKLYDCAIND-UHFFFAOYSA-N	237.299	1.622	10	20	BDCD	
C[C@@H]1OCC[C@@H]1NCCc1ccc(N)cc1	841033804	BJOZTJLHIXCFEN-GWCFXTLKSA-N	220.316	1.578	10	20	BDCD	
C[C@H](C[C@@H]1CCCN1)NCCc1ccc(N)cc1	841038786	QGVHRWDNFPEQEM-DOMZBBRYSA-N	247.386	1.932	10	20	BDCD	
CCOc1ccc(O)c(CN(C)C[C@H](C)N)c1	863653487	LFCGHAIXLQHPJA-JTQLQIEISA-N	238.331	1.570	10	20	BDCD	
CC(C)[C@@H](CN)CNCCc1ccc(N)cc1	873211129	WDLVMGKZFIELLC-ZDUSSCGKSA-N	235.375	1.632	10	20	BDCD	
Nc1ccc(CN2CCCc3n[nH]cc32)cc1	1120269046	MAHBCHOWVCODMD-UHFFFAOYSA-N	228.299	1.945	10	20	BDCD	
CSCCNC(=O)c1ccc(C)c(O)c1O	780857583	YARBYDHSDCRLJM-UHFFFAOYSA-N	241.312	1.499	10	20	BDCD	
CC1=NO[C@H](CNCc2ccc3c(c2)CCO3)C1	895310006	FDXZSEWRDJIILM-ZDUSSCGKSA-N	246.310	1.876	10	20	BDCD	
CCN(CCO)Cc1c(O)cccc1Cl	127963359	SDWVKIDPRRGLJW-UHFFFAOYSA-N	229.707	1.860	10	20	BDCD	
C[C@@H]1C[C@H](NC(=O)Nc2ccc(N)cc2)CO1	402046782	NPQYFUKFVYJNDL-KCJUWKMLSA-N	235.287	1.568	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CCO1	21958505	XLDBUJCIQVZWBZ-SNVBAGLBSA-N	234.299	1.059	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@H](C)N1	153355705	YVNZGEKEOVWSKM-GHMZBOCLSA-N	247.342	1.020	10	20	BDCD	
CC[C@@](C)(CO)NCc1ccc2c(c1)CCO2	77111490	DQZSJQORAWIMDK-AWEZNQCLSA-N	235.327	1.872	10	20	BDCD	
CC[C@@H]1CCN(C(=O)c2cccc(O)c2O)C1	126539045	NCAFMGNEUDXVCG-SECBINFHSA-N	235.283	1.970	10	20	BDCD	
C[C@H](NCc1ccc(N(C)C)cc1)C(=O)O	41689450	NSBREJIHQQMHMK-VIFPVBQESA-N	222.288	1.315	10	20	BDCD	
C[C@H](O)CCN[C@H]1CCc2cccc(O)c21	297542399	FCNZENBVOXVPQQ-ONGXEEELSA-N	221.300	1.740	10	20	BDCD	
Cc1cc(O)c(CN2CCO[C@H]3C[C@@H]32)cc1C	368143252	RVGLAHVIOJPGRC-JSGCOSHPSA-N	233.311	1.982	10	20	BDCD	
Cc1cccc(CN2CCC[C@@H](CO)C2)c1O	271841930	TYWXWDHTQIGACN-GFCCVEGCSA-N	235.327	1.905	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1sccc1C	808488337	SYMUCQBYBPOLHQ-UHFFFAOYSA-N	226.253	1.371	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2C[C@H](O)C2)cc1Cl	827832632	QKGZMLNXEKKTOD-MGCOHNPYSA-N	241.718	1.967	10	20	BDCD	
O=C(CCCF)NCc1ccc(O)c(O)c1	830559509	PLDAFXIGQUWQDF-UHFFFAOYSA-N	227.235	1.464	10	20	BDCD	
C[C@H]1CN=C(NCc2cc(Cl)ccc2O)N1	849050321	ZJKXSLSGLIFXDW-ZETCQYMHSA-N	239.706	1.483	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1CC[C@@H](O)C1	877468774	MPXKOIGQVHSBHJ-NWDGAFQWSA-N	235.327	1.951	10	20	BDCD	
CCOC(=O)c1cnc(SC[C@@H](C)O)s1	882737732	VEONQQOFQSQPGG-ZCFIWIBFSA-N	247.341	1.793	10	20	BDCD	
COC[C@H]1CCCN(C(=O)CN=[N+]=[N-])C1	409432842	WQDSMQAPFFDZMZ-QMMMGPOBSA-N	212.253	1.182	10	20	BDCD	
CCN1CCC[C@H]1CNCc1ccc(N)cc1	1577771100	RORPTLMPVVHDQJ-AWEZNQCLSA-N	233.359	1.843	10	20	BDCD	
N[C@H]1CCN(Cc2cc(F)ccc2O)C1	219836505	IEILJIJOVPAZBY-JTQLQIEISA-N	210.252	1.064	10	20	BDCD	
Cc1cccc(CNCC[C@@H](O)C2CC2)c1O	898202145	DTNITSVJNZSPFA-CYBMUJFWSA-N	235.327	1.951	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1c(O)cccc1Cl	128816090	GLKBRMHMDGBSRV-SSDOTTSWSA-N	243.690	1.951	10	20	BDCD	
CCOc1ccc(CNCCF)c(O)c1	379977573	FKQMREPUZHQYIT-UHFFFAOYSA-N	213.252	1.850	10	20	BDCD	
CN(CC(=O)N1CCC1)Cc1ccccc1O	264584269	DKUSUXQIAAHVMJ-UHFFFAOYSA-N	234.299	1.056	10	20	BDCD	
Cc1ccc(O)c(CNc2ncnn2C)c1	162214045	WGBNANRLQYSHQV-UHFFFAOYSA-N	218.260	1.441	10	20	BDCD	
CCCCN(Cc1ccccc1O)C(=O)CO	282597885	XRJZUZVCQTVBOB-UHFFFAOYSA-N	237.299	1.513	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@H]1[C@@H]3CNC[C@@H]31)CC2	817977856	QRFQEIQFPYKSDP-BBGACYKPSA-N	230.311	1.187	10	20	BDCD	
CC(C)(CNC(=O)c1cc(O)cs1)C(=O)O	826596339	QTJZGZZZRHCDHV-UHFFFAOYSA-N	243.284	1.294	10	20	BDCD	
O=C(NCc1ccccc1O)OCCF	859002527	XYKYUBKTSWAYAY-UHFFFAOYSA-N	213.208	1.588	10	20	BDCD	
CNC[C@H](C)N[C@@H](C)c1ccc(C)cc1O	854232557	SKNSDZOCPDTFDI-QWRGUYRKSA-N	222.332	1.959	10	20	BDCD	
COC(=O)[C@H](C)Sc1nccs1	47852605	OHXHLRZEVSUXEI-YFKPBYRVSA-N	203.288	1.797	10	20	BDCD	
CN[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1	53201413	UCNVMAMRPWKUEV-AWEZNQCLSA-N	247.386	1.936	10	20	BDCD	
NC(=O)CN(Cc1ccc(N)cc1)C1CCCC1	35081202	CEUYQGDVPSFVOX-UHFFFAOYSA-N	247.342	1.499	10	20	BDCD	
C[C@H](O)CN[C@@H](C)c1cc(C(=O)O)ccc1O	1593462542	MEEDHNAQPMNZNY-YUMQZZPRSA-N	239.271	1.122	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@@H]1CCOC1	401389268	RNLPPZXWDYUMJN-NSHDSACASA-N	249.310	1.777	10	20	BDCD	
C[C@@H]1COCCN(Cc2ccccc2O)C1	369450280	CJGUVPJQMVVUJQ-NSHDSACASA-N	221.300	1.861	10	20	BDCD	
O=Cc1cc(F)c(O)c(O)c1Br	2241961149	IFGLUDQKTXAUKZ-UHFFFAOYSA-N	235.008	1.812	10	20	BDCD	
NCC1(C(=O)NCc2ccccc2O)CCCC1	228421325	NOWMPEUXMZTIQF-UHFFFAOYSA-N	248.326	1.528	10	20	BDCD	
Cc1cccc(CN(C)CC2CC(O)C2)c1O	191161368	ZSWHMINMYKHMEI-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
CC[C@H](O)CN[C@@H]1CCc2cccc(O)c21	297357664	PQBATQJHLFZQES-WDEREUQCSA-N	221.300	1.740	10	20	BDCD	
CNCCN[C@@H](C)c1ccc(N(C)C)cc1	817953169	OAGOLQLPSXRSIJ-NSHDSACASA-N	221.348	1.623	10	20	BDCD	
C[C@H]1C[C@H](NCCN)c2c(O)ccc(F)c21	817935452	WERXVXVPVNSXCG-CBAPKCEASA-N	224.279	1.628	10	20	BDCD	
C[C@@H](O)CN(Cc1ccccc1O)CC(F)F	825098699	MMNDIWHGXMCKJT-SECBINFHSA-N	245.269	1.840	10	20	BDCD	
COc1cccc([C@H](C)NCCCO)c1O	846138542	WCVVVJPQWXMNOK-VIFPVBQESA-N	225.288	1.434	10	20	BDCD	
CCOC[C@H](O)CN(C)Cc1ccccc1O	269665725	VRZZZAMNXPWHKF-GFCCVEGCSA-N	239.315	1.221	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1C[C@@H](C)[C@@H](O)C1	897680116	PIGUGQQMCIHYCD-DOMZBBRYSA-N	248.370	1.874	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)NC2CC2)o1	1537962584	PKDADYCSASLKBM-UHFFFAOYSA-N	206.205	1.982	10	20	BDCD	
CC(C)[C@@H](N)CNCc1ccc(N)cc1	1336284798	DEXRZBJVZYSAIU-LBPRGKRZSA-N	207.321	1.342	10	20	BDCD	
C[C@H](NC(=O)Cc1ccc(N)cc1)[C@@H]1CCCO1	35734284	DUMWFFAUTPHGDB-GWCFXTLKSA-N	248.326	1.495	10	20	BDCD	
C[C@H](CN)N[C@H](C)c1cc(C(=O)O)ccc1O	1593354403	PBMRYNMFKOHYHY-HTQZYQBOSA-N	238.287	1.088	10	20	BDCD	
C[C@H](CC(=O)O)NCc1ccc2c(c1)CCCO2	1120249080	DWUUSPFSYOIRCK-SNVBAGLBSA-N	249.310	1.964	10	20	BDCD	
C[C@H]1NCCC[C@H]1NCc1ccc(N(C)C)cc1	396726133	YSWDGASQCPBEAK-IUODEOHRSA-N	247.386	1.983	10	20	BDCD	
CO[C@H]1COC[C@@H]1NCc1ccc2c(c1)CCO2	289890538	SRTOTIGARQEDNW-JSGCOSHPSA-N	249.310	1.125	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCCCN1	37823729	ABWXKPISCDTETJ-LBPRGKRZSA-N	248.326	1.493	10	20	BDCD	
CN(C)c1ccc(CNCc2cc[nH]n2)cc1	36900214	UMCZQSMRPMFITA-UHFFFAOYSA-N	230.315	1.766	10	20	BDCD	
Oc1ccc(F)cc1CN[C@@H]1CCCC[C@H]1O	187674987	YPARGYYZSKQJEB-DGCLKSJQSA-N	239.290	1.924	10	20	BDCD	
COc1ccc(N(C)CCO)c(OC)c1	49814968	YCIQMLSRKJTYOT-UHFFFAOYSA-N	211.261	1.132	10	20	BDCD	
Cn1cnc(CNCc2ccccc2O)c1	381230757	KUWSFNQICHMMIT-UHFFFAOYSA-N	217.272	1.416	10	20	BDCD	
O=C1OCC[C@]12CCCN2Cc1ccccc1O	190030803	WAKRXYMSUALBPC-CQSZACIVSA-N	247.294	1.674	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H]2[C@@H](CO)[C@@H]2C1	814172644	XOJVZOOEYSJOLE-IAZYJMLFSA-N	249.310	1.071	10	20	BDCD	
C[C@@H](NC(=O)[C@H](O)C1CC1)c1ccccc1O	827946445	ICRLTQLBYNTYCF-PRHODGIISA-N	235.283	1.340	10	20	BDCD	
COC[C@@H]1CCN(C(=O)c2cc(O)cs2)C1	740128253	MWBJDYGPZPEISK-MRVPVSSYSA-N	241.312	1.562	10	20	BDCD	
COc1cccc([C@H](C)N[C@H]2C[C@@H](O)C2)c1O	846168812	LZMMZDFMZMCHJO-LPEHRKFASA-N	237.299	1.575	10	20	BDCD	
Cc1ccc(O)c(CNCCCNC2CC2)c1	841091674	CRPUSJYBAKWJSW-UHFFFAOYSA-N	234.343	1.932	10	20	BDCD	
CNCCNCc1cccc(Cl)c1O	841037265	VIUJZQPFVUUKML-UHFFFAOYSA-N	214.696	1.355	10	20	BDCD	
CCN(Cc1cn(C)nn1)c1ccc(OC)cc1	761671943	BSXIWEVZBDPUQK-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
Oc1c(Cl)cccc1CNC[C@@H](O)C1CC1	165164071	FNWQPGVTVMBCCT-LLVKDONJSA-N	241.718	1.906	10	20	BDCD	
COC[C@H](C)OC(=O)c1cccc(O)c1O	784787883	NKHIADXOGDOXDH-ZETCQYMHSA-N	226.228	1.290	10	20	BDCD	
Cc1cc(O)c(CN2C[C@H](O)C[C@H]2C)cc1C	788271149	ZFINUBFKVCKIBR-DGCLKSJQSA-N	235.327	1.964	10	20	BDCD	
CN(C)c1ccc(CNc2nnc(CO)o2)cc1	275221996	JSLJWVOMKYMTSK-UHFFFAOYSA-N	248.286	1.240	10	20	BDCD	
CSCCNC(=O)NCc1ccccc1O	726251445	YMRMZXPDFDJSQP-UHFFFAOYSA-N	240.328	1.554	10	20	BDCD	
CC(C)N(CCO)Cc1ccc(N)cc1	35365385	ODAUHHOCBPAULD-UHFFFAOYSA-N	208.305	1.472	10	20	BDCD	
COc1cccc(CNC[C@H](C)OC)c1O	191201245	AHTLKBZOCFERLP-VIFPVBQESA-N	225.288	1.525	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@H](C)CN)c1	382993412	FNSGCDVBUFZTHI-SECBINFHSA-N	224.304	1.180	10	20	BDCD	
Cc1ccc(O)c(CNCc2nonc2C)c1	809745714	ZVQFVALFUXGLPW-UHFFFAOYSA-N	233.271	1.682	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC[C@@H](C)CN)c1	817963212	SJBPULAKGSWPIS-QWRGUYRKSA-N	222.332	1.946	10	20	BDCD	
Cc1ccc(O)c(CN2CCc3nn[nH]c3C2)c1	827884961	MMYOEFSLPUPJEF-UHFFFAOYSA-N	244.298	1.377	10	20	BDCD	
Oc1c(F)cc(Cl)cc1CN[C@@H]1CC[C@H]1O	822503266	DTJJDNRQKUSZHJ-NXEZZACHSA-N	245.681	1.798	10	20	BDCD	
Cc1cccc(CN(C)C2(CO)CC2)c1O	827903468	IBKNUFUECXLVFD-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
CCNC(=N)NCc1cc(OC)ccc1O	849008863	GBLZHIAROJOYOI-UHFFFAOYSA-N	223.276	1.035	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](CO)CCF	846098152	ZTMRUMLJKLHFHR-SECBINFHSA-N	243.278	1.211	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](N)C(C)C)c1	841031793	YAFDVUQVXRSIJU-GFCCVEGCSA-N	238.331	1.474	10	20	BDCD	
Oc1ccc(Cl)cc1CN[C@H]1CCCNC1	841041644	CLGKMOWLSHMUMG-NSHDSACASA-N	240.734	1.887	10	20	BDCD	
C[C@H](CCO)N(C)Cc1ccc(N(C)C)cc1	844448562	GDZHGKDGVKHMMC-GFCCVEGCSA-N	236.359	1.955	10	20	BDCD	
CC(C)[C@@H](CCO)NC(=O)c1cc(O)cs1	756785225	BLTVZDRGSSAHPE-SECBINFHSA-N	243.328	1.591	10	20	BDCD	
Cc1ccc(CN2CCNC(=O)[C@H]2C)c(O)c1	876651487	CPOAZTMYVHSRCB-SNVBAGLBSA-N	234.299	1.021	10	20	BDCD	
Cc1ccc(CN(C)C[C@H](O)C2CC2)c(O)c1	877527710	OCJLZTMYDVZNEK-AWEZNQCLSA-N	235.327	1.903	10	20	BDCD	
CC(C)OCC(=O)NCc1cccc(O)c1O	1349080090	ZGXMGQCVDGWKJZ-UHFFFAOYSA-N	239.271	1.139	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccc(N)cc2)CC1(F)F	817877613	UKNJQZTXTQYKCD-NSHDSACASA-N	240.253	1.930	10	20	BDCD	
C[C@H](NC1CC(C(=O)O)C1)c1ccccc1O	1594240597	AHQNASOQWKOVFL-IDKOKCKLSA-N	235.283	1.906	10	20	BDCD	
O=C(Nc1ccncc1)c1cccc(O)c1O	126195099	JBSRFTDVGXSCPP-UHFFFAOYSA-N	230.223	1.745	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@](C)(O)C2)cc1	180183177	FPSUVSZHBYXAFL-CQSZACIVSA-N	234.343	1.709	10	20	BDCD	
CNC[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1	71142081	FDAVQGSQLYYLQZ-CQSZACIVSA-N	247.386	1.794	10	20	BDCD	
CCN1CCN(Cc2cc(F)ccc2O)CC1	138236110	OYNGSISGRNZMAX-UHFFFAOYSA-N	238.306	1.669	10	20	BDCD	
C[C@@H](CO)NCc1c(O)cccc1Cl	90739539	DGFFMEFEACGOCV-ZETCQYMHSA-N	215.680	1.516	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC(C)=O)c1	238378996	CXNPCTWLWKKCHA-SSDOTTSWSA-N	209.245	1.598	10	20	BDCD	
C[C@H](C[S@](C)=O)N(C)Cc1ccccc1O	185225763	ZTYJFTVAIDKKCO-HWPZZCPQSA-N	241.356	1.591	10	20	BDCD	
C[C@@H](NC1CC1)C(=O)NCCc1ccc(N)cc1	832659108	MKZQDJZUMJOKSQ-SNVBAGLBSA-N	247.342	1.068	10	20	BDCD	
Oc1c(F)cccc1CN[C@@H]1CCCNC1	841042617	LTHOSMCSECAYGJ-SNVBAGLBSA-N	224.279	1.373	10	20	BDCD	
Cc1cccc(O)c1CN(C)C1CC(O)C1	877344619	KRAFWNDZPMFKFS-UHFFFAOYSA-N	221.300	1.656	10	20	BDCD	
C[C@@H](O)[C@@H](C)Sc1ncc([N+](=O)[O-])s1	194946379	JCKJOVBYYNPLFS-RFZPGFLSSA-N	234.302	1.913	10	20	BDCD	
O=C(CC1CC1)NCc1ccc(O)cc1O	1332164866	GXTLFDMPGGLJAV-UHFFFAOYSA-N	221.256	1.514	10	20	BDCD	
CN(CC(=O)O)Cc1cc(F)c(F)cc1O	1593721294	FWXPFCGIFMZDFU-UHFFFAOYSA-N	231.198	1.187	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC[C@@H]2C[C@@H]21	804300710	ZJEZVANOECOHDL-SCZZXKLOSA-N	233.267	1.722	10	20	BDCD	
COCC(=O)NCc1ccc(N(C)C)c(F)c1	58730614	KPYYDWSFSZZHOA-UHFFFAOYSA-N	240.278	1.154	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1	33465777	HDFQIFXNSLHAMP-SNVBAGLBSA-N	236.315	1.658	10	20	BDCD	
CCNCCCN[C@H]1CCc2cccc(O)c21	817942557	AILIKWAMIUUYDT-LBPRGKRZSA-N	234.343	1.969	10	20	BDCD	
CC1(CNC(=O)c2c(F)ccc(O)c2O)CC1	826629980	IJHALBZZIFTLOM-UHFFFAOYSA-N	239.246	1.767	10	20	BDCD	
COc1cccc(O)c1CN(C)CC[C@H](C)O	769450856	IDSNAQBHRRIXIT-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
CC[S@@](=O)CCNCc1ccc(C)cc1O	877041836	PIGYRAFWOYOVIW-MRXNPFEDSA-N	241.356	1.559	10	20	BDCD	
C[C@@H]1C(=O)CCCN1C(=O)c1cc(O)cs1	885053079	DAMQWUYIKRVIHM-SSDOTTSWSA-N	239.296	1.647	10	20	BDCD	
C[C@H]1CN(C(=O)c2cc(O)cs2)CC[C@@H]1O	779462839	VYIVQOKOTYPAQJ-CBAPKCEASA-N	241.312	1.297	10	20	BDCD	
COc1cccc(O)c1CN(C)Cc1ncc[nH]1	894583695	JWVHGFVLJKOWSU-UHFFFAOYSA-N	247.298	1.756	10	20	BDCD	
CC[C@@](C)(CO)NCc1cccc(OC)c1O	80886476	UUSDUJLDWSGFOG-ZDUSSCGKSA-N	239.315	1.651	10	20	BDCD	
CN[C@H](C)CCNCc1ccc(N)cc1	1335290456	XQHCFUZRVFWBHK-SNVBAGLBSA-N	207.321	1.356	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)OCCCO	140620460	GMDYWBJIXKLGEX-HWKANZROSA-N	238.239	1.037	10	20	BDCD	in-vitro
COc1ccc(CN[C@@H](C)CO)cc1C	37258694	HIHHVUZEXSXNQO-JTQLQIEISA-N	209.289	1.474	10	20	BDCD	
Nc1ccc(N2CC[C@@](O)(C(F)(F)F)C2)cc1	380226626	XADILDHWWNFSML-JTQLQIEISA-N	246.232	1.772	10	20	BDCD	
CCO[C@@H](C)c1nccn1CC(=O)C(C)=O	808029902	ULLFRIWPUREYEI-VIFPVBQESA-N	224.260	1.139	10	20	BDCD	
CCCN[C@H](C)C(=O)NCCc1ccc(N)cc1	295167360	LBQSSXMFWUVFHY-LLVKDONJSA-N	249.358	1.316	10	20	BDCD	
CC[C@H]1CN(C(=O)c2cc(O)cs2)CCO1	732266446	BNYUOBVRXSZFJX-VIFPVBQESA-N	241.312	1.705	10	20	BDCD	
C[C@@]1(CNC(=O)c2cc(O)cs2)CCOC1	733365016	YVKSPLPSIAMXTB-NSHDSACASA-N	241.312	1.610	10	20	BDCD	
Oc1ccc(F)cc1CN[C@H]1CCCNC1	841043036	MYZSBJBJYLOMCD-NSHDSACASA-N	224.279	1.373	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)C1(CO)CC1	696129929	FBYWMHJSCSOUPP-NSHDSACASA-N	247.338	1.872	10	20	BDCD	
Cc1ccc(CN[C@H](C)C[C@@H](C)O)c(O)c1	877195860	PBDIYTNQKWHZFV-GHMZBOCLSA-N	223.316	1.950	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H](O)C1CCC1	877574920	ZMKGKVRGRQRHDM-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
CO[C@H]1CN(Cc2cc(C)ccc2O)CCO1	895968219	KCEVEPMBSQCIAA-CYBMUJFWSA-N	237.299	1.505	10	20	BDCD	
NCC[C@@H](NCc1ccc(N)cc1)C(F)F	1336284776	CSISPTQEWZPZAP-SNVBAGLBSA-N	229.274	1.341	10	20	BDCD	
Nc1ccc(CNC2CCC(N)CC2)cc1	1337838255	MWEGYITZQJGLFV-UHFFFAOYSA-N	219.332	1.628	10	20	BDCD	
COc1cccc(CNC[C@@H](C)C(=O)O)c1O	1332977796	CJKPHSROWVCKSU-MRVPVSSYSA-N	239.271	1.211	10	20	BDCD	
Nc1ccc(NC(=O)CC[C@@H]2CCNC2)cc1	168803298	XNTWVFQJNSOYNP-SNVBAGLBSA-N	233.315	1.597	10	20	BDCD	
CC[C@@]1(C(=O)NCc2ccc(N)cc2)CCCN1	1515330957	CGYXENWDRGGRGE-AWEZNQCLSA-N	247.342	1.417	10	20	BDCD	
C[C@@H]1CCN(CC(=O)NCc2ccc(N)cc2)C1	1576728971	BBBDFUXJHAJGAO-LLVKDONJSA-N	247.342	1.227	10	20	BDCD	
CC(C)(CO)CN[C@@H]1CCc2cccc(O)c21	310465465	GNYNVGHMDSQHIE-LLVKDONJSA-N	235.327	1.988	10	20	BDCD	
C[C@@H]1C[C@@H](C(=O)NCc2ccccc2O)CO1	132779793	OCRIOIMFYCRHFM-MWLCHTKSSA-N	235.283	1.433	10	20	BDCD	
O=C(CNCc1ccccc1O)NC1CCCC1	134522711	FQYCASGKRAAXJY-UHFFFAOYSA-N	248.326	1.541	10	20	BDCD	
CCc1ccc(C(=O)OCC(=O)C(C)=O)cc1	808487574	CQLWGOAASOQYIR-UHFFFAOYSA-N	234.251	1.564	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)CO)cc1Cl	825130513	BGWYHPHSAJKIMS-MRVPVSSYSA-N	229.707	1.824	10	20	BDCD	
CC[C@](C)(CCO)NC(=O)c1cc(O)cs1	831784132	HSCYJMICEWIFRW-LLVKDONJSA-N	243.328	1.735	10	20	BDCD	
CCOCCCOC(=O)c1cccc(O)c1O	758549097	YAYOLEWPENRRDM-UHFFFAOYSA-N	240.255	1.681	10	20	BDCD	
Nc1ccc(CCNC[C@@]23CNC[C@@H]2C3)cc1	853245989	FSZUGBMKQXACRR-JSGCOSHPSA-N	231.343	1.010	10	20	BDCD	
CC[C@H](NC)C(=O)Nc1ccc(N)cc1	852790857	UZHZZLGOIDEYLH-JTQLQIEISA-N	207.277	1.205	10	20	BDCD	
CN(Cc1cc2c(cc1O)OC[C@H]2O)C1CC1	768439914	ACURHDAIXZJSGT-GFCCVEGCSA-N	235.283	1.412	10	20	BDCD	
Cc1ccc(CNCCCn2cncn2)c(O)c1	877012046	NWMMMLIYJPIPHF-UHFFFAOYSA-N	246.314	1.472	10	20	BDCD	
C[C@H](N)C(=O)NCc1ccc(N2CCCC2)cc1	83884420	UHRBBODRIIHMSS-NSHDSACASA-N	247.342	1.250	10	20	BDCD	
Cn1nc(-c2cnccn2)cc1CN=[N+]=[N-]	409444086	ZSTYKPGURQSXJC-UHFFFAOYSA-N	215.220	1.687	10	20	BDCD	
COc1cccc(CN[C@@H]2C[C@]2(C)OC)c1O	694342811	ZNGCQFCJEBSRDD-YPMHNXCESA-N	237.299	1.668	10	20	BDCD	
CCn1[nH]cnc1=NCc1ccc(OC)cc1O	1515721769	XGGQGRWVEPLSBJ-UHFFFAOYSA-N	248.286	1.046	10	20	BDCD	
Cc1cccc(CN[C@H](C)C[S@](C)=O)c1O	164410170	XZLIAZLAGMVDIL-QLJPJBMISA-N	241.356	1.557	10	20	BDCD	
C[C@@H](CN)N(C)Cc1ccc(Cl)cc1O	1576006674	VWHKPTXPGPMGBY-QMMMGPOBSA-N	228.723	1.825	10	20	BDCD	
CC[C@H](CNCc1cc(OC)ccc1O)OC	290818269	GQUKAZNLKDEDSK-LLVKDONJSA-N	239.315	1.915	10	20	BDCD	
C[C@H](O)CCCNCc1cc(F)cc(F)c1O	708485209	LRPMIWWELHDPLQ-QMMMGPOBSA-N	245.269	1.921	10	20	BDCD	
CN[C@H]1CCN(Cc2ccccc2O)C1	150072671	IDSHHPOBDOBUNO-NSHDSACASA-N	206.289	1.186	10	20	BDCD	
Oc1ccccc1CN1C[C@@H]2CNC[C@@H]2C1	85282269	DETUCKWDDYMODP-TXEJJXNPSA-N	218.300	1.043	10	20	BDCD	
C[C@H](CNCc1cc(Cl)ccc1O)C(=O)O	848637661	JRNYUKGMAXOIKH-SSDOTTSWSA-N	243.690	1.856	10	20	BDCD	
Cc1[nH]ccc1C(=O)NCc1ccccc1O	750237793	DBPZMNCTBYWNGQ-UHFFFAOYSA-N	230.267	1.959	10	20	BDCD	
CN(Cc1cc2c(cc1O)OC[C@H]2O)C1CCC1	768465360	HJMXFSKNDLPILZ-CYBMUJFWSA-N	249.310	1.802	10	20	BDCD	
COc1ccc(CN[C@H](C)[C@H](C)OC)c(O)c1	877493867	PRSUEIAYVYYFIK-ZJUUUORDSA-N	239.315	1.914	10	20	BDCD	
Cc1cccc(O)c1CNCCOCCF	877643263	FVSPSQXWLUUNLJ-UHFFFAOYSA-N	227.279	1.776	10	20	BDCD	
Cc1ccc(CN(CCO)C(C)C)c(O)c1	876539113	VIYCZDPGIHIYOC-UHFFFAOYSA-N	223.316	1.903	10	20	BDCD	
COc1cc(C)cc(CN[C@H]2C[C@@H](O)C2)c1O	894940972	QCYWLVWVPOJQHQ-PHIMTYICSA-N	237.299	1.322	10	20	BDCD	
C[C@H](N[C@H](C)c1ccccc1O)c1ncnn1C	276698322	VKGVPXKGQMDEAH-ZJUUUORDSA-N	246.314	1.933	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)Nc1cc[nH]n1	1254338656	MBASUXFEBHUMIT-RQOWECAXSA-N	245.238	1.473	10	20	BDCD	
COc1cccc(O)c1CNCCCCCO	790483812	SXNJQVCFYBJIEJ-UHFFFAOYSA-N	239.315	1.653	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H](N)C2CCC2)cc1	1342019512	DUHYBRQGADYSEA-LBPRGKRZSA-N	233.315	1.012	10	20	BDCD	
CN1CCC(=O)[C@H](Cc2ccc(N)cc2)C1	261508372	RUBXFMSRLAIOOE-LLVKDONJSA-N	218.300	1.332	10	20	BDCD	
CC1(C)[C@@H](O)C[C@@H]1NCc1ccccc1O	163421384	KOGUUWCKIQKSKL-RYUDHWBXSA-N	221.300	1.641	10	20	BDCD	
CC(C)[C@H](NCc1ccccc1O)C(=O)O	19039	CNFJXXOHJSQWDI-NSHDSACASA-N	223.272	1.591	10	20	BDCD	
O[C@H]1C[C@H](CNCc2ccc3c(c2)CCCO3)C1	922323365	LEIGUTKBZBNSMH-MQMHXKEQSA-N	247.338	1.872	10	20	BDCD	
Cc1ccc(CN2CCC[C@H](C(=O)O)C2)c(O)c1	1594358489	BAXYBJZGEWQHFQ-LBPRGKRZSA-N	249.310	1.997	10	20	BDCD	
CCc1nc(CN[C@@H](C)c2ccccc2O)n[nH]1	274564205	CYMVXTPQDCPPBF-VIFPVBQESA-N	246.314	1.924	10	20	BDCD	
C[C@@H]1COCCN1Cc1cc(F)cc(F)c1O	708415586	ZJTUHHFGVQCOSX-MRVPVSSYSA-N	243.253	1.891	10	20	BDCD	
Nc1ccc(NC(=O)NC2CCC2)cc1	52212619	MMWUOZNYSAIBSN-UHFFFAOYSA-N	205.261	1.943	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(N)=O	115780456	PJOMLYAGPWKNPU-UHFFFAOYSA-N	207.277	1.229	10	20	BDCD	
C[C@H](N[C@H](C)c1ccccc1O)c1nncn1C	37017447	MVVIGOBWSNPIOU-ZJUUUORDSA-N	246.314	1.933	10	20	BDCD	
O=C(Nc1cccnc1)c1cccc(O)c1O	126194373	STCRZUPMKMWKDD-UHFFFAOYSA-N	230.223	1.745	10	20	BDCD	
CN(CCC(C)(C)O)Cc1ccccc1O	267456608	SZWNTRGGRDCEPW-UHFFFAOYSA-N	223.316	1.985	10	20	BDCD	
C[C@@H](N[C@H]1CCNC1)c1cc(F)ccc1O	817945301	ZBPSFXMPMBJCFF-SCZZXKLOSA-N	224.279	1.544	10	20	BDCD	
CNC(=O)C1(C(=O)Nc2ccc(N)cc2)CCC1	832244747	UCPZLMFUXJZQCU-UHFFFAOYSA-N	247.298	1.124	10	20	BDCD	
CNC[C@@H](C)NCc1cc(C)ccc1O	853248808	KFTWFVRKFDDYTF-SNVBAGLBSA-N	208.305	1.398	10	20	BDCD	
CN(C(=O)c1cc(O)cs1)C1(CO)CC1	854436183	RWJKDKVRXYOQNW-UHFFFAOYSA-N	227.285	1.051	10	20	BDCD	
C[C@H]1CCN(Cc2ccccc2O)C[C@@H]1CO	857061320	OIGGLOUYIHGJDY-WCQYABFASA-N	235.327	1.843	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1ccon1	768917185	DJYCUMZRXIFBIT-UHFFFAOYSA-N	234.211	1.016	10	20	BDCD	
CC(C)C[C@@H](N)C(=O)N(C)c1ccc(N)cc1	877078703	ACYQFMHMKFKZNP-GFCCVEGCSA-N	235.331	1.605	10	20	BDCD	
O=C(O)CCNCc1ccc(N2CCCC2)cc1	37252428	QNLKUEIPNVFZBE-UHFFFAOYSA-N	248.326	1.851	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@H]1CCCN1C	92621895	BBNOHNGXYFLDQN-CQSZACIVSA-N	233.359	1.795	10	20	BDCD	
CCn1ccn2nc(-c3cnccn3)cc12	409438428	MSRYVTKSWUJUSX-UHFFFAOYSA-N	213.244	1.613	10	20	BDCD	
CC[C@@H]1CN(c2ccc(N)cc2)CC[C@@H]1O	409436080	XYLFIKIJRGJELC-MFKMUULPSA-N	220.316	1.866	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1C[C@H](N)C1	693606582	UGLHCOKVNGVNAC-XYPYZODXSA-N	234.299	1.088	10	20	BDCD	
CN(C)c1ccc(CN(C)[C@@H]2CCNC2=O)cc1	771525656	KFMPQJKMZCQDFG-CYBMUJFWSA-N	247.342	1.073	10	20	BDCD	
Oc1c(F)cccc1CN1C[C@H]2CCNC[C@H]21	1580887996	CONOIZZMRDCIEO-BXKDBHETSA-N	236.290	1.325	10	20	BDCD	
C[C@H]1CCOCCN1C(=O)Nc1ccc(N)cc1	904500624	NEJHACAZYRIVLP-JTQLQIEISA-N	249.314	1.912	10	20	BDCD	
Nc1ccc(CC(=O)N[C@H]2CCC[C@H](N)C2)cc1	834598290	AWRKAKSVCZUXQR-STQMWFEESA-N	247.342	1.197	10	20	BDCD	
COC(=O)CN1CCCc2cc(CN)ccc21	700884210	XCAXWWSZPQKKKV-UHFFFAOYSA-N	234.299	1.071	10	20	BDCD	
CCCN[C@@H]1CCC2=C(C1)[S@](=O)C(=N)N2	2048531916	MZOCOESUNXMDIR-MLXNANBUSA-N	227.333	1.037	10	20	BDCD	
C[C@@H](NCc1ccccc1O)c1ncnn1C	788971522	KKPGNEZLROVCFV-SECBINFHSA-N	232.287	1.372	10	20	BDCD	
COc1ccc(CN[C@H]2CC(=O)N(C)C2)cc1C	263706518	HEQXRXNKNSZQLS-LBPRGKRZSA-N	248.326	1.324	10	20	BDCD	
C=Cn1cc(CNCc2ccccc2O)cn1	236565406	SXASWLFJASRTSE-UHFFFAOYSA-N	229.283	1.979	10	20	BDCD	
C[C@H]1C[C@H]1C(=O)NCc1ccc(O)cc1O	910957806	NPMDRDDCTZBCSB-OIBJUYFYSA-N	221.256	1.370	10	20	BDCD	
CCC1CN(C(=O)c2ccc(C)c(O)c2O)C1	837257676	DNYWCYMNMMTYHG-UHFFFAOYSA-N	235.283	1.888	10	20	BDCD	
C[C@@H](CN)N(C)Cc1cc(Cl)cc(F)c1O	843050858	AIQJFOAFPVCXKF-ZETCQYMHSA-N	246.713	1.964	10	20	BDCD	
Cc1cc(N(C)C)ccc1C[C@@H](C)NC(N)=O	840941503	YFWVRYRVPBOAQA-SNVBAGLBSA-N	235.331	1.660	10	20	BDCD	
COc1cccc(O)c1CNC[C@@H](N)C1CC1	841051184	VBDIBZMMQBKUPM-LLVKDONJSA-N	236.315	1.228	10	20	BDCD	
OC[C@@H](CCF)NCc1ccccc1O	846098166	ZZVQXVAMNANIMR-SNVBAGLBSA-N	213.252	1.202	10	20	BDCD	
CN(Cc1cccc(F)c1O)CC(C)(C)N	849350232	MKRGAPKHQRATNB-UHFFFAOYSA-N	226.295	1.700	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@](C)(O)C1	876791704	PAHHCSASPJDCGK-CYBMUJFWSA-N	221.300	1.657	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H](O)C[C@H]2C)c1	788270956	XPABBELVVIWMFU-MWLCHTKSSA-N	237.299	1.356	10	20	BDCD	
COc1ccc(CN[C@H]2CCN(C)C2)cc1C	42545920	KLABIGYMNDUEKP-ZDUSSCGKSA-N	234.343	1.797	10	20	BDCD	
COC(=O)[C@@H](C)NCc1cc(F)cc(F)c1O	708482647	XUTZCTCZIAIAJQ-ZCFIWIBFSA-N	245.225	1.322	10	20	BDCD	
CCON(C)C(=O)NCc1ccc(N)cc1	1335724684	IRNBJMSNSOEBIN-UHFFFAOYSA-N	223.276	1.362	10	20	BDCD	
Cc1[nH]nc(NCc2ccc(N)cc2)c1C(N)=O	1579838693	FIMWWXFRYJDWSQ-UHFFFAOYSA-N	245.286	1.011	10	20	BDCD	
CC[C@@H](O)CN[C@@H](C)c1cc(OC)ccc1O	163988895	SGYYXRHVLZMHHR-VHSXEESVSA-N	239.315	1.822	10	20	BDCD	
CC(C)NC(=O)CN[C@H](C)c1ccccc1O	36781641	JPFMCVPMJOABMV-SNVBAGLBSA-N	236.315	1.567	10	20	BDCD	
CCOCCCNC(=O)c1cccc(O)c1O	126231148	AKGRKUMPQJVARC-UHFFFAOYSA-N	239.271	1.254	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CCN(C)C2)c1	42545252	MOQWQIYSHSIMTC-LLVKDONJSA-N	236.315	1.195	10	20	BDCD	
C[C@@H](NCc1cnn(C)c1)c1ccccc1O	41158894	JNNZPKUEDXYIRA-SNVBAGLBSA-N	231.299	1.977	10	20	BDCD	
CCn1ccnc(Sc2nccs2)c1=O	91007417	UXTOXINMVNMYKA-UHFFFAOYSA-N	239.325	1.871	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1CCC(=O)O1	821390905	FRVUHOANXWLDGQ-NSHDSACASA-N	235.283	1.530	10	20	BDCD	
CSC[C@H](O)CN(C)c1ccc(N)cc1	923401860	YLSMUGCXJHBFNF-LLVKDONJSA-N	226.345	1.429	10	20	BDCD	
Cc1ccc(CN[C@@H](C)c2ncn(C)n2)c(O)c1	877459430	JKHOOOUUYMSGSI-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
C[C@H](NC/C=C\CO)c1c(O)cccc1F	886636072	FSWKWNILDIJVJU-XADBCAIWSA-N	225.263	1.730	10	20	BDCD	
CCCCNC(=O)NCCc1ccc(N)cc1	40675746	LOQQGGXOOCIQLA-UHFFFAOYSA-N	235.331	1.911	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H]2C[C@H]2F)cc1	1263063230	PPYKCVZKBOTWTH-GHMZBOCLSA-N	222.263	1.286	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1CO[C@@H](C)C1	842773589	BLKJKFCFVAMJDV-VHSXEESVSA-N	237.299	1.668	10	20	BDCD	
C[C@@H](O)CCCNCc1ccccc1O	227959705	NPCVAJAHXXVEAQ-SNVBAGLBSA-N	209.289	1.643	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@](O)(C(F)(F)F)C1	308803715	FOKXZCLYXLSGQF-ZCFIWIBFSA-N	224.186	1.296	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cc[nH]c1	109952610	BFVVMQUOEVMSFC-UHFFFAOYSA-N	230.267	1.993	10	20	BDCD	
COC(C)(C)CNC(=O)c1cccc(O)c1O	126541456	QEHXOGFXTSSQFP-UHFFFAOYSA-N	239.271	1.253	10	20	BDCD	
N[C@@H]1CCN(Cc2c(O)cccc2Cl)C1	128319961	JMLWGGLIQUVZGU-MRVPVSSYSA-N	226.707	1.579	10	20	BDCD	
CCN(CCO)Cc1cccc(OC)c1O	127966155	QGMABNBRKCJQBR-UHFFFAOYSA-N	225.288	1.215	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCc2cc[nH]n2)c1	41014223	QIMWIHCWXSVIDB-VIFPVBQESA-N	247.298	1.975	10	20	BDCD	
CN(C)c1ccc(CNC(N)=O)cc1F	194603468	DPWUXGFZPOOFIO-UHFFFAOYSA-N	211.240	1.060	10	20	BDCD	
CC[C@@H]1NCC[C@H]1C(=O)Nc1ccc(N)cc1	294779683	NORSRMMZWXAUBG-NEPJUHHUSA-N	233.315	1.595	10	20	BDCD	
C[C@@H](NCCNC1CC1)c1ccccc1O	817953727	PSSRKVNLRZYDJQ-SNVBAGLBSA-N	220.316	1.795	10	20	BDCD	
C[C@H](NCC1CNC1)c1ccc(N(C)C)cc1	817965139	MOBVMOKLUUSNCA-NSHDSACASA-N	233.359	1.623	10	20	BDCD	
CC[C@@H](N)CNCc1c(O)cccc1OC	841069645	CBXCTDQPXGGQRP-SECBINFHSA-N	224.304	1.228	10	20	BDCD	
CC(C)C1(C(=O)NCc2ccccc2O)COC1	934936290	REPAJEBVRCWHFT-UHFFFAOYSA-N	249.310	1.681	10	20	BDCD	
Cc1cccc(O)c1CN(CCO)C1CC1	876580018	OXELWSOFGGLJPP-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
C[C@H](N[C@@H]1CCN(C)C1)c1c(O)cccc1F	886522914	SYBPNBJNWVTUBA-VHSXEESVSA-N	238.306	1.886	10	20	BDCD	
CCOc1ccc(CNCCCCO)c(O)c1	785534888	PKVZILFKQVJVBT-UHFFFAOYSA-N	239.315	1.653	10	20	BDCD	
COC[C@@H](C)OC(=O)c1cc(O)cs1	783607013	CYXPVGHAEPUUKY-ZCFIWIBFSA-N	216.258	1.645	10	20	BDCD	
COC[C@@H](C)NCc1cc(C)cc(OC)c1O	894150000	TVJKTLKQVMUWIC-SNVBAGLBSA-N	239.315	1.834	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)NCc2ccc(N)cc2)CCO1	1341922896	GPVQFZUWEUVJJI-ZYHUDNBSSA-N	248.326	1.700	10	20	BDCD	
CN(C)c1ccc(CNC(C)(C)C(=O)O)cc1	77253752	SMXBJJSTSIWUMV-UHFFFAOYSA-N	236.315	1.705	10	20	BDCD	
Nc1ccc(N2C[C@@H]3CCC[C@@]3(CO)C2)cc1	409432342	LDJJQSPCVCVCAF-FZMZJTMJSA-N	232.327	1.868	10	20	BDCD	
CN[C@@H]1CCN(Cc2ccc(N)cc2)C1	1336116108	BSCMIZBMKLUZJR-GFCCVEGCSA-N	205.305	1.063	10	20	BDCD	
C[C@@H](CN(C)C)NCc1cc(F)cc(F)c1O	708479852	ASXXCQVINNVKGL-QMMMGPOBSA-N	244.285	1.710	10	20	BDCD	
CCN(CCNCc1ccccc1O)C1CC1	227550929	XYVGZOHNERAGPY-UHFFFAOYSA-N	234.343	1.966	10	20	BDCD	
CCOc1ccc(O)c(CNCC[C@H](C)O)c1	114770881	YRFZEKLQJZBIQC-JTQLQIEISA-N	239.315	1.651	10	20	BDCD	
COc1ccc(O)c(CN2CCC(O)CC2)c1	179584959	DBUGXRTUMCPSRP-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
O=C(NCc1ccccc1O)c1cncc(F)c1	124865749	PKBRUOUCIVQYDH-UHFFFAOYSA-N	246.241	1.856	10	20	BDCD	
OC[C@H]1CCN(Cc2ccccc2O)C1	128551555	AHJKDMGXUJONRF-JTQLQIEISA-N	207.273	1.206	10	20	BDCD	
C[C@@H](O)CN(Cc1ccc(N)cc1)C1CC1	83677027	PVRFOJNHMASSRE-SNVBAGLBSA-N	220.316	1.614	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)C(=O)O	274189763	QMLALUHGQCYPJX-UHFFFAOYSA-N	237.255	1.215	10	20	BDCD	
O=C(NOC/C=C\Cl)c1cc(O)cs1	812405320	WERRBWZGDWQGIF-UPHRSURJSA-N	233.676	1.868	10	20	BDCD	
CC(C)(C)C(=O)NCc1ccc(O)cc1O	910952544	XKLMJNBLSJLMDI-UHFFFAOYSA-N	223.272	1.760	10	20	BDCD	
CC[C@@H](N)CNCc1cc(OC)ccc1O	841071968	KOMSHJWRJUFASM-SNVBAGLBSA-N	224.304	1.228	10	20	BDCD	
CC[C@@]1(O)CCN(Cc2ccccc2O)C1	779217439	UMDMSWPZWBHDRR-CYBMUJFWSA-N	221.300	1.739	10	20	BDCD	
C[C@H](NC/C=C/CO)c1c(O)cccc1F	886636070	FSWKWNILDIJVJU-HPOULIHZSA-N	225.263	1.730	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCCCCN)c1	37714911	PZJLGNBVCOPNTA-JTQLQIEISA-N	238.331	1.790	10	20	BDCD	
COC(=O)c1ccc(NC(=O)CN=[N+]=[N-])cc1	102917917	SRHZRCANAWOPOB-UHFFFAOYSA-N	234.215	1.722	10	20	BDCD	
NC(=O)C1(NCc2cc(Cl)ccc2O)CC1	191482672	FLXWHVQDWBGCIY-UHFFFAOYSA-N	240.690	1.153	10	20	BDCD	
CO[C@H](C)[C@H](C)NC(=O)Cc1ccc(N)cc1	832166562	OAMGPWUZHKPVGG-VHSXEESVSA-N	236.315	1.351	10	20	BDCD	
Nc1ccc(NC(=O)NCC[C@@H](O)C2CC2)cc1	904502509	ZRBSGNURMOMDBB-GFCCVEGCSA-N	249.314	1.551	10	20	BDCD	
COCC1(NCc2cc(F)ccc2O)CC1	309648959	NJYOZCPGWAQYKM-UHFFFAOYSA-N	225.263	1.800	10	20	BDCD	
Cc1ccc(CN[C@@H]2CCC[C@H]2O)c(O)c1	877578704	LPLDVWHACSPAPK-VXGBXAGGSA-N	221.300	1.704	10	20	BDCD	
CCOc1ccc(N(C)CC(=O)N(C)C)cc1	60259139	BZIXJAAPBVOIGD-UHFFFAOYSA-N	236.315	1.610	10	20	BDCD	
C[C@H](N)CC(=O)N(C)Cc1ccccc1O	37823782	XZUQYBUERGDVHS-VIFPVBQESA-N	222.288	1.088	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1(O)CCCC1	125289994	RGENINOZDNFFBB-UHFFFAOYSA-N	249.310	1.656	10	20	BDCD	
CCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1	183443428	QKSLAVQRNZJEHW-QMMMGPOBSA-N	223.272	1.555	10	20	BDCD	
Cc1ccc(O)c(CN(CC(=O)O)C(C)C)c1	86740008	PBWYVRGHYXCJNS-UHFFFAOYSA-N	237.299	1.996	10	20	BDCD	
COC[C@@H](C)CC(=O)NCc1ccc(N)cc1	95033958	KAWRSGRVDUWFEX-JTQLQIEISA-N	236.315	1.558	10	20	BDCD	
OC[C@H]1CCN1Cc1c(O)ccc2ccncc12	902631548	YXIOSPDWMQFKFO-LLVKDONJSA-N	244.294	1.507	10	20	BDCD	
CO[C@H](C)C(=O)NCc1cc(Cl)ccc1O	846471848	BRFRLWUTOXPHIC-SSDOTTSWSA-N	243.690	1.697	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H](C)N1	70075013	DSTUZCGLBSVYMD-CHWSQXEVSA-N	247.386	1.935	10	20	BDCD	
COC1CC(C(=O)NCc2cc(C)ccc2O)C1	862754065	QBOQJEPBUTZFDQ-UHFFFAOYSA-N	249.310	1.742	10	20	BDCD	
Cc1cccc(O)c1CN1CCCOCC1	876618542	YMMYWXOVVXCAKY-UHFFFAOYSA-N	221.300	1.923	10	20	BDCD	
C[C@@H]1NCC[C@H]1C(=O)N(C)c1ccc(N)cc1	877077504	KXFKDULTSBYITR-JOYOIKCWSA-N	233.315	1.230	10	20	BDCD	
O=C(NC1CSC1)c1c(F)ccc(O)c1O	880729857	INDRRZLERFPLGQ-UHFFFAOYSA-N	243.259	1.082	10	20	BDCD	
CN(CC(=O)N(C)C)Cc1ccc(N(C)C)cc1	102675119	BPEXYJDRDCUKRF-UHFFFAOYSA-N	249.358	1.273	10	20	BDCD	
Oc1ccccc1CN1CCO[C@H](CF)C1	840955297	UDWLSMNUDZHUPN-LLVKDONJSA-N	225.263	1.563	10	20	BDCD	
COc1cccc(CN[C@H]2CCCOC2)c1O	109543595	AGHJHHRDMGKAPF-NSHDSACASA-N	237.299	1.669	10	20	BDCD	
CN[C@H]1CCN(Cc2cc(OC)ccc2O)C1	128864404	LMCWZHNCFKZXKL-NSHDSACASA-N	236.315	1.195	10	20	BDCD	
Cn1cc(NC(=O)c2cccc(O)c2O)cn1	126257067	RYPZYYZFDDGVEL-UHFFFAOYSA-N	233.227	1.084	10	20	BDCD	
CC(=O)C1(C(=O)N(C)Cc2ccccc2O)CC1	293491135	VVMPBZAJJXDEAB-UHFFFAOYSA-N	247.294	1.720	10	20	BDCD	
C[C@H](NC[C@@H](C)N)c1ccc(N(C)C)cc1	817972184	UWPPINVTCIYUCL-MNOVXSKESA-N	221.348	1.750	10	20	BDCD	
CC(C)[C@@H](O)C(=O)N[C@H](C)c1ccccc1O	827946588	NEGBJKYOHRHDBA-BXKDBHETSA-N	237.299	1.586	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCCCON)c1	902425337	MGXVNHUYUWRIJP-JTQLQIEISA-N	224.304	1.632	10	20	BDCD	
CC[C@H](CNCc1ccccc1O)C(=O)O	903704857	MTUMWUODSUSVAT-SECBINFHSA-N	223.272	1.593	10	20	BDCD	
C[C@H]1CCN(C(=O)c2cc(O)cs2)[C@@H]1CO	832761437	ZIDIODOZCHJSTO-IONNQARKSA-N	241.312	1.297	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1C[C@@H](N)[C@H](C)C1	843120255	BGLJNWBPOCHEAO-IUODEOHRSA-N	247.386	1.840	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCCOC2)c1	862758567	CZEPCBKFIPNCDV-NSHDSACASA-N	249.310	1.743	10	20	BDCD	
Cc1ccc(C(=O)OCC2CC2)c(O)c1O	763954799	IVHIEFINAFWBPJ-UHFFFAOYSA-N	222.240	1.973	10	20	BDCD	
C[C@H](NCC(F)(F)CO)c1c(O)cccc1F	886592072	KBYSDWCWUUISAJ-ZETCQYMHSA-N	249.232	1.810	10	20	BDCD	
CCOC1CC(C(=O)NCc2ccc(N)cc2)C1	1341924758	ZEUGWHBYBQEKKE-UHFFFAOYSA-N	248.326	1.700	10	20	BDCD	
COc1ccc(CNCc2ccn(C)n2)c(O)c1	213105634	XIQVLXBKZNLXHK-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
CO[C@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)C1	706532960	GLQYWBRMEURLHY-HAQNSBGRSA-N	234.299	1.105	10	20	BDCD	
Cc1ccc(O)c(CN2CCO[C@@H](CF)C2)c1	840955389	UMIOPGPGQMNWBF-LBPRGKRZSA-N	239.290	1.871	10	20	BDCD	
Oc1ccc(F)cc1CNCC(F)F	236560059	NOJDFGVIOTXMJZ-UHFFFAOYSA-N	205.179	1.886	10	20	BDCD	
Cc1cccc(CN2CC[C@H](N)C2)c1O	309625055	PYEFGQXGGGSROE-NSHDSACASA-N	206.289	1.234	10	20	BDCD	
COc1cccc(O)c1CNCCCC(=O)O	818622655	SDHVIQCRFSOILO-UHFFFAOYSA-N	239.271	1.355	10	20	BDCD	
C[C@H]1CN(Cc2ccccc2O)CC[C@@H]1C(=O)O	306071584	WQWCDUSQPDYHJX-JQWIXIFHSA-N	249.310	1.935	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(Cl)c2O)CCN1	132482175	QGQXCGVMCOPHAX-SECBINFHSA-N	240.734	1.839	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCC[C@H](C)O)c1	85983765	HXWSWCHZYGUJAC-VHSXEESVSA-N	239.315	1.822	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)c1ccn(C)n1	817957992	RUWXARZIQYCORF-NSHDSACASA-N	244.342	1.896	10	20	BDCD	
OC/C=C/CN[C@H]1CCc2cccc(O)c21	717532236	IJADYHRJSWGVKJ-GXFZAYBSSA-N	219.284	1.518	10	20	BDCD	
CC(C)=CC(=O)NCc1ccc(O)cc1O	910956893	IKSKVKKDSRQNJH-UHFFFAOYSA-N	221.256	1.680	10	20	BDCD	
C[C@@H]1CCN[C@H](C(=O)Nc2ccc(N)cc2)C1	841846484	OYXOIHZAAPBHGV-SKDRFNHKSA-N	233.315	1.595	10	20	BDCD	
CCc1cccc(CN2CC(=O)N[C@@H](C)C2)c1O	848915273	FFZZPBXSAKSMMD-JTQLQIEISA-N	248.326	1.275	10	20	BDCD	
CNC[C@H](C)N[C@H](C)c1ccccc1O	854230947	CDAHMAHFXOIJMU-VHSXEESVSA-N	208.305	1.651	10	20	BDCD	
COc1ccc(C(=O)N2CC(N=[N+]=[N-])C2)cc1	409422368	CXKIZFQMVGBLGL-UHFFFAOYSA-N	232.243	1.830	10	20	BDCD	
C[S@@](=O)CCNCc1cc(F)cc(F)c1O	708435160	BBHOXIIODWTGFD-MRXNPFEDSA-N	249.282	1.139	10	20	BDCD	
COc1ccc(O)c(CN2CCNC[C@H]2C)c1	722387077	NIKMQJPDJQRGTH-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@@H](OC)C2)c1	300046223	RQGDNTRCNHMSOP-GFCCVEGCSA-N	237.299	1.622	10	20	BDCD	
Nc1ccc(CC(=O)NC2CCOCC2)cc1	36308302	NSYKVRANQHQGSJ-UHFFFAOYSA-N	234.299	1.107	10	20	BDCD	
O=C(NCc1ccccc1O)N1CCCC1	136333634	XJUJHVIUMLRTHD-UHFFFAOYSA-N	220.272	1.698	10	20	BDCD	
O=C(O)COc1ccc(N2CCCC2)cc1	82656385	HSMUIMVKYBKIFW-UHFFFAOYSA-N	221.256	1.750	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1ccccc1O	83406845	KJGXRCXISSERAH-MRVPVSSYSA-N	209.245	1.297	10	20	BDCD	
C[C@H](c1nncn1C)N(C)Cc1ccccc1O	287761032	MGVBECVMTKBQBX-SNVBAGLBSA-N	246.314	1.714	10	20	BDCD	
C[C@@H](C[C@@H]1CCCN1)NCCc1ccc(N)cc1	841038789	QGVHRWDNFPEQEM-WFASDCNBSA-N	247.386	1.932	10	20	BDCD	
CN(C)CC(=O)NCc1cc(Cl)ccc1O	846472114	HAQWNTHMFPKWII-UHFFFAOYSA-N	242.706	1.223	10	20	BDCD	
C/C=C/C=C\C(=O)NCCc1ccc(O)c(O)c1	767784452	ALLZEMMCSMDIMG-IAROGAJJSA-N	247.294	1.889	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CO[C@@H](C)C2)c1	862757040	FEBJAMIIVWNLPS-JQWIXIFHSA-N	249.310	1.742	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1COCO1)CCCO2	894891077	YCCBMQSCCSYGJR-CYBMUJFWSA-N	249.310	1.474	10	20	BDCD	
CC[C@H](NCc1cc(F)ccc1O)C(=O)O	1329425778	AQZCHJXIVXAWLG-VIFPVBQESA-N	227.235	1.484	10	20	BDCD	
O=C(NCc1ccccc1O)C1CSC1	718373041	SXCCOSDSERKTLH-UHFFFAOYSA-N	223.297	1.371	10	20	BDCD	
CCc1cccc(CNC2(CO)CCC2)c1O	691494951	QSSPBLUZQUNYSP-UHFFFAOYSA-N	235.327	1.959	10	20	BDCD	
Nc1ccc(CN[C@H](C(=O)O)C2CC2)cc1	1608273107	ROAKHWABUALXBD-NSHDSACASA-N	220.272	1.222	10	20	BDCD	
Cn1cnc(CNCc2ccc3c(c2)CCO3)c1	808385002	HQVCWIDXRYTKTC-UHFFFAOYSA-N	243.310	1.645	10	20	BDCD	
C[C@H](NCCN1CCNC1=O)c1ccccc1O	808744283	XTFNMHOKNMPYDE-JTQLQIEISA-N	249.314	1.068	10	20	BDCD	
COC[C@@H](O)CN(C)c1ccc(OC)cc1	8697948	LOBJORACDSXKTD-NSHDSACASA-N	225.288	1.139	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@H](N)C2)cc1	20215729	PWDDGNYRIOGBQC-ZDUSSCGKSA-N	233.359	1.676	10	20	BDCD	
COc1cccc(O)c1CNCCSC	380243948	NTZPWDJASIRCSJ-UHFFFAOYSA-N	227.329	1.853	10	20	BDCD	
CO[C@@H](C)CN(C)Cc1cc(F)ccc1O	289195652	BBNARZKMJSASDL-VIFPVBQESA-N	227.279	1.998	10	20	BDCD	
CN1CC[C@@H]1CNCc1c(O)cccc1Cl	712572080	MUWXUXJKBPUJHL-SECBINFHSA-N	240.734	1.839	10	20	BDCD	
Cc1ccc(C(=O)O[C@@H](C)C(=O)O)c(O)c1O	738258997	XGZJWUVLJQJMAE-LURJTMIESA-N	240.211	1.036	10	20	BDCD	
Nc1ccc(NC(=O)NOC2CCC2)cc1	841300293	TWWBQGNKVWTPJS-UHFFFAOYSA-N	221.260	1.874	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2CSC2)c1	869411887	VRBKOUDGEAOIKT-UHFFFAOYSA-N	237.324	1.680	10	20	BDCD	
Cc1ccc(CN2C[C@@H]3C[C@]3(CO)C2)c(O)c1	877461708	JLJXSVJWXOLFLU-GXTWGEPZSA-N	233.311	1.515	10	20	BDCD	
C[C@H](NC[C@H]1C[C@@H](N)C1)c1ccc(F)cc1O	873253027	XVIWMGVYNDIWFG-ATZCPNFKSA-N	238.306	1.919	10	20	BDCD	
Cc1cc(O)c(CN2C[C@@H]3CNC[C@H]3C2)cc1C	770395032	OOPJACQIPRKUSF-KBPBESRZSA-N	246.354	1.660	10	20	BDCD	
COc1cc(C)cc(CNC/C=C\CO)c1O	895249053	ZLPZWTRGRCIKPE-ARJAWSKDSA-N	237.299	1.347	10	20	BDCD	
Cc1cc(O)c(CN2C[C@@H](O)C[C@@H]2C)cc1C	788271148	ZFINUBFKVCKIBR-AAEUAGOBSA-N	235.327	1.964	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(N)cc2)CCO1	36768910	VZONBBVSMGMCRC-CYBMUJFWSA-N	220.316	1.880	10	20	BDCD	
CCc1cccc(CN[C@H](C)C(=O)OC)c1O	691502313	BYJQLYIARHRFPU-SECBINFHSA-N	237.299	1.606	10	20	BDCD	
CN1CC[C@@]2(CCN(Cc3ccccc3O)C2)C1	292865473	VUMHBBWDSLANHH-OAHLLOKOSA-N	246.354	1.920	10	20	BDCD	
C[C@H](N)CN(C)Cc1c(O)cccc1Cl	309052958	QWNWNEWMQKKWDT-QMMMGPOBSA-N	228.723	1.825	10	20	BDCD	
COc1cccc(CNCc2cocn2)c1O	397988476	VUNVIYNDRVBGHN-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
C[C@H]1CCCN1C(=O)Cc1ccc(N)cc1	37909590	DVXQKHUSPWDCJD-JTQLQIEISA-N	218.300	1.822	10	20	BDCD	
Cc1cc(C(=O)NCc2ccccc2O)on1	133770886	KNEIDJCNXZBDTI-UHFFFAOYSA-N	232.239	1.619	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)[C@@H]1CO	191187227	SJHXNKMPUKVEMC-IUODEOHRSA-N	248.370	1.955	10	20	BDCD	
C[C@@H](CO)CN[C@H]1CCc2cccc(O)c21	295782694	AZVWVETYNIOKNZ-KOLCDFICSA-N	221.300	1.598	10	20	BDCD	
Cc1cccc(CN2CC(CC(N)=O)C2)c1O	297389802	KKFGNFVOWXPGMF-UHFFFAOYSA-N	234.299	1.008	10	20	BDCD	
CO[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1	732285609	KBSAMOWTBCVMIW-SECBINFHSA-N	241.312	1.705	10	20	BDCD	
O=C(NC1(CCO)CC1)c1cc(O)cs1	832831073	PDDHNRVMHCBTHX-UHFFFAOYSA-N	227.285	1.099	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H]2CO)cc1C	902629463	DRGJIBYZUYPCJL-GFCCVEGCSA-N	221.300	1.576	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@@H]2CNC[C@@H]21	841026422	BEMROARJHZPSSO-PWSUYJOCSA-N	248.326	1.195	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H](O)C[C@H]2C)c1	788270954	XPABBELVVIWMFU-KOLCDFICSA-N	237.299	1.356	10	20	BDCD	
C[C@@H]1C[C@H](NCc2ccccc2O)CCN1C	90721237	ULPUYZMYDUJNPC-DGCLKSJQSA-N	234.343	1.965	10	20	BDCD	
CC[C@H](NCc1ccc(C)cc1O)C(=O)O	1603959599	ZPKGHWFKXIMPOA-JTQLQIEISA-N	223.272	1.653	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@@H](C)C(=O)O	820870937	JIXCSWWFPLQPFI-QMMMGPOBSA-N	239.271	1.306	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCCO1	136335172	CXDUQGSKARPVPW-NSHDSACASA-N	221.256	1.187	10	20	BDCD	
C[C@@H](O)CCCNCc1ccc2c(c1)CCO2	227963348	HNCBLSYHPIUVBG-LLVKDONJSA-N	235.327	1.872	10	20	BDCD	
C[C@H](NC[C@@H](C)N)c1cc(F)ccc1O	817972762	OIOFJEYESTZWBM-SFYZADRCSA-N	212.268	1.529	10	20	BDCD	
CC[C@H](O)CNCc1ccc(N(C)C)cc1C	819077705	NLRAVTNNFRVQPY-AWEZNQCLSA-N	236.359	1.922	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@@H]1CCNC1)CC2	817944608	IAOHRXDULMPLMM-MNOVXSKESA-N	218.300	1.331	10	20	BDCD	
Cn1cc(NC(=O)c2cc(O)cs2)cn1	732271682	OPPQRRIKHQXFHB-UHFFFAOYSA-N	223.257	1.440	10	20	BDCD	
NC[C@@H]1CC[C@@H](NCc2cccc(F)c2O)C1	841084533	KHGCNHVDCVFCOF-MWLCHTKSSA-N	238.306	1.748	10	20	BDCD	
Cc1oncc1C(=O)N1CC(N=[N+]=[N-])C1	409424586	WPSKHOBWWMIBLT-UHFFFAOYSA-N	207.193	1.118	10	20	BDCD	
CC1(N)CCN(Cc2cc(F)ccc2O)CC1	707673767	NJVRIUUNCXLFLX-UHFFFAOYSA-N	238.306	1.845	10	20	BDCD	
Oc1ccccc1CNCCCN1CCCC1	20128980	ZRLWVVADXHBHAZ-UHFFFAOYSA-N	234.343	1.968	10	20	BDCD	
C[C@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)CO1	402046776	NPJIFKLIIYINPZ-CABZTGNLSA-N	234.299	1.105	10	20	BDCD	
C[C@@H]1OCC[C@]1(C)NC(=O)Nc1ccc(N)cc1	300561380	BSSTUCMMGFMUNW-ZANVPECISA-N	249.314	1.958	10	20	BDCD	
Cc1cc(NC(=O)c2cccc(O)c2O)[nH]n1	126646683	GRHOLUNMYQSLJM-UHFFFAOYSA-N	233.227	1.382	10	20	BDCD	
COC(=O)CSc1ncc(C(=O)O)s1	379519760	BXERQXXLAZVAPO-UHFFFAOYSA-N	233.270	1.106	10	20	BDCD	
COc1ccc(N(C)C[C@H](C)O)c(OC)c1	49820092	WLILNYYFSQHNRN-VIFPVBQESA-N	225.288	1.521	10	20	BDCD	
COC[C@@H](CNCc1cc(C)ccc1O)OC	227704620	HKYSVKLKNSHMFR-GFCCVEGCSA-N	239.315	1.452	10	20	BDCD	
Cc1nnc(Cc2ccc(N)cc2)n1C	42013817	CPJMMONFMQDGRM-UHFFFAOYSA-N	202.261	1.297	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](C)OC)c1	191204764	GUQZTYYIHCMZGT-VIFPVBQESA-N	225.288	1.525	10	20	BDCD	
C[C@H](NC/C=C/CO)c1ccc(F)cc1O	717573924	ARGBCTVUMZFPOI-HPOULIHZSA-N	225.263	1.730	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC(=O)C2CC2)c1	728984501	QQFQPKTZHBELJE-MRVPVSSYSA-N	235.283	1.988	10	20	BDCD	
C[C@H](N[C@@H](CO)CCF)c1ccccc1O	846207676	BCJSORLFVRDVDB-VHSXEESVSA-N	227.279	1.763	10	20	BDCD	
CCS(=O)(=O)CCSc1nccs1	118176037	BIRINRCUIOOAKB-UHFFFAOYSA-N	237.371	1.670	10	20	BDCD	
C[C@H](C(=O)N[C@H](C)c1ccccc1O)[C@@H](C)N	870988339	MTFFTBCUXMCUJH-IVZWLZJFSA-N	236.315	1.553	10	20	BDCD	
Cc1cccc(CN2C[C@H](C)[C@@H](O)C2)c1O	897681624	XSTYFWGMVUACMM-JQWIXIFHSA-N	221.300	1.513	10	20	BDCD	
COc1cc(C)cc(CNCc2ccon2)c1O	894325834	ZAAZDAHXGVRJTD-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
CC[C@@H](N[C@H]1CC(=O)N(C)C1)c1ccccc1O	274859948	CQOUTCQKYXWLAW-CMPLNLGQSA-N	248.326	1.664	10	20	BDCD	
CN(C)c1ccc(CNCC(C)(C)CO)cc1	126350220	WVTHPQGCQURHDH-UHFFFAOYSA-N	236.359	1.861	10	20	BDCD	
CC1(NCc2cc3c(cc2O)OCO3)CC1	124445398	UODASGMXLCCCEI-UHFFFAOYSA-N	221.256	1.763	10	20	BDCD	
NCC[C@@H]1CCCN(Cc2ccccc2O)C1	70169760	YVGDPDCQHZNYIB-LBPRGKRZSA-N	234.343	1.953	10	20	BDCD	
Cn1cc(NCc2cc(F)ccc2O)cn1	226590887	ZAJAMPZJYMMTRN-UHFFFAOYSA-N	221.235	1.877	10	20	BDCD	
CC(C)NC(=O)c1c(F)ccc(O)c1O	276718798	RXQGKFPIXYSKSY-UHFFFAOYSA-N	213.208	1.375	10	20	BDCD	
C[C@H](N[C@H]1CCNC1)c1ccccc1O	817944563	GZWQSMVUSHXFHV-UWVGGRQHSA-N	206.289	1.405	10	20	BDCD	
COc1cccc(CNC(=O)c2cnc[nH]2)c1O	729859336	PFXWAUGDSWPTDR-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
O=C(NCc1cocn1)c1cc(O)cs1	732290124	PQZTUWPJDJJKPM-UHFFFAOYSA-N	224.241	1.372	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@H]1C[C@@H]1C1CC1	910945810	ZGYIAGDRAVSBMB-NEPJUHHUSA-N	247.294	1.760	10	20	BDCD	
Cc1cccc(O)c1CN1CCC[C@H](C(N)=O)C1	876511360	GJFVXAIJRKAFJK-NSHDSACASA-N	248.326	1.398	10	20	BDCD	
CNC[C@@H](C)CNCc1cccc(F)c1O	1117953979	VWUHJIDXGLIRLE-SECBINFHSA-N	226.295	1.476	10	20	BDCD	
CCc1cccc(CN[C@H](C)C(=O)O)c1O	691468367	VKCRWDOWRBKMHB-MRVPVSSYSA-N	223.272	1.517	10	20	BDCD	
Nc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3)cc1	1334754290	OMTCLFZIVSLVRF-KGLIPLIRSA-N	231.343	1.595	10	20	BDCD	
C[C@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1	37257682	CZLVRXCMSXZNIW-QWRGUYRKSA-N	222.332	1.784	10	20	BDCD	
C[C@H](NC(=O)c1cccc(O)c1O)C(F)(F)F	288757422	ZTTJPGGKCXPSNK-YFKPBYRVSA-N	249.188	1.778	10	20	BDCD	
Cc1cc(C)c([C@H](C)NCCO)c(O)c1	293916136	XDVKWMQMQOXIMD-JTQLQIEISA-N	209.289	1.652	10	20	BDCD	
CCN(CC1OCCO1)c1ccc(OC)cc1	272042464	GBASNJRRDOZRRR-UHFFFAOYSA-N	237.299	1.894	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC/C=C\CO)c1	717544770	CEHAJSXPMHGJDA-XOULXFPDSA-N	237.299	1.600	10	20	BDCD	
Cc1ccc(O)c(CNCCCON)c1	904458394	XGDOFWIGUDSYHD-UHFFFAOYSA-N	210.277	1.071	10	20	BDCD	
CC[C@@H](C)C(=O)NCc1ccc(O)cc1O	910952520	WOOLXIGTVVYWTE-MRVPVSSYSA-N	223.272	1.760	10	20	BDCD	
Oc1ccc(F)cc1CNCCCNC1CC1	841091593	BGJDOHXKVSAOAR-UHFFFAOYSA-N	238.306	1.763	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](N)C2CC2)c1	841048927	GWACTEOHJBZDMK-GFCCVEGCSA-N	220.316	1.528	10	20	BDCD	
CC[C@@H](COC(=O)c1cccc(O)c1O)OC	842090662	FDHFNWQTSFGINI-QMMMGPOBSA-N	240.255	1.680	10	20	BDCD	
CCCC(=O)COC(=O)c1cccc(O)c1O	758580212	JINKNBLJDDWBSV-UHFFFAOYSA-N	238.239	1.624	10	20	BDCD	
CCO[C@H](C)C(=O)NCc1cc(C)ccc1O	862760793	WDFSALCWANFFAU-SNVBAGLBSA-N	237.299	1.742	10	20	BDCD	
CC(C)C[C@H](N)CC(=O)NCc1ccc(N)cc1	1122540994	YHDYQIULJLKEJR-ZDUSSCGKSA-N	249.358	1.649	10	20	BDCD	
CCc1cccc(CN2CCOCC2)c1O	692107516	UGINKNHFABPNPM-UHFFFAOYSA-N	221.300	1.787	10	20	BDCD	
CNC(=O)CCN(C)Cc1ccc(N(C)C)cc1	193840317	ZISAMTZQBFMQDP-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
CCc1cccc(CN[C@@H](C)C(=O)OC)c1O	691502315	BYJQLYIARHRFPU-VIFPVBQESA-N	237.299	1.606	10	20	BDCD	
C[C@@H]1NCCC[C@@H]1NCc1ccc(N)cc1	1336286232	PNUBGHFTNIZYNH-GWCFXTLKSA-N	219.332	1.499	10	20	BDCD	
C/C=C/C(=O)NCc1ccc(O)c(O)c1	169205748	OCVFISJOOCQBBA-NSCUHMNNSA-N	207.229	1.290	10	20	BDCD	
Nc1ccc(CCNC(=O)C[C@H]2CCCN2)cc1	152572223	MTKVOLPUOSCSLA-CYBMUJFWSA-N	247.342	1.070	10	20	BDCD	
C[C@H]1NCC[C@@H]1NCc1ccc2c(c1)CCO2	1579505329	VVITYERWIWGCFJ-MFKMUULPSA-N	232.327	1.462	10	20	BDCD	
O=S(=O)(Nc1ccc(O)cc1)N1CCCC1	20256164	NRQKZCILUXATLD-UHFFFAOYSA-N	242.300	1.145	10	20	BDCD	
CN1C[C@H](N(C)Cc2ccccc2O)CCC1=O	862428999	ZIUWNUDJQDSKQT-GFCCVEGCSA-N	248.326	1.445	10	20	BDCD	
COC(=O)[C@@H](F)CSc1nccs1	133253120	BHTYDHOGIBYRBO-YFKPBYRVSA-N	221.278	1.746	10	20	BDCD	
C[C@H](NCc1cnn(C)c1)c1ccccc1O	41158892	JNNZPKUEDXYIRA-JTQLQIEISA-N	231.299	1.977	10	20	BDCD	
CO[C@H](C)CNCc1cc(F)ccc1O	191204963	JZFJEBNIGVOGFO-MRVPVSSYSA-N	213.252	1.656	10	20	BDCD	
COc1ccc(O)c(CNCc2ccno2)c1	231881955	ISKQXZKMIJHMBJ-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
Nc1ccc(CCN[C@H]2CCC[C@H](N)C2)cc1	848714489	CACFCXXDWSPVOR-KBPBESRZSA-N	233.359	1.671	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@](F)(CO)C1	877505021	WONZMQHLNZWZFK-ZDUSSCGKSA-N	239.290	1.607	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@](C)(O)C(F)F	886064865	KDPAYUFCLGENJN-GFCCVEGCSA-N	245.269	1.840	10	20	BDCD	
COc1cc(C)cc(CN(C)[C@H](C)CO)c1O	894770147	LVFBXXATRBGMHY-SNVBAGLBSA-N	239.315	1.522	10	20	BDCD	
COc1cccc(CN(C)[C@H](C)C(=O)O)c1O	86756462	ZIABDUVRLVYGDJ-MRVPVSSYSA-N	239.271	1.306	10	20	BDCD	
Cc1cc(Sc2nccs2)nc(CO)n1	1321101385	PRIBJJKFEKAJRR-UHFFFAOYSA-N	239.325	1.885	10	20	BDCD	
CO[C@@H](C)CNCc1cc2c(cc1O)OCO2	191208351	PYIHIPXTZDBWOK-QMMMGPOBSA-N	239.271	1.245	10	20	BDCD	
C[C@@H](NCc1ccccc1O)[C@H]1CCCNC1	699704006	YUORTUJPCBFGQL-NEPJUHHUSA-N	234.343	1.870	10	20	BDCD	
COc1cccc(O)c1CNCCC[C@H](C)O	788524828	VQPLOHZJKRAACG-JTQLQIEISA-N	239.315	1.651	10	20	BDCD	
CC(C)(CCN)NC(=O)Cc1ccc(N)cc1	843501903	STBRNMJLKCGDLY-UHFFFAOYSA-N	235.331	1.055	10	20	BDCD	
CC[C@H](N[C@H]1C[C@H](O)C1)c1ccccc1O	850579044	RFOIFYXRJDVRLC-NHCYSSNCSA-N	221.300	1.956	10	20	BDCD	
CCOc1cccc(CNCCCO)c1O	20187968	WAGABYNOQJLGLK-UHFFFAOYSA-N	225.288	1.263	10	20	BDCD	
CC(=O)C(=O)COC(=O)CCc1cccs1	808489637	BPWSGKLMOJQLHF-UHFFFAOYSA-N	240.280	1.382	10	20	BDCD	
C[C@H](O)CN(Cc1ccccc1O)CC(F)F	825098701	MMNDIWHGXMCKJT-VIFPVBQESA-N	245.269	1.840	10	20	BDCD	
Cc1cccc(CN2CCC[C@H](N)C2)c1O	843043721	FBFXYOVHQGEWQD-LBPRGKRZSA-N	220.316	1.624	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CO[C@@H](C)C2)c1	862757039	FEBJAMIIVWNLPS-CMPLNLGQSA-N	249.310	1.742	10	20	BDCD	
Cc1ccc(CNCc2cncn2C)c(O)c1	877539195	LAIQVLAMZAXJRR-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
Nc1ccc(CNC(=O)N[C@@H]2C=CCC2)cc1	1353438562	PTFYZRMFONOESV-GFCCVEGCSA-N	231.299	1.787	10	20	BDCD	
C[C@H](NCc1ccc(N2CC=CC2)cc1)[C@@H](C)O	1327979783	XMCSHSNTDMJVAT-QWHCGFSZSA-N	246.354	1.922	10	20	BDCD	
COCCOC1CN(c2ccc(N)cc2)C1	95908475	AKYCJCBDSVFVHM-UHFFFAOYSA-N	222.288	1.120	10	20	BDCD	
CC[C@@H](NCc1cc(F)cc(F)c1O)[C@@H](C)O	708535840	QVFBBKVLGHYADE-RDDDGLTNSA-N	245.269	1.919	10	20	BDCD	
NCC[C@H](NCc1ccc(N)cc1)C(F)F	1336284774	CSISPTQEWZPZAP-JTQLQIEISA-N	229.274	1.341	10	20	BDCD	
CC(C)C(=O)NCc1ccc(O)c(O)c1	158863160	PKCYTKVMMHCWSB-UHFFFAOYSA-N	209.245	1.370	10	20	BDCD	
CO[C@H](C)CC(=O)Nc1ccc(N)cc1	160457626	LALXYYZUCCKDCJ-MRVPVSSYSA-N	208.261	1.632	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@@H]2COC[C@H]2O)c1	296052682	VGJXPMAPCXAGSA-UFGOTCBOSA-N	237.299	1.111	10	20	BDCD	
Oc1ccccc1CNc1ncccn1	67447984	LILSBUJKGOEAKR-UHFFFAOYSA-N	201.229	1.794	10	20	BDCD	
CN(CC(F)(F)F)C(=O)c1cccc(O)c1O	126272978	OCVROHODRYCNMK-UHFFFAOYSA-N	249.188	1.732	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H](O)C2)cc1C	128081070	KFFUYWYGXXVWIX-GFCCVEGCSA-N	221.300	1.576	10	20	BDCD	
Cc1ccc(O)c(CN(C)Cc2nncn2C)c1	290257112	WFOWFASWAHJTNO-UHFFFAOYSA-N	246.314	1.461	10	20	BDCD	
CC[C@@H](CO)C(=O)N[C@H](C)c1ccccc1O	827940329	ASIVTAWVVDNRIL-ZJUUUORDSA-N	237.299	1.588	10	20	BDCD	
CC[C@H](NCCCON)c1ccccc1O	902425888	OSBMAPAVTITKDN-NSHDSACASA-N	224.304	1.713	10	20	BDCD	
CCC(=O)[C@H](C)OC(=O)c1cc(O)cs1	732353125	DNGNEMGLGQSEIS-LURJTMIESA-N	228.269	1.978	10	20	BDCD	
Nc1ccc(CCN[C@@H]2CCC[C@@H](N)C2)cc1	848714492	CACFCXXDWSPVOR-ZIAGYGMSSA-N	233.359	1.671	10	20	BDCD	
CCC[C@@H](C)NC(=O)C(=O)Nc1ccc(N)cc1	840999757	OZJJHIPUNUQSJP-SECBINFHSA-N	249.314	1.512	10	20	BDCD	
Cc1ccc(CN[C@@H]2C[C@@H](O)C2(C)C)c(O)c1	877430718	POQAZVNFQOALQQ-CHWSQXEVSA-N	235.327	1.950	10	20	BDCD	
Cc1ccc(CN2C[C@@H](O)C[C@@H]2C)c(O)c1	877468070	YCMCPUSIMCDOAG-JQWIXIFHSA-N	221.300	1.656	10	20	BDCD	
CO[C@@H]1CN(Cc2ccc(C)cc2O)CCO1	895961832	FNGBSBHYXDYFGZ-ZDUSSCGKSA-N	237.299	1.505	10	20	BDCD	
Cc1cnc(NC(=O)c2cccc(O)c2O)[nH]1	790885787	VVVHRMGZAODQJM-UHFFFAOYSA-N	233.227	1.382	10	20	BDCD	
[N-]=[N+]=NCCn1nc(C(F)(F)F)cc1N	409437288	FSGJQLBAFDNRIJ-UHFFFAOYSA-N	220.158	1.794	10	20	BDCD	
Nc1ccc(N2CCC3(CC2)COC3)cc1	224830475	SAQSBWIJIGOQMT-UHFFFAOYSA-N	218.300	1.886	10	20	BDCD	
COC[C@@H](O)CCNCc1cccc(C)c1O	224932967	BWHUPOHPEJYIIJ-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
O=C(CC1CCC1)NCc1ccc(O)cc1O	1335019455	SAKRKOIWTDKROC-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
Nc1ccc(CNC(=O)NC(CF)CF)cc1	1338794339	YVOWZDXNYRWQAP-UHFFFAOYSA-N	243.257	1.376	10	20	BDCD	
C[C@H](CC(=O)O)C(=O)N1Cc2cccc(O)c2C1	1604094260	MIPJTNOYFLOCJW-MRVPVSSYSA-N	249.266	1.345	10	20	BDCD	
c1cc2c(cc1CNC[C@@H]1CCCN1)CCCO2	258919087	OGDWVXKKFOTRQL-AWEZNQCLSA-N	246.354	1.853	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@H](C)C(=O)O	162956396	ORLUZOBJTMFWEP-IUCAKERBSA-N	223.272	1.591	10	20	BDCD	
CCn1ncnc1CN(C)c1ccc(OC)cc1	844354851	ITRIOYMEXRYJHU-UHFFFAOYSA-N	246.314	1.943	10	20	BDCD	
C[C@H](NC[C@H]1CCCN1)c1ccccc1O	817953308	ZTIDAOBFFIIORT-WDEREUQCSA-N	220.316	1.795	10	20	BDCD	
C[C@@]1(CN)CCN(C(=O)Cc2ccc(N)cc2)C1	834723139	RUXMQUKZXRFNRL-AWEZNQCLSA-N	247.342	1.009	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCNC2(C)C)cc1	841087849	XCBIIQKPFLNTMH-CQSZACIVSA-N	247.386	1.983	10	20	BDCD	
Cc1cccc(CN[C@@H]2CC[C@H](CN)C2)c1O	841084091	FZVVQSXDDKLBTG-WCQYABFASA-N	234.343	1.918	10	20	BDCD	
CN1CC[C@@H](N[C@@H]2CCc3cccc(O)c32)C1	380211695	HYELYVPSKVIFFA-VXGBXAGGSA-N	232.327	1.673	10	20	BDCD	
OC[C@@H]1CCN(Cc2ccccc2O)C1	128551773	AHJKDMGXUJONRF-SNVBAGLBSA-N	207.273	1.206	10	20	BDCD	
CS[C@H](C)C(=O)Nc1ccc(N)cc1	38063525	DUWCBGKROFCPEB-SSDOTTSWSA-N	210.302	1.959	10	20	BDCD	
Nc1ccc(CCNC(=O)C2CCC2)cc1	40675574	VTWRCCGYBJTYNK-UHFFFAOYSA-N	218.300	1.728	10	20	BDCD	
CCN(CC(=O)O)Cc1cccc(OC)c1O	86775058	JBXQKGHMEZYZRM-UHFFFAOYSA-N	239.271	1.307	10	20	BDCD	
COC(=O)[C@@H](NCc1cc(C)ccc1O)C1CC1	276451723	JYMATRFIKQBKKL-ZDUSSCGKSA-N	249.310	1.742	10	20	BDCD	
CC1(C)CN(Cc2ccccc2O)C[C@@H]1O	280482207	OCUNZFHKZINSDQ-LBPRGKRZSA-N	221.300	1.595	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1cc(C)oc1C	808486671	WJWZYXRXRSTTDG-UHFFFAOYSA-N	224.212	1.211	10	20	BDCD	
CS[C@@H](C)C(=O)NCc1ccccc1O	299581550	RDHLFKXRGFOWBV-QMMMGPOBSA-N	225.313	1.760	10	20	BDCD	
COC[C@@H](C)CNC(=O)c1cc(O)cs1	732277621	OXOKCZCCCGNVTQ-ZETCQYMHSA-N	229.301	1.466	10	20	BDCD	
CCn1cc(C(=O)NCc2ccccc2O)cn1	734015563	MXNVIMROETXQTH-UHFFFAOYSA-N	245.282	1.539	10	20	BDCD	
Nc1ccc(Cc2nc([C@@H]3CCCN3)no2)cc1	842644277	UMDVFIUNBUWNPY-NSHDSACASA-N	244.298	1.667	10	20	BDCD	
N[C@H](CNCc1cc(F)ccc1O)C1CC1	841049303	JPBXUQKSCZBVGV-LLVKDONJSA-N	224.279	1.358	10	20	BDCD	
NC1(CNCc2ccc3c(c2)CCO3)CCC1	841050499	GVGYRKGWUQCHSK-UHFFFAOYSA-N	232.327	1.593	10	20	BDCD	
Oc1ccccc1CN1C[C@@H]2CC[C@H](C1)N2	873215439	AJKAGDXBRIRWQG-TXEJJXNPSA-N	218.300	1.328	10	20	BDCD	
Cc1ccc(CN2CC[C@@H]([C@@H](C)O)C2)c(O)c1	877183263	BECMAKMANVUXGM-VXGBXAGGSA-N	235.327	1.903	10	20	BDCD	
COC(=O)C1(CNCc2c(C)cccc2O)CC1	877425126	ZRYACHBNKJUFBH-UHFFFAOYSA-N	249.310	1.743	10	20	BDCD	
CNC(=S)N[C@@H](C)c1ccc(N(C)C)cc1	774256867	OUYLMFIQPSMQFG-VIFPVBQESA-N	237.372	1.908	10	20	BDCD	
Oc1cccc(Cl)c1CNC[C@@H]1COCO1	894873981	UQAZLSUMFZIKIP-MRVPVSSYSA-N	243.690	1.508	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](CO)C1CC1	894274112	SHNXVVVXTFWTKD-LBPRGKRZSA-N	221.300	1.561	10	20	BDCD	
C[C@H]1CO[C@H](C)CN1Cc1ccc(N)cc1	223160612	VEUCBBYBKGZDDZ-WDEREUQCSA-N	220.316	1.878	10	20	BDCD	
CCNC(=O)CSc1ncc(C(=O)O)s1	309028010	ZIFKYOJITMXASS-UHFFFAOYSA-N	246.313	1.070	10	20	BDCD	
Nc1ccc(CC(=O)NCC2CC=CC2)cc1	717300020	SPZJZVRXOFVZDR-UHFFFAOYSA-N	230.311	1.894	10	20	BDCD	
C[C@@H](NCCO)c1cc(F)cc(F)c1O	134911107	OLNUCSKENBTNJS-ZCFIWIBFSA-N	217.215	1.313	10	20	BDCD	
Cn1ccc(C(=O)NCc2ccccc2O)n1	218198586	HTDOEQIANFZYDX-UHFFFAOYSA-N	231.255	1.056	10	20	BDCD	
C[C@@H](CF)NCc1cc2c(cc1O)OCO2	288371565	FCTRJWHGTYOXRS-ZETCQYMHSA-N	227.235	1.569	10	20	BDCD	
COC[C@@H](CO)NCc1cc(Cl)ccc1O	234867316	YZOPTCRMNPQCSM-SNVBAGLBSA-N	245.706	1.143	10	20	BDCD	
N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3O)C[C@@H]21	230125956	QWWVLFDTKNSXHH-KWCYVHTRSA-N	246.354	1.951	10	20	BDCD	
CN(CC(=O)O)Cc1cc(Cl)cc(F)c1O	820569090	KGYCBLXLVADWAG-UHFFFAOYSA-N	247.653	1.701	10	20	BDCD	
CC[C@@](C)(O)Cc1cn(-c2ccc(N)cc2)nn1	849134256	ABDBSFVNVCRLJS-CYBMUJFWSA-N	246.314	1.553	10	20	BDCD	
CSCCNC(=S)NCc1cccn1C	752761244	RTLQSBFPDHBLST-UHFFFAOYSA-N	243.401	1.352	10	20	BDCD	
Cc1ccc(CNCC2(CC(N)=O)CC2)c(O)c1	877595269	WUONFYUEIHZPCG-UHFFFAOYSA-N	248.326	1.446	10	20	BDCD	
CC[C@H](NC)C(=O)N(C)c1ccc(N)cc1	877074167	APMFCCULQPHAKX-NSHDSACASA-N	221.304	1.230	10	20	BDCD	
Cc1ccc(O)c(CNCc2ccon2)c1	86452630	FKOYYAOBQHKPLQ-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
C[C@H]1CN(c2ccc(N)cc2)C[C@@H]1CO	409433733	ZBTSKTOTORIABK-VHSXEESVSA-N	206.289	1.333	10	20	BDCD	
OC[C@H](CC(F)F)NCc1cc(F)ccc1O	717712905	KQNCLTIOOHRVGU-VIFPVBQESA-N	249.232	1.637	10	20	BDCD	
CCNC(=O)CNCc1ccc(OC)c(C)c1	35052684	LEHJCIAINCMDRD-UHFFFAOYSA-N	236.315	1.229	10	20	BDCD	
CCN1CCc2cc(CNCCC(=O)O)ccc21	1776877269	GMFLZFCNAOALNE-UHFFFAOYSA-N	248.326	1.633	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1CO[C@H](C)C1	842773587	BLKJKFCFVAMJDV-NXEZZACHSA-N	237.299	1.668	10	20	BDCD	
NC[C@@H]1CC[C@@H](NCc2ccc3c(c2)CCO3)C1	841084147	HKDNGDCPOISSTM-BXUZGUMPSA-N	246.354	1.839	10	20	BDCD	
CCN1C[C@H](C(=O)Nc2ccc(N)cc2)CC1=O	160449963	KLKXNEVLNZVYLZ-SECBINFHSA-N	247.298	1.076	10	20	BDCD	
CNC(=O)C[C@H](C)N[C@@H](C)c1ccccc1O	322758377	FTQANWNWKHFYRF-UWVGGRQHSA-N	236.315	1.567	10	20	BDCD	
CC(=O)N[C@@H]1CCN(Cc2cccc(C)c2O)C1	228356548	QNTWTRFGGPOYJR-CYBMUJFWSA-N	248.326	1.411	10	20	BDCD	
CC[C@H](CCO)NCc1cc(C)ccc1O	77452978	PHLJZXPXXDQSRB-GFCCVEGCSA-N	223.316	1.951	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CCC[C@@H]2CO)cc1	226352255	DFJCFRHIHQFJIB-DGCLKSJQSA-N	248.326	1.089	10	20	BDCD	
Cc1cccc(CN[C@H](C)CCO)c1O	133551425	HJNDEJBLOWGZMT-SNVBAGLBSA-N	209.289	1.561	10	20	BDCD	
C[C@H](CO)NCc1ccc2c(c1)CCCO2	82538507	LUXUAIQORNEFKE-SNVBAGLBSA-N	221.300	1.482	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(C)cc1O	808484263	NNUPTBOHISWCGZ-UHFFFAOYSA-N	236.223	1.016	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccccc1Cl	808488363	FDWDWEZLZGXDTP-UHFFFAOYSA-N	240.642	1.655	10	20	BDCD	
O=C(O)CCC(=O)NCc1c(O)cccc1F	902854233	ZJSHGMHQGAJTJP-UHFFFAOYSA-N	241.218	1.012	10	20	BDCD	
C[C@@H](NCC1(N)CC1)c1ccc(N(C)C)cc1	902417545	SOSLMENBZHGGKN-LLVKDONJSA-N	233.359	1.895	10	20	BDCD	
CN(C)c1ccc(CNC2CC(N)C2)cc1F	906510162	OOGUHHMDAUQHRL-UHFFFAOYSA-N	237.322	1.471	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1=COCC1	910954205	JUOIWZIGLNLTPC-UHFFFAOYSA-N	235.239	1.018	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2C[C@]23CCCNC3)cc1	848393237	WADVVWJOSWXJOS-JSGCOSHPSA-N	245.326	1.597	10	20	BDCD	
CC[C@@H](NC(=O)c1cc(O)cs1)C(C)(C)O	854662510	CULMEXGYUJXPIP-SECBINFHSA-N	243.328	1.733	10	20	BDCD	
CONC(=O)N[C@H](C)c1ccc(N(C)C)cc1	773610040	BTNBBHVSPVXAJC-SECBINFHSA-N	237.303	1.674	10	20	BDCD	
C[C@@](O)(CNCc1ccc2c(c1)CCO2)C1CC1	386593134	DXFUHTJGURBGIX-OAHLLOKOSA-N	247.338	1.872	10	20	BDCD	
O=C1OCC[C@@H]1NCc1ccc2c(c1)CCCO2	895812199	OAWMJARXNNIATB-LBPRGKRZSA-N	247.294	1.417	10	20	BDCD	
Cc1ccc(CNCC[C@H](O)C2CC2)c(O)c1	898195703	YWPMNKBALSYCGN-ZDUSSCGKSA-N	235.327	1.951	10	20	BDCD	
CN1CCN(Cc2ccc(N)cc2)C(C)(C)C1=O	94865345	QBNAGSHPCYLJCO-UHFFFAOYSA-N	247.342	1.321	10	20	BDCD	
Cc1ccc(O)c(CN(C)C[C@@H](C)N)c1	309054496	SCFWGULZULCIJU-SNVBAGLBSA-N	208.305	1.480	10	20	BDCD	
COCC1(NCc2cccc(C)c2O)CC1	309671330	WAUIGLQOBBLASU-UHFFFAOYSA-N	221.300	1.969	10	20	BDCD	
CCc1cccc(CN(CC)CC(N)=O)c1O	709322425	YMUZBYRZOAILHZ-UHFFFAOYSA-N	236.315	1.262	10	20	BDCD	
C[C@H](O)C1(NCc2ccccc2O)CC1	827580546	UMBCZLKRPCNWKJ-VIFPVBQESA-N	207.273	1.395	10	20	BDCD	
CCOCCNCc1c(C)cccc1O	877146264	QQKFJRDGYSTFQU-UHFFFAOYSA-N	209.289	1.827	10	20	BDCD	
CCN1CC(=O)N[C@H]1c1ccc(N(C)C)cc1	189888019	IVIXEXVIPYIZHA-CYBMUJFWSA-N	233.315	1.203	10	20	BDCD	
CC[C@H]1C(=O)NCCN1Cc1cccc(C)c1O	180036770	TZLNVVDFGSZKFD-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
CCOc1cccc(CNC[C@H](C)OC)c1O	191206120	GTPQMNBOROJKHG-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
CCN(CC(=O)N1CCC1)c1ccc(OC)cc1	299382218	ODNBAZCRXGYENN-UHFFFAOYSA-N	248.326	1.754	10	20	BDCD	
C[C@@H](CF)NC(=O)c1c(F)ccc(O)c1O	295271471	DYVWVANDWJKYFA-YFKPBYRVSA-N	231.198	1.325	10	20	BDCD	
C[C@H](NCCc1ccc(N)cc1)c1cnn(C)c1	817955789	HTLPIPUEQIHXPE-NSHDSACASA-N	244.342	1.896	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC[C@@H](C)N)c1	817973262	RXESBEBXFNSXGY-BDAKNGLRSA-N	224.304	1.399	10	20	BDCD	
C[C@@H]1CNCCN1Cc1cc(F)ccc1O	722393972	CNXVPUGWLJKLRA-SECBINFHSA-N	224.279	1.325	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)C[C@H](C)N)c1	843129851	SDSCVKFENJCSOT-UWVGGRQHSA-N	238.331	1.616	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3CNC[C@@H]3C2)c1O	775747937	PAXXTTJBRJZWOI-BETUJISGSA-N	232.327	1.352	10	20	BDCD	
CC(C)[C@](C)(O)C(=O)NCc1ccccc1O	771417043	JWAUMPLJZXDSFF-ZDUSSCGKSA-N	237.299	1.415	10	20	BDCD	
CCOC[C@@H]1CC(F)(F)CN1C(=O)CN=[N+]=[N-]	409428997	HDSVMMRCOZQJHK-ZETCQYMHSA-N	248.233	1.569	10	20	BDCD	
C[C@@H](CC(=O)O)NCc1ccc(N(C)C)cc1	738891142	NIYLFHZHMSIAAU-JTQLQIEISA-N	236.315	1.705	10	20	BDCD	
CCn1ncnc1CNCc1cccc(C)c1O	793345921	JFYNBZFJDDCHEA-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)CC(=O)O)c1	1605296536	JYEYKMNCZBRJOZ-SECBINFHSA-N	223.272	1.653	10	20	BDCD	
C[C@H](CC(N)=O)NCc1cccc(Cl)c1O	162705793	OOCJZEMIPIUDIB-SSDOTTSWSA-N	242.706	1.399	10	20	BDCD	
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(N)cc1	236815387	HQZJVUSMGLPOFJ-GFCCVEGCSA-N	247.298	1.218	10	20	BDCD	
Cn1ccc(CNCc2ccc3c(c2)CCO3)n1	112344925	YSWQHXBCZMZCIC-UHFFFAOYSA-N	243.310	1.645	10	20	BDCD	
C[C@H](O)CN(C)c1ccc2c(c1)OCO2	49814485	HDTSDEOZTUYTJN-QMMMGPOBSA-N	209.245	1.232	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](C)[C@@H]2CO)c1	191185899	LFMPQMBZVVSUBL-YPMHNXCESA-N	235.327	1.903	10	20	BDCD	
C[C@@H]1NCC[C@@H]1C(=O)Nc1ccc(N)cc1	832244145	LWHABRWHCIXCKS-KWQFWETISA-N	219.288	1.205	10	20	BDCD	
Oc1c(F)cccc1CNC1CCNCC1	841026506	FQZXJCUTMSISEO-UHFFFAOYSA-N	224.279	1.373	10	20	BDCD	
Nc1ccc(CCNC[C@@]23CNC[C@H]2C3)cc1	853245990	FSZUGBMKQXACRR-OCCSQVGLSA-N	231.343	1.010	10	20	BDCD	
CC(=O)N1CCN(Cc2c(C)cccc2O)CC1	876525220	GFBQDFNVGHNFOC-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
COC[C@H](CO)N[C@@H](C)c1c(O)cccc1F	886604922	GELUGBFLSDQFBL-IUCAKERBSA-N	243.278	1.189	10	20	BDCD	
COC[C@H](C)NC(=O)c1ccc(CN=[N+]=[N-])o1	1537962261	BHOHLLQSVKKGLQ-ZETCQYMHSA-N	238.247	1.855	10	20	BDCD	
O=C(NCc1ccccc1O)c1cnsn1	701169821	SWDHRFMMLSXHII-UHFFFAOYSA-N	235.268	1.174	10	20	BDCD	
[N-]=[N+]=NCCN1CCn2c(Cl)cnc2C1	409433949	NUQZSJDMQNVQEI-UHFFFAOYSA-N	226.671	1.662	10	20	BDCD	
CN[C@@H](C)CCNCc1cccc(F)c1O	1345105048	OYZGCCCCXPDCJS-VIFPVBQESA-N	226.295	1.619	10	20	BDCD	
CN(C(=O)[C@@H]1CCCCCN1)c1ccc(N)cc1	1352849746	MGUWZEWCXUZAEN-ZDUSSCGKSA-N	247.342	1.764	10	20	BDCD	
Cc1ccc(CN2CCC[C@H]2C(=O)O)c(O)c1	1607780375	BJSSWTSRALGPAZ-NSHDSACASA-N	235.283	1.750	10	20	BDCD	
COCCCC(=O)N(C)Cc1ccccc1O	298806983	SXYSRYSLRBCTGZ-UHFFFAOYSA-N	237.299	1.777	10	20	BDCD	
CO[C@@H](C)CCNC(=O)Nc1ccc(N)cc1	310325526	KONKLWSBXMJWAI-VIFPVBQESA-N	237.303	1.815	10	20	BDCD	
CNC(=O)C[C@@H](C)N[C@@H](C)c1ccccc1O	322758379	FTQANWNWKHFYRF-ZJUUUORDSA-N	236.315	1.567	10	20	BDCD	
CCN(CC)CCNC(=O)Cc1ccc(N)cc1	22221281	OFXMPBCARSOIMJ-UHFFFAOYSA-N	249.358	1.269	10	20	BDCD	
Oc1cccc2c1[C@H](NCC1CCNCC1)CC2	817941786	RRWVHZBFXUGTPC-CYBMUJFWSA-N	246.354	1.969	10	20	BDCD	
CN(C[C@@H]1CCOC1)C(=O)c1cc(O)cs1	749545741	WWLQBKZRVJEJJE-QMMMGPOBSA-N	241.312	1.562	10	20	BDCD	
C[C@@H]1OCC[C@H]1NCCc1ccc(N)cc1	841033805	BJOZTJLHIXCFEN-GXFFZTMASA-N	220.316	1.578	10	20	BDCD	
CCN(Cc1cc2c(cc1O)OC[C@H]2O)C1CC1	768440141	DIPUGXZTTGDGTK-CYBMUJFWSA-N	249.310	1.802	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C2(CO)CC2)c(O)c1	877624193	AGASRLYNDGJSJM-NSHDSACASA-N	235.327	1.951	10	20	BDCD	
COc1cc(C)cc(CN[C@@H](C)CCO)c1O	894284640	RQUOAELJMMKPJE-JTQLQIEISA-N	239.315	1.570	10	20	BDCD	
CC1(CNC(=O)NCc2ccc(N)cc2)CC1	1336051399	PVBCLUQDYNDWOF-UHFFFAOYSA-N	233.315	1.868	10	20	BDCD	
O=C(NCc1ccccc1O)N[C@@H]1C=CCC1	852509145	VESFGDZTGVSHMU-LLVKDONJSA-N	232.283	1.910	10	20	BDCD	
COc1ccc(CNCCN2CCC2)cc1C	697390506	OIMFBVCBTZFVFR-UHFFFAOYSA-N	234.343	1.799	10	20	BDCD	
Oc1ccc(Cl)cc1CNC[C@@H](O)C1CC1	70880916	RAIQJKRIBQUSSJ-GFCCVEGCSA-N	241.718	1.906	10	20	BDCD	
CC(C)Oc1ccc(N(C)CC(N)=O)cc1	191580522	JOMDNEOIJCIPJK-UHFFFAOYSA-N	222.288	1.395	10	20	BDCD	
COc1cccc(C(=O)OCC(=O)C(C)=O)c1	808487666	PQBHSGDXKOTTHK-UHFFFAOYSA-N	236.223	1.010	10	20	BDCD	
C[C@@H]1CCCN1C(=O)c1c(F)ccc(O)c1O	294857536	FZRRHMXFMULDDZ-SSDOTTSWSA-N	239.246	1.861	10	20	BDCD	
C[C@@H](CCN(C)C)NC(=O)c1cc(O)cs1	748362325	FCEQSGCLMOHSHS-QMMMGPOBSA-N	242.344	1.524	10	20	BDCD	
CCCN1CC(=O)N[C@H]1c1cccc(F)c1O	840825692	ZJDJTPIOJGYCQX-GFCCVEGCSA-N	238.262	1.372	10	20	BDCD	
C[C@H]1C[C@@H](NC(=O)c2cc(O)cs2)CCO1	770412788	WIDSQZNTGGLKHJ-YUMQZZPRSA-N	241.312	1.751	10	20	BDCD	
C[C@@H](NCCCO)c1c(O)cccc1F	886489883	UEBCKCWMPMJWJC-MRVPVSSYSA-N	213.252	1.564	10	20	BDCD	
[N-]=[N+]=NCC(=O)N(C1CC1)[C@H]1CCSC1	409426934	DFKIBHFSQOYDII-QMMMGPOBSA-N	226.305	1.793	10	20	BDCD	
C[C@@H]1CCCN1C(=O)NCc1ccc(N)cc1	1357792036	RSEMPOPVIWXROX-SNVBAGLBSA-N	233.315	1.963	10	20	BDCD	
O=C(O)[C@H](CF)NCc1ccc(Cl)cc1O	1608532609	FMPTVBGCQYPODX-QMMMGPOBSA-N	247.653	1.558	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H]2CCCCN2)cc1	131836663	GHLSLZKBCURNCB-ZDUSSCGKSA-N	247.342	1.070	10	20	BDCD	
Oc1cc2onc(CN3CCCC3)c2cc1O	147644741	VTVBWQVDWCQAMW-UHFFFAOYSA-N	234.255	1.835	10	20	BDCD	
CC(C)(C)OCC(=O)NCc1ccccc1O	165921042	VYMBLSOWPCKXPX-UHFFFAOYSA-N	237.299	1.824	10	20	BDCD	
CON(C)CCN[C@H](C)c1ccccc1O	850478634	DTBWSYNXGWRMKT-SNVBAGLBSA-N	224.304	1.536	10	20	BDCD	
OC[C@@H](NCc1ccc2c(c1)CCCO2)C1CC1	921744106	RMEWQFGVCVPZSL-CQSZACIVSA-N	247.338	1.872	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1CCC[C@@H]1O	305745872	OXXVDSISGAZFLD-JSGCOSHPSA-N	235.327	1.985	10	20	BDCD	
CC(C)[C@H](CO)CNCc1cc(F)ccc1O	394031190	CJLZEMSTTVPYAS-NSHDSACASA-N	241.306	1.885	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1CCC[C@@H]1CO	877575433	TZYHKBFZIQXAFS-DGCLKSJQSA-N	235.327	1.951	10	20	BDCD	
COc1ccc(CNCCCCN)cc1C	37715524	RZJRSWGQRJOREY-UHFFFAOYSA-N	222.332	1.832	10	20	BDCD	
CC1(NCc2ccc(N)cc2)CCOCC1	229908097	NFXHMWBJQOTSLT-UHFFFAOYSA-N	220.316	1.928	10	20	BDCD	
C[C@@H](OCC1CC1)C(=O)NCc1ccccc1O	748346523	KANAWQPLRSUAHT-SNVBAGLBSA-N	249.310	1.824	10	20	BDCD	
CCO[C@@H](C)C(=O)NCc1ccccc1O	748346434	XCOCGAJDYUZWFF-VIFPVBQESA-N	223.272	1.433	10	20	BDCD	
CN[C@H]1CCN(Cc2cc(C)c(C)cc2O)C1	843045797	WKJUASXXOAVTPX-ZDUSSCGKSA-N	234.343	1.803	10	20	BDCD	
COc1ccc(CN[C@@H](CN)C2CC2)cc1C	841027387	AOKURCHYOSPRMF-ZDUSSCGKSA-N	234.343	1.831	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1CC(=O)N(C)C1	876994750	MHTRMQQKCJGADV-SNVBAGLBSA-N	234.299	1.021	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](O)C2CC2)c1	71300245	JJYLVQHACNFNEI-CYBMUJFWSA-N	237.299	1.261	10	20	BDCD	
Cc1cccc(O)c1CN(C)CC(=O)NC1CC1	876549602	SEZHYMVVKIKPPF-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@@H]1F	1123669323	OVENCJRKZPNVLD-SFYZADRCSA-N	225.219	1.072	10	20	BDCD	
Nc1ccc(CNC(=O)N2CC[C@@H]3C[C@@H]3C2)cc1	1337070072	HPZGRQMQAPZOBV-VXGBXAGGSA-N	245.326	1.820	10	20	BDCD	
CC[C@@H](N[C@H]1CCc2cccc(O)c21)C(=O)O	1603915942	WQFNGKSKCPRUOR-ZJUUUORDSA-N	235.283	1.832	10	20	BDCD	
C[C@@H]1COC[C@H]1NC(=O)Nc1ccc(N)cc1	699776768	INXZNLNAGMICJF-LDYMZIIASA-N	235.287	1.425	10	20	BDCD	
COc1cccc(CN(C)[C@@H]2CCNC2)c1O	71309233	KYDFPZDDAAUKNY-LLVKDONJSA-N	236.315	1.195	10	20	BDCD	
CN(C)c1ccc(CN(CC(=O)O)C2CC2)cc1	76633882	HZWXHTLGMMBOID-UHFFFAOYSA-N	248.326	1.802	10	20	BDCD	
C[C@@H](CCCN)NCc1ccccc1O	380006970	LGRGVGAUFMJYMR-JTQLQIEISA-N	208.305	1.609	10	20	BDCD	
CC(C)(C)NC(=O)NCc1ccccc1O	130806527	HLIPDVLUJYBYNX-UHFFFAOYSA-N	222.288	1.990	10	20	BDCD	
C[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1	276586362	MHYVHWWQEANHPA-ZETCQYMHSA-N	239.246	1.719	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(C)c(C)c1	808489355	NMKCMSRZMVHJMZ-UHFFFAOYSA-N	234.251	1.618	10	20	BDCD	
CCO[C@@H](C)C(=O)N[C@H](C)c1ccccc1O	827930121	BVRGUAVFGUXPBK-ZJUUUORDSA-N	237.299	1.994	10	20	BDCD	
COc1cccc([C@H](C)NC[C@@H](C)O)c1O	846137990	QEOVCYYSVFFBJN-BDAKNGLRSA-N	225.288	1.432	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2[C@@H]3CNC[C@@H]32)cc1C	841077161	BRPXDXPHNIHWQM-IMRBUKKESA-N	232.327	1.316	10	20	BDCD	
Cc1ccc(CN(C)[C@H]2CCNC2=O)c(O)c1	876814218	DOJXMDZCHUAEQX-NSHDSACASA-N	234.299	1.021	10	20	BDCD	
CC[C@@H]1CN(Cc2c(C)cccc2O)C[C@@H]1O	876815175	NMDXWJLVJMEFJM-RISCZKNCSA-N	235.327	1.903	10	20	BDCD	
COc1cc(C)cc(CNCc2ccno2)c1O	894452890	MPPAOSFSVHEZKO-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
CCOC[C@H]1CN(C(=O)CN=[N+]=[N-])C[C@H]1C	409434688	QDIJWWIBZYPPDV-RKDXNWHRSA-N	226.280	1.428	10	20	BDCD	
CCN(C(=O)CN=[N+]=[N-])C1CCOCC1	409427855	FPISNJOVUAWIAK-UHFFFAOYSA-N	212.253	1.324	10	20	BDCD	
CC(C)(CO)NCc1cc(F)cc(F)c1O	708435129	AXXLTUFPIAPOBQ-UHFFFAOYSA-N	231.242	1.531	10	20	BDCD	
NCC1(CC(=O)NCc2ccc(N)cc2)CC1	1346210143	OOGPKEAGGPLKQE-UHFFFAOYSA-N	233.315	1.014	10	20	BDCD	
CNC[C@H](C)CNCc1cc(C)c(C)cc1O	1345100667	URPQJDUAEYIYCE-JTQLQIEISA-N	236.359	1.954	10	20	BDCD	
CC[C@@H](N[C@H]1C[C@H](O)C1)c1ccccc1O	850579043	RFOIFYXRJDVRLC-CKYFFXLPSA-N	221.300	1.956	10	20	BDCD	
C[C@H]1C[C@@H](NCc2ccc3c(c2)CCO3)CCN1	841062474	XDYVJAZUXKFROK-FZMZJTMJSA-N	246.354	1.852	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CC[C@H]2O)c1	822503366	GZIWJRNCVHGBBU-ZYHUDNBSSA-N	223.272	1.014	10	20	BDCD	
Cc1cccc(CN(C)[C@H]2CCNC2=O)c1O	775743468	HJNQWLAAMDLIKG-NSHDSACASA-N	234.299	1.021	10	20	BDCD	
COC(=O)[C@@H](C)NCc1ccc(OC)c(C)c1	42307637	HLUVMJCAXNHOBY-SNVBAGLBSA-N	237.299	1.655	10	20	BDCD	
CNC[C@@H](C)NCc1ccc2c(c1)CCCO2	229101097	UQTCECHVDJXCHH-LLVKDONJSA-N	234.343	1.709	10	20	BDCD	
CCONC(=O)NCc1ccc(N(C)C)cc1	193180341	CLNUHBVFVVKUEM-UHFFFAOYSA-N	237.303	1.503	10	20	BDCD	
C[C@@H](CNCc1ccc2c(c1)CCO2)CN(C)C	291693709	JHZAESLDFJZQTM-LBPRGKRZSA-N	248.370	1.909	10	20	BDCD	
C[C@H](NCC(F)(F)CN)c1ccccc1O	817966521	PNRQVOGZQXZJIO-QMMMGPOBSA-N	230.258	1.637	10	20	BDCD	
CCO[C@H]1C[C@@H]1C(=O)N[C@H](C)c1ccccc1O	827930227	FKEOHCMQWMJLFJ-CDMKHQONSA-N	249.310	1.994	10	20	BDCD	
COCc1cn(Cc2ccc(N(C)C)cc2)nn1	900534119	CUUMJHJSSBRQIT-UHFFFAOYSA-N	246.314	1.539	10	20	BDCD	
C[C@@H]1CN(C(=O)c2cc(O)cs2)[C@H](C)CO1	731868503	HAZFGEBOASWYFR-HTQZYQBOSA-N	241.312	1.703	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CC23CCNCC3)c1	841078752	KBAJKYSVMOODHJ-AWEZNQCLSA-N	246.354	1.932	10	20	BDCD	
C[C@@H]1CN(Cc2cccc(F)c2O)[C@H](C)CN1	843120082	VJHDWKKQDMBRSF-NXEZZACHSA-N	238.306	1.714	10	20	BDCD	
CC[C@@H](N)CNCc1cccc(C)c1O	841071341	DJHNWRUUFDPJJT-LLVKDONJSA-N	208.305	1.528	10	20	BDCD	
CCOc1ccc(CN(CC)CCO)c(O)c1	768140172	DNEGLBVNQUPIFR-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
Nc1ccc(CN2CCC[C@@H](O)C2)cc1	36798430	SKMXFCWLTWDGCV-GFCCVEGCSA-N	206.289	1.226	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@@H]2CCC[C@H]2O)cc1	89151025	XFTZOHMUFBZEKM-WCQYABFASA-N	248.326	1.089	10	20	BDCD	
CCN(Cc1cccc(C)c1O)[C@H]1CCNC1=O	281785893	NOHVFFSXBWNYPE-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@@H](C(F)(F)F)C1	409425437	FVQKHYKXLRBXMJ-RXMQYKEDSA-N	222.170	1.708	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@H](O)[C@@H](CC2CC2)C1	409435674	WCXFHVGHUYOPOK-QWRGUYRKSA-N	224.308	1.780	10	20	BDCD	
C[C@H](C(=O)NCc1cccc(O)c1O)C1CC1	1350299486	AVEQMMQJEYNTDT-QMMMGPOBSA-N	235.283	1.760	10	20	BDCD	
CNC(=O)[C@H]1CCCN(Cc2ccc(N)cc2)C1	232278506	HHNIZYJVFSXLPY-LBPRGKRZSA-N	247.342	1.227	10	20	BDCD	
Oc1ccc(F)cc1CNCCC1(O)CCC1	285070770	LYPCHCOWZUXLII-UHFFFAOYSA-N	239.290	1.926	10	20	BDCD	
CC(C)(C)NC(=O)NCCc1ccc(N)cc1	40675745	SMHOIZUXRWKMMH-UHFFFAOYSA-N	235.331	1.909	10	20	BDCD	
C[C@H]1CCCN(Cc2ccccc2O)[C@H]1CN	252219789	YSGNHAYMMQYRNB-AAEUAGOBSA-N	234.343	1.951	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC[C@@H](C)CN)c1	817961607	ANJGINWLVUVUOV-UWVGGRQHSA-N	238.331	1.646	10	20	BDCD	
CCC(=O)N[C@H](C)c1cc(OC)ccc1O	728984486	QLBQWMYKYXUHFF-MRVPVSSYSA-N	223.272	1.988	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCCCON	904457383	MJXLWQZRWOUXSM-UHFFFAOYSA-N	237.347	1.431	10	20	BDCD	
C[C@@]1(NC(=O)c2cc(O)cs2)CCCOC1	831646011	RPVVFOSFWAAOOK-LLVKDONJSA-N	241.312	1.753	10	20	BDCD	
C[C@H](NCCO)c1ccc(Cl)cc1O	841743126	CTBBHHHASBLHFK-ZETCQYMHSA-N	215.680	1.689	10	20	BDCD	
Cc1cccc(CNCC(C)(C)N)c1O	841030357	FTGHHJRGSRULPD-UHFFFAOYSA-N	208.305	1.528	10	20	BDCD	
C[C@H](N(C)C(=O)c1cc(O)cs1)C(C)(C)O	854762538	WHWMNMAJQHOUFO-ZETCQYMHSA-N	243.328	1.685	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@@H]2COC[C@@H]2O)c(O)c1	866421210	XNSYNCIFKLTXEW-XWIASGKRSA-N	237.299	1.111	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H](C)CCO	877067471	IEBWARNXZFDFQH-JTQLQIEISA-N	223.316	1.809	10	20	BDCD	
Cc1ccc(CN2CCCNC(=O)C2)c(O)c1	876639595	HUAHLQGPNFHGDH-UHFFFAOYSA-N	234.299	1.023	10	20	BDCD	
CNC(=O)CN(C)Cc1cccc(Cl)c1O	165413398	SQJQSRFAQAOFED-UHFFFAOYSA-N	242.706	1.223	10	20	BDCD	
COc1ccc(CNC(=O)[C@@H]2C[C@H]2C)c(O)c1	794382805	INVIKXCFSMYPJJ-LDYMZIIASA-N	235.283	1.673	10	20	BDCD	
COc1ccc(CNC(=O)NC2CC2)c(O)c1	792763217	OUWCCYQPQFRLJP-UHFFFAOYSA-N	236.271	1.362	10	20	BDCD	
CCOC[C@@H]1CN(C(=O)CN=[N+]=[N-])C[C@H]1C	409434685	QDIJWWIBZYPPDV-BDAKNGLRSA-N	226.280	1.428	10	20	BDCD	
CC(C)CN1CCN(C(=O)CN=[N+]=[N-])CC1	409429689	PFGOSBQWYIAGLC-UHFFFAOYSA-N	225.296	1.097	10	20	BDCD	
CC[C@H](OC(=O)c1cccc(O)c1O)C(=O)O	1605121109	WRNBYLPVYLIDIJ-QMMMGPOBSA-N	240.211	1.118	10	20	BDCD	
C/C=C/C=C/C(=O)NCCc1ccc(O)c(O)c1	158058504	ALLZEMMCSMDIMG-MQQKCMAXSA-N	247.294	1.889	10	20	BDCD	
CCN1C[C@@H](C(=O)Nc2ccc(N)cc2)CC1=O	160450125	KLKXNEVLNZVYLZ-VIFPVBQESA-N	247.298	1.076	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNS(C)(=O)=O	115592737	YWWXLRQNCLSFAD-UHFFFAOYSA-N	242.344	1.110	10	20	BDCD	
Cc1ccc(O)c(CN(CC(N)=O)C(C)C)c1	133009132	VQZHUPKVSXKXMG-UHFFFAOYSA-N	236.315	1.396	10	20	BDCD	
CCCN(CC(=O)O)Cc1cc(F)ccc1O	233005732	DXOLHMFXZDIBJN-UHFFFAOYSA-N	241.262	1.828	10	20	BDCD	
CCOc1ccc(CN[C@H]2[C@@H]3CNC[C@@H]32)c(O)c1	841079028	VRPHOADZACWJSV-IMRBUKKESA-N	248.326	1.098	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](CN)C2CC2)c1	841027961	HUWPCYBLNFQDCC-LBPRGKRZSA-N	236.315	1.228	10	20	BDCD	
CCO[C@@H]1C[C@H]1C(=O)NCc1cc(C)ccc1O	862758911	QHXXGNAFQRXZBU-DGCLKSJQSA-N	249.310	1.742	10	20	BDCD	
CN(C(=O)[C@H]1C[C@@]12CCNC2)c1ccc(N)cc1	877077685	QVYSMSKSXUFYON-TZMCWYRMSA-N	245.326	1.231	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1CCCO1	80130060	OPJGYPPCNFDOKB-GFCCVEGCSA-N	235.283	1.530	10	20	BDCD	
CN(C(=O)C[C@H](N)C(C)(C)C)c1ccc(N)cc1	1340845915	AZDOZAVCNRYUGI-LBPRGKRZSA-N	249.358	1.995	10	20	BDCD	
C[C@H](CC(N)=O)NCc1cc(Cl)ccc1O	160800876	NOIHHLLVZRFTGE-SSDOTTSWSA-N	242.706	1.399	10	20	BDCD	
CONC(=O)NCCCSc1nccs1	164308079	YFHRBXJZCIQIPG-UHFFFAOYSA-N	247.345	1.486	10	20	BDCD	
Oc1ccc(F)cc1CNCc1cocn1	309529804	VQPUVGPFCFRZOT-UHFFFAOYSA-N	222.219	1.809	10	20	BDCD	
CCCN[C@H]1CCC2=C(C1)[S@@](=O)C(=N)N2	2048531917	MZOCOESUNXMDIR-NZFNHWASSA-N	227.333	1.037	10	20	BDCD	
Cc1cccc(CN[C@@H]2CC[C@H](C(N)=O)C2)c1O	825279561	RSCLDQYQXJXVEJ-CMPLNLGQSA-N	248.326	1.444	10	20	BDCD	
CN(Cc1ccccc1O)[C@@H]1CCCCNC1=O	119948004	ORHOMOHLUAKJJU-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
C[C@@H](NCCOCCO)c1ccc(F)cc1O	62745385	YGUSXYIWBWSOJB-SECBINFHSA-N	243.278	1.191	10	20	BDCD	
CN(C(=O)[C@@H]1CCCO1)c1ccc(N)cc1	34939051	VFXBTQXFILNPRB-NSHDSACASA-N	220.272	1.411	10	20	BDCD	
CO[C@@H](C)CCNCc1ccccc1O	263818868	PJGXNKHUMSFKBR-JTQLQIEISA-N	209.289	1.907	10	20	BDCD	
C[C@H]1CN[C@H](C)CN1C(=O)Cc1ccc(N)cc1	841849469	WHRDXWPTDQCMCG-MNOVXSKESA-N	247.342	1.020	10	20	BDCD	
COC[C@H](CO)N[C@@H](C)c1cc(C)ccc1O	234822511	PPNDVANZNWUBSY-QWRGUYRKSA-N	239.315	1.359	10	20	BDCD	
COc1cccc(CN(CCO)C(C)C)c1O	271052211	WTJJDIBZSMYWDX-UHFFFAOYSA-N	239.315	1.604	10	20	BDCD	
CC(=O)C(=O)COC(=O)Cc1ccc(C)cc1	808491316	MCFQTKJAULJTPS-UHFFFAOYSA-N	234.251	1.239	10	20	BDCD	
Cc1cc(O)c(CNCC2(N)CC2)cc1C	904448811	CRAHUVNVJFRSRV-UHFFFAOYSA-N	220.316	1.590	10	20	BDCD	
C[C@@H](OC(=O)c1cc(O)cs1)C(=O)N(C)C	731910477	RTLKNWQWEIYQCB-ZCFIWIBFSA-N	243.284	1.087	10	20	BDCD	
COc1cccc(O)c1CN[C@H](C)CCCN	841079567	JUNMWPGKIISIRT-SNVBAGLBSA-N	238.331	1.618	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1CC(F)C1	753072027	FQJYZSPTTKHXGP-DUXPYHPUSA-N	237.230	1.291	10	20	BDCD	
C[C@H](N)C(=O)NCc1ccc2c(c1)CCCN2C	166475728	REFLUVKDOILXFI-JTQLQIEISA-N	247.342	1.032	10	20	BDCD	
C[C@H]1C[C@H](O)CN1C(=O)c1cc(O)cs1	788592308	QCIVDCWNTLVIST-BQBZGAKWSA-N	227.285	1.049	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1CC[C@H](O)C1	187985573	OAXBFHIXOVXFMX-CABZTGNLSA-N	239.290	1.782	10	20	BDCD	
Cc1ccc(C(=O)OCC[C@@H](C)O)c(O)c1O	1346728970	ZVDLQFJNPBLWGV-MRVPVSSYSA-N	240.255	1.334	10	20	BDCD	
CNCc1ccc(N2CCN(C)CC2)c(F)c1	34823180	KIJMWZVYXHNXQF-UHFFFAOYSA-N	237.322	1.297	10	20	BDCD	
CNC(=O)C[C@H](C)N[C@H]1CCc2cccc(O)c21	322803390	RBGVDAMXOJVPJO-ONGXEEELSA-N	248.326	1.494	10	20	BDCD	
Cc1ccc(O)c(CNCC23CC(CO2)C3)c1	527789892	PWWKZTMTNIYYLS-UHFFFAOYSA-N	233.311	1.969	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)CC(=O)N1	294926027	FXYMIVCJIJGTAI-NSHDSACASA-N	247.342	1.073	10	20	BDCD	
C[C@@H](CN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O	817969890	HSBGQOJGUUCJRH-JGVFFNPUSA-N	239.275	1.298	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)c1ncc[nH]1	817956758	CEZXVQSHYVOATR-SNVBAGLBSA-N	230.315	1.885	10	20	BDCD	
C[C@H](NCCCON)c1cc(F)cc(F)c1O	902426920	YYLBXVPZPDMXSF-ZETCQYMHSA-N	246.257	1.601	10	20	BDCD	
COC[C@H](C)NC(=O)NCc1ccccc1O	748451532	SKRCOKDMEMINMZ-VIFPVBQESA-N	238.287	1.226	10	20	BDCD	
COc1cccc(CN[C@H](C)C[C@@H](C)N)c1O	843129819	RPBWINLHBNCPQD-NXEZZACHSA-N	238.331	1.616	10	20	BDCD	
CC(C)CNC[C@H](N)c1ccc(N(C)C)cc1	841046302	ZOIANTYLNDPVTR-AWEZNQCLSA-N	235.375	1.998	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)CC2(O)CCC2)c1	862754819	KYRLFKOZPOCFFE-UHFFFAOYSA-N	249.310	1.622	10	20	BDCD	
CON(C)CCN[C@H](C)c1c(O)cccc1F	886634863	OQSBGDXBRWNSKW-SECBINFHSA-N	242.294	1.675	10	20	BDCD	
CCS(=O)(=O)NCc1ccc(N(C)C)cc1	48903620	XTBBNXRQWQSOHU-UHFFFAOYSA-N	242.344	1.192	10	20	BDCD	
CN(Cc1ccc(N)cc1)CC(C)(C)CN	1262486949	GDFPQTORJGQMDS-UHFFFAOYSA-N	221.348	1.686	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1CO	191728441	SVSORNKUYIPHKQ-OCCSQVGLSA-N	248.370	1.813	10	20	BDCD	
CC(C)[C@H](C(=O)Nc1ccc(N)cc1)N(C)C	62461296	SBNLBKPBQKOKLN-GFCCVEGCSA-N	235.331	1.794	10	20	BDCD	
COC[C@@H](O)CN[C@H](C)c1cc(C)ccc1O	71265159	LBIKVFCCIAOASP-MNOVXSKESA-N	239.315	1.359	10	20	BDCD	
CCOc1cccc(CN(C)CC(=O)O)c1O	77253446	QQDDKJULHHHSLK-UHFFFAOYSA-N	239.271	1.307	10	20	BDCD	
CCCCNC(=O)NCc1ccccc1O	136335321	FGBGXKMUPWHOAD-UHFFFAOYSA-N	222.288	1.992	10	20	BDCD	
CN(CCc1cnn(C)c1)c1ccc(N)cc1	230764776	ZPNSXBRXDROFDL-UHFFFAOYSA-N	230.315	1.681	10	20	BDCD	
C[C@@H](CNCc1cc(F)ccc1O)C(=O)O	848638862	WZPOWTOVFDQEDL-ZETCQYMHSA-N	227.235	1.342	10	20	BDCD	
Cc1cc(CN2CCC[C@H](N)C2)ccc1N(C)C	923282872	UYDKTIVCDBGCKN-AWEZNQCLSA-N	247.386	1.984	10	20	BDCD	
CC1=NO[C@@H](CNC(=O)c2cc(O)cs2)C1	854804023	UAXHGKVFPZURQD-MRVPVSSYSA-N	240.284	1.348	10	20	BDCD	
CN(CCN)Cc1ccc(N2CCCC2)cc1	1117956155	NVTUNTXTMFPCRZ-UHFFFAOYSA-N	233.359	1.677	10	20	BDCD	
O=C(c1cc(O)cs1)N1CC[C@H](F)C1	1118704294	AKDCLPMWOHTCBF-LURJTMIESA-N	215.249	1.638	10	20	BDCD	
CC1=NO[C@@H](CNCc2ccc3c(c2)CCO3)C1	895310004	FDXZSEWRDJIILM-CYBMUJFWSA-N	246.310	1.876	10	20	BDCD	
CN(C(=O)[C@]1(C)CCOC1)c1ccc(N)cc1	687355042	IQVVRDMCLKOGCK-CYBMUJFWSA-N	234.299	1.658	10	20	BDCD	
CCOC(=O)c1[nH]c2c(c1CCN)CCCC2	328578581	PMIGYZJGVHEYEW-UHFFFAOYSA-N	236.315	1.571	10	20	BDCD	
N[C@H]1C[C@H](CNCc2cccc(F)c2O)C1	1580427728	NTYWVMVTZKEEAD-CZMCAQCFSA-N	224.279	1.358	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H](C)CC(N)=O)c(O)c1	168830142	UWARYVFRIYZWSG-NXEZZACHSA-N	236.315	1.615	10	20	BDCD	
Cc1cccc(CNC[C@@H](O)C2CCC2)c1O	316683487	ZIYJOSYYTDIJDB-CYBMUJFWSA-N	235.327	1.951	10	20	BDCD	
Cc1cccc(CNCCCn2cncn2)c1O	381751772	DWMJBPUVFYHPLI-UHFFFAOYSA-N	246.314	1.472	10	20	BDCD	
COC(=O)[C@H](C)CN(C)Cc1ccc(N)cc1	1336286568	SQRDVNMUGCWCBM-SNVBAGLBSA-N	236.315	1.510	10	20	BDCD	
COC(=O)CCCN(C)Cc1ccccc1O	117340675	BANPFEMJUNBSAT-UHFFFAOYSA-N	237.299	1.777	10	20	BDCD	
C[C@@H]1OCC[C@]1(O)CNCc1ccccc1O	227976229	GVMJINDZUHHTOR-GWCFXTLKSA-N	237.299	1.022	10	20	BDCD	
CN1CCC[C@@H]1CNC(=O)Cc1ccc(N)cc1	82284151	QQGPYNYEPOLHHY-CYBMUJFWSA-N	247.342	1.022	10	20	BDCD	
NC[C@@H]1CCCN(Cc2ccccc2O)C1	44527858	XZMNGNPNTAKLTM-NSHDSACASA-N	220.316	1.563	10	20	BDCD	
Cn1cnc2c(Sc3nccs3)ncnc21	750531484	CLMVNQDLCHHKER-UHFFFAOYSA-N	249.324	1.971	10	20	BDCD	
COC(=O)[C@H]1CCC[C@@H]1NCc1ccccc1O	1116771991	XUMFJJQFVQDQKZ-RYUDHWBXSA-N	249.310	1.824	10	20	BDCD	
CN=c1cc(C)nc(Nc2ccc(N)cc2)[nH]1	409426871	GYPQWGGWMQQZLW-UHFFFAOYSA-N	229.287	1.574	10	20	BDCD	
CCOC(=O)[C@H]1CCN(Cc2ccc(N)cc2)C1	1336284959	FKOYOJXQEQPIEQ-LBPRGKRZSA-N	248.326	1.654	10	20	BDCD	
CCOCCN(C)Cc1c(O)cccc1OC	779598467	JMUSCGMVFALFGA-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
CC[C@@H](C)C[C@H](N)C(=O)NCc1ccc(N)cc1	1356237804	AXPQFUIMNSBWCN-MFKMUULPSA-N	249.358	1.649	10	20	BDCD	
CCC[C@@H](O)CNC(=O)Cc1ccc(N)cc1	156976746	PKVXWMSFYQUZFM-GFCCVEGCSA-N	236.315	1.089	10	20	BDCD	
O=C(O)C1(C(=O)NCc2ccccc2O)CCC1	852942718	MDEIBBLOJLNXON-UHFFFAOYSA-N	249.266	1.263	10	20	BDCD	
O=[N+]([O-])c1cnc(SCCO)s1	226777847	OAWATDGGLQLEPU-UHFFFAOYSA-N	206.248	1.136	10	20	BDCD	
COCCC(=O)CSc1nccs1	308503921	YEIQHJGINJGJCN-UHFFFAOYSA-N	217.315	1.841	10	20	BDCD	
C[C@@H](CN(C)C)N[C@H](C)c1ccccc1O	130164606	OXDNMDUOAKECFR-WDEREUQCSA-N	222.332	1.993	10	20	BDCD	
COC[C@@H](C)N(C)C(=O)c1cccc(O)c1O	126293391	AYAUFPMGNVEREF-MRVPVSSYSA-N	239.271	1.205	10	20	BDCD	
CC(C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1	183423048	OJTNCUWANQPWLY-VIFPVBQESA-N	237.299	1.801	10	20	BDCD	
CCN(CC)C(=O)CN(C)Cc1ccc(N)cc1	35063927	KBJLKEIQAYTXPP-UHFFFAOYSA-N	249.358	1.569	10	20	BDCD	
C[C@@H](NCCCO)c1ccc(N(C)C)cc1	37236430	VTLAZVNAWSMSSZ-LLVKDONJSA-N	222.332	1.786	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@@H](CN)C2)c1	71409465	FUISIVHWNWOGCB-LBPRGKRZSA-N	234.343	1.871	10	20	BDCD	
C[C@@H](CCO)N[C@@H](C)c1ccccc1O	132432770	HATLBZPDAXAMOR-UWVGGRQHSA-N	209.289	1.814	10	20	BDCD	
C=Cn1cc(/C=C2/SC(=S)NC2=O)cn1	194517901	NEFDNDUCDYLXKI-XVNBXDOJSA-N	237.309	1.472	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@](F)(CO)C2)c1	802661121	IZJRZYFEFXAIII-ZDUSSCGKSA-N	239.290	1.607	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@H](N)C2)cc1	906508306	MFKLPHRIVZGSFK-HAQNSBGRSA-N	219.332	1.332	10	20	BDCD	
C[C@H](NC[C@@H]1CCN1C)c1c(O)cccc1F	903316347	OCHASULLHVTJEC-UWVGGRQHSA-N	238.306	1.886	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@H](CC(N)=O)C1	877534755	GWLQLBDDLDVGNX-NSHDSACASA-N	248.326	1.398	10	20	BDCD	
Nc1ccc(CNC(=O)NCC2CCC2)cc1	1353278247	PFNAOOOBRIFMIP-UHFFFAOYSA-N	233.315	1.868	10	20	BDCD	
Nc1ccc(NCc2nc(CO)cs2)cc1	1580449585	OYERRTGEFQTOMO-UHFFFAOYSA-N	235.312	1.830	10	20	BDCD	
C[C@H](CN[C@H](C)c1c(O)cccc1F)C(=O)O	1589067337	JFHPWHRKFCAMCY-HTQZYQBOSA-N	241.262	1.903	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@@H]2C(N)=O)cc1	160304926	ZXVDSCCMKHVKGG-CYBMUJFWSA-N	247.342	1.202	10	20	BDCD	
CC(C)CCNC(=O)c1cccc(O)c1O	163268450	FQWRNHJANPZQBN-UHFFFAOYSA-N	223.272	1.874	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC[C@H]1CF	294247154	XVMDNTRXHYHTLJ-QMMMGPOBSA-N	239.246	1.672	10	20	BDCD	
O=C(CN1CCCC1)NCc1ccccc1O	821060522	HKUGFPWKAZHHHI-UHFFFAOYSA-N	234.299	1.104	10	20	BDCD	
Cc1cccc(CN2CCNCC2)c1O	106886559	NNLRLFCECBRPIT-UHFFFAOYSA-N	206.289	1.106	10	20	BDCD	
CC[C@H](NCCO)c1ccc(F)cc1O	285809229	VTMIGPHHDGBVIX-JTQLQIEISA-N	213.252	1.564	10	20	BDCD	
C[C@]1(CNC(=O)Nc2ccc(N)cc2)CCCO1	94804635	KJLZUJJUUPRZTD-CYBMUJFWSA-N	249.314	1.959	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)C(F)F	279980038	UZMIPRVXGDEXGN-UHFFFAOYSA-N	231.198	1.022	10	20	BDCD	
Nc1ccc(CNC(=O)NCC2CC2)cc1	701014833	VWBVWDIWEQMLEX-UHFFFAOYSA-N	219.288	1.478	10	20	BDCD	
COc1cccc(O)c1CNC[C@@H](C)CN	841049219	OGQICIGNOSNEGF-VIFPVBQESA-N	224.304	1.085	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)C1CCCC1	910957112	JKOVCVNUZDLQES-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
N[C@@H]1CCCN(Cc2cccc(F)c2O)C1	843043699	DCFGRELQECGGIA-SNVBAGLBSA-N	224.279	1.454	10	20	BDCD	
CCOC(=O)/C=C\CN(C)Cc1ccccc1O	929973197	XZYYQFCNCNMORC-TWGQIWQCSA-N	249.310	1.943	10	20	BDCD	
COCCOCCOC(=O)c1cc(O)cs1	768953185	KHWPYMFQNVZIMC-UHFFFAOYSA-N	246.284	1.274	10	20	BDCD	
CCC(=O)N[C@@H](C)C(=O)N(C)c1ccc(N)cc1	877080652	LRDVCYBVDQSMSS-VIFPVBQESA-N	249.314	1.146	10	20	BDCD	
CN(C(=O)[C@@]1(C)CCCNC1)c1ccc(N)cc1	877077753	SUJSTOZSXNYRKD-AWEZNQCLSA-N	247.342	1.621	10	20	BDCD	
CCOC(=O)[C@H]1CCN(Cc2ccccc2O)C1	896961871	GMBBMIWOSQGKDZ-LBPRGKRZSA-N	249.310	1.777	10	20	BDCD	
Cc1ccc(CN[C@@H]2COC[C@@H]2C)c(O)c1	896733135	NCEAHIMOJWIHPD-CMPLNLGQSA-N	221.300	1.825	10	20	BDCD	
[N-]=[N+]=NCCn1nc(-c2ccccn2)cc1O	409440187	SHINZLDMDRJQDU-UHFFFAOYSA-N	230.231	1.961	10	20	BDCD	
COc1ccc(CNC[C@H]2CCN2C)cc1C	712588736	XAFAFTYYPYRIHI-CYBMUJFWSA-N	234.343	1.797	10	20	BDCD	
CN(C)c1ccc(OCCF)cc1C(=O)O	1598328670	XIBOQVFLBBDABB-UHFFFAOYSA-N	227.235	1.799	10	20	BDCD	
CCc1cccc(CN[C@@H](CO)C2CC2)c1O	848897370	PSSMMIAQHZLUID-ZDUSSCGKSA-N	235.327	1.815	10	20	BDCD	
CNCCC(=O)N[C@@H](C)c1ccccc1O	870988461	PWIFMXMFINUPJU-VIFPVBQESA-N	222.288	1.179	10	20	BDCD	
CC1(C)C[C@@H]1C(=O)NCCc1ccc(N)cc1	124416314	AKBNZHCYLPXVQT-GFCCVEGCSA-N	232.327	1.974	10	20	BDCD	
CN(C)CCCNCc1ccc2c(c1)CCO2	37362680	VHZXPNRFXMWFDW-UHFFFAOYSA-N	234.343	1.663	10	20	BDCD	
CC1(CNCc2ccccc2O)COC1	82694290	FRYNKBKZICXMCW-UHFFFAOYSA-N	207.273	1.518	10	20	BDCD	
CCCCOCC(=O)NCc1ccccc1O	265478953	KYEFMIDIAUYNGO-UHFFFAOYSA-N	237.299	1.825	10	20	BDCD	
CCNCCN[C@@H]1CCc2cccc(O)c21	817951315	DFHHVKYRHCWEJQ-LLVKDONJSA-N	220.316	1.579	10	20	BDCD	
CN(C)c1ccc2c(c1)OCCN2C(=O)O	828073445	KFEPUORDCXTAAS-UHFFFAOYSA-N	222.244	1.629	10	20	BDCD	
CN(C)c1ccc(CNC[C@@H](N)C2CC2)cc1	841049572	LIJNFGOMCYIUEA-CQSZACIVSA-N	233.359	1.580	10	20	BDCD	
C[C@@H]1[C@H](CO)CCCN1Cc1ccccc1O	840979170	RXQNGRDCNFIACW-YPMHNXCESA-N	235.327	1.985	10	20	BDCD	
Cc1cc(CN2CC[C@@H](N)C2)ccc1N(C)C	923274668	PIRVMLVQUQQEEL-CYBMUJFWSA-N	233.359	1.594	10	20	BDCD	
Nc1ccc(NC(=O)CC[C@H]2CCCNC2)cc1	856995205	RKEGMXKWRNJJGP-LLVKDONJSA-N	247.342	1.987	10	20	BDCD	
CCCONC(=O)NCc1cc(C)ccc1O	875691570	XPGYIJWXMIHREU-UHFFFAOYSA-N	238.287	1.841	10	20	BDCD	
[N-]=[N+]=NCc1ccc(C(=O)N2CCOCC2)o1	1537962676	VNSQOLRYIDATIK-UHFFFAOYSA-N	236.231	1.562	10	20	BDCD	
Cc1n[nH]c(CN(C)Cc2ccccc2O)n1	272233167	FBZZOSPSJKWACE-UHFFFAOYSA-N	232.287	1.451	10	20	BDCD	
CC[C@H](NCc1c(O)cccc1OC)[C@H](C)O	1325133332	PIVRNMDTXAPWHX-ONGXEEELSA-N	239.315	1.650	10	20	BDCD	
C[C@@H](NCc1cnn[nH]1)c1ccccc1O	398319860	YSHHTVNQAXGNTJ-MRVPVSSYSA-N	218.260	1.361	10	20	BDCD	
Nc1ccc(NC(=O)CC[C@H]2CCNC2)cc1	168803376	XNTWVFQJNSOYNP-JTQLQIEISA-N	233.315	1.597	10	20	BDCD	
CC[C@H](NC)C(=O)NCc1ccc(N(C)C)cc1	692071317	ANLGDJSCGKRVSK-ZDUSSCGKSA-N	249.358	1.367	10	20	BDCD	
Nc1ccc(CN2CC[C@@H](C(=O)O)C2)cc1	1601215538	CYEGFRZTFAVBEV-SNVBAGLBSA-N	220.272	1.175	10	20	BDCD	
Oc1cccc(Cl)c1CN1CCCNCC1	128315255	MGAQBSRRQLTCDI-UHFFFAOYSA-N	240.734	1.841	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC[C@@H](C)O)c1	35629069	WFPWAOXCHZCBEI-NXEZZACHSA-N	209.289	1.732	10	20	BDCD	
CCOc1cccc(CN(C)C[C@H](C)O)c1O	130718063	VLALTXAQQJZBGT-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
C[C@@]1(C(=O)NCc2ccc(N)cc2)CCCOC1	297351229	ZEJCEEYPBKCNJN-CQSZACIVSA-N	248.326	1.702	10	20	BDCD	
COCC(=O)NCc1c(C)c2ccccc2n1C	348636753	YYHCCIWCJBITJZ-UHFFFAOYSA-N	246.310	1.749	10	20	BDCD	
c1csc(SCCn2cncn2)n1	263919999	PLPBOFOJQICPSR-UHFFFAOYSA-N	212.303	1.527	10	20	BDCD	
CC[C@@H]1CN(Cc2ccccc2O)C[C@H]1O	272378027	HIESWTNHJVMHHW-ZWNOBZJWSA-N	221.300	1.595	10	20	BDCD	
C[C@H](CO)N(C)Cc1cccc(Cl)c1O	289425803	JWWOGVSQNYIASP-MRVPVSSYSA-N	229.707	1.858	10	20	BDCD	
Cc1cccc(CN(C)CC(C)(C)N)c1O	849350558	QHLPKSKPWPHZBF-UHFFFAOYSA-N	222.332	1.870	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H]1COCO1	894880144	AMLUXJWMAPNOMV-SNVBAGLBSA-N	223.272	1.163	10	20	BDCD	
O=C(N[C@H]1C=CCC1)c1cccc(O)c1O	829344347	XVBLLUOBLRKEFH-QMMMGPOBSA-N	219.240	1.546	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCc2ccc(CO)cc21	409434059	OADKXIUBYCJTPD-UHFFFAOYSA-N	232.243	1.378	10	20	BDCD	
C[C@@H]1NCCN(Cc2ccc(N)cc2)[C@H]1C	1334773976	BVUPSTIZVQALEL-QWRGUYRKSA-N	219.332	1.451	10	20	BDCD	
c1cc(N2CCCC2)ccc1CN1CCNCC1	19726888	BVWSAXUAKBSYBZ-UHFFFAOYSA-N	245.370	1.692	10	20	BDCD	
CCOCOc1ccc(N(C)C)c(C(=O)O)c1	1596945909	UBFHKMUSTDJLLP-UHFFFAOYSA-N	239.271	1.824	10	20	BDCD	
NC(=O)[C@H]1CCCN(Cc2ccccc2O)C1	155066235	AXLMESDZKPNYKB-NSHDSACASA-N	234.299	1.090	10	20	BDCD	
C[C@H](O)CCCNCc1ccccc1O	227959718	NPCVAJAHXXVEAQ-JTQLQIEISA-N	209.289	1.643	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC[C@@H](F)C1	689835993	JQBIMXBBPYDVIQ-MRVPVSSYSA-N	239.246	1.672	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H]3CNC[C@@H]32)c1	385324052	SCPBWOAMOONUSX-YPMHNXCESA-N	232.327	1.494	10	20	BDCD	
COCCOC(=O)N[C@H](C)c1ccccc1O	885343823	NHQNXSFDCPBECL-SECBINFHSA-N	239.271	1.826	10	20	BDCD	
COc1ccc(CNCCNC(C)=O)cc1C	35052622	GYHFRZHIULRUEX-UHFFFAOYSA-N	236.315	1.229	10	20	BDCD	
O=C(NC[C@H]1CCCO1)c1cccc(O)c1O	126233010	YVWDDPBRRYQZGI-MRVPVSSYSA-N	237.255	1.007	10	20	BDCD	
C[C@@H](NCc1ccc(N(C)C)cc1)C(=O)O	41689453	NSBREJIHQQMHMK-SECBINFHSA-N	222.288	1.315	10	20	BDCD	
CN(C)c1ccc(CNCC2(CO)CC2)cc1	80247026	UAMPZFAELHXITC-UHFFFAOYSA-N	234.343	1.615	10	20	BDCD	
COc1cccc(CNC[C@@H](C)OC)c1O	191201259	AHTLKBZOCFERLP-SECBINFHSA-N	225.288	1.525	10	20	BDCD	
O=C(NCc1ccccc1O)C(F)F	236561060	ROTGHXAIMWYJHP-UHFFFAOYSA-N	201.172	1.274	10	20	BDCD	
COc1ccc(CNC(=O)c2cocn2)c(O)c1	794379527	OWRYCFIKNVCPAI-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
COc1cc(C)c(CN(C)CCCN)c(O)c1	1579145184	WIHHVQJYPRPFML-UHFFFAOYSA-N	238.331	1.490	10	20	BDCD	
C[C@@H]1C[C@H]1C(=O)N(C)c1ccc(N)cc1	34939055	DJUZRUTYVGXMKQ-LDYMZIIASA-N	204.273	1.888	10	20	BDCD	
COC[C@H](C)NCc1cc(OC)ccc1O	20087726	IISOBCDJUCVSPD-VIFPVBQESA-N	225.288	1.525	10	20	BDCD	
CN(CC(=O)O)Cc1ccc(N2CCCC2)cc1	108245345	DOVQVBODNJCAOY-UHFFFAOYSA-N	248.326	1.803	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1CCSC1	309886470	YQYBRBBVXMLRKL-VIFPVBQESA-N	239.340	1.996	10	20	BDCD	
Cc1cccc(CN[C@@H](CO)CC(F)F)c1O	717826557	XMMYDGZZJVFEEZ-SNVBAGLBSA-N	245.269	1.806	10	20	BDCD	
Cc1cc(CNCc2ccccc2O)ncn1	756989014	AUUFHCBNQFWVJM-UHFFFAOYSA-N	229.283	1.780	10	20	BDCD	
CCNC(=O)C(C)(C)NCc1ccc(N)cc1	1356083073	JHBLCPLMKPKIPI-UHFFFAOYSA-N	235.331	1.273	10	20	BDCD	
CC[C@@H](CCO)NCc1ccc2c(c1)CCO2	77453697	SBUZPCDBMYWKPN-ZDUSSCGKSA-N	235.327	1.872	10	20	BDCD	
CC(C)NC(=O)CNCc1ccc(N(C)C)cc1	35136003	SFPCUISFOWLSJF-UHFFFAOYSA-N	249.358	1.367	10	20	BDCD	
CC[C@@H](NCCCO)c1ccc(F)cc1O	285683141	OAHCATVLYYWEGL-LLVKDONJSA-N	227.279	1.954	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)[C@@H]1CO	226908708	SXRJSZRBOYKINN-ZWNOBZJWSA-N	220.316	1.472	10	20	BDCD	
C[C@H](NCC(C)(C)C(N)=O)c1ccccc1O	183638053	HXQBAWDFYXWNAS-VIFPVBQESA-N	236.315	1.554	10	20	BDCD	
CN1CC[C@@H](CNC(=O)c2cc(O)cs2)C1	735688507	XBIIOIHGBROAEY-QMMMGPOBSA-N	240.328	1.135	10	20	BDCD	
Nc1ccc(-n2cc([C@H](O)C3CC3)nn2)cc1	849134579	HNVPWRKMESMLGU-GFCCVEGCSA-N	230.271	1.293	10	20	BDCD	
C[C@H](CCCN)NCc1cccc(F)c1O	841081252	RXTFYWRIODOXQX-SECBINFHSA-N	226.295	1.748	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC[C@H](CO)C1	840913557	XSPNLACPAQNEEP-ZDUSSCGKSA-N	248.370	1.875	10	20	BDCD	
NC[C@@H]1CC[C@H](NCc2cccc(F)c2O)C1	841084532	KHGCNHVDCVFCOF-KOLCDFICSA-N	238.306	1.748	10	20	BDCD	
CC[C@@H](O)CN[C@@H](C)c1cccc(OC)c1O	850529785	SZFVJTDKMJNOGK-VHSXEESVSA-N	239.315	1.822	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1[C@@H]2CCC[C@@H]12	1123977418	FLINFUIJXMDGJE-NXEZZACHSA-N	247.294	1.760	10	20	BDCD	
COc1ccc(CNC[C@@H]2COCO2)cc1C	894871697	VSVUWUZYDMYJFO-GFCCVEGCSA-N	237.299	1.466	10	20	BDCD	
C[C@H]1C[C@@H](C(=O)NCc2ccccc2O)CCO1	271910519	ZBWBPGVRAFXHSS-QWRGUYRKSA-N	249.310	1.824	10	20	BDCD	
[N-]=[N+]=NCCn1nc(-c2cnccn2)cc1O	409441157	WWAZHCAHCPQTIZ-UHFFFAOYSA-N	231.219	1.356	10	20	BDCD	
[N-]=[N+]=NCCN1CCOC[C@@H]2CCC[C@H]21	409435185	STPRRNJFHGBTRA-VHSXEESVSA-N	210.281	1.798	10	20	BDCD	
C[C@@H]1C[C@H](NC(=O)NCc2ccc(N)cc2)CO1	1335602883	GOZYLOKPQURLSB-SKDRFNHKSA-N	249.314	1.245	10	20	BDCD	
CCN(C)c1ccc(CN(C)CCO)cc1	1256009891	NDAHKMDARSLYBA-UHFFFAOYSA-N	222.332	1.567	10	20	BDCD	
CCOC1CN(C(=O)NCc2ccc(N)cc2)C1	1337020143	YNPNDHWFTLTEGF-UHFFFAOYSA-N	249.314	1.199	10	20	BDCD	
C[C@H]1C[C@@H]1CNC(=O)NCc1ccc(N)cc1	1346191587	OESOVZTXCSDJNQ-GXSJLCMTSA-N	233.315	1.724	10	20	BDCD	
C[C@H](CCCCN)NCc1ccc(N)cc1	1262488244	VUZZVDJESZCYDA-LLVKDONJSA-N	221.348	1.876	10	20	BDCD	
C[C@@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)CO1	402046779	NPJIFKLIIYINPZ-SKDRFNHKSA-N	234.299	1.105	10	20	BDCD	
N[C@H](C(=O)NCc1ccccc1O)C1CCC1	399022439	FVPXDCZJOUZNJU-LBPRGKRZSA-N	234.299	1.136	10	20	BDCD	
COC(=O)[C@@H](C)NCc1ccc(C)cc1O	83352580	JNMKQXJPHLXADG-SECBINFHSA-N	223.272	1.352	10	20	BDCD	
C[C@H]1CN(Cc2cc(Cl)ccc2O)CCN1	83368863	NMMDMEAHCWQPCY-VIFPVBQESA-N	240.734	1.839	10	20	BDCD	
C[C@H](CCCO)NCc1cc(F)ccc1O	226616743	VZOKSGXQJOPGNQ-SECBINFHSA-N	227.279	1.782	10	20	BDCD	
CCCNCCNCc1ccc2c(c1)CCO2	228718262	DFHPLEGRZDGJAV-UHFFFAOYSA-N	234.343	1.711	10	20	BDCD	
OC/C=C\CNCc1ccc(N2CCCC2)cc1	717536513	ZENMJUIHBMEKEM-RJRFIUFISA-N	246.354	1.925	10	20	BDCD	
O=C(O)[C@H]1CCCN1Cc1cccc(F)c1O	821509764	VVLALJTVBVPHGC-SNVBAGLBSA-N	239.246	1.580	10	20	BDCD	
CCOc1ccc(CNC[C@@H](C)CN)c(O)c1	841048554	KCMMSYVSLUKKKG-JTQLQIEISA-N	238.331	1.475	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC[C@H](CN)C1	843048426	SZCAGGJMVUEUPG-CYBMUJFWSA-N	247.386	1.842	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)OCCCF	867417095	MNFAYGNSTYCSGC-UHFFFAOYSA-N	243.234	1.684	10	20	BDCD	
Nc1ccc(NC(=O)[C@H](N)CC2CC2)cc1	884009483	XVQLTBCKLFTYQP-LLVKDONJSA-N	219.288	1.335	10	20	BDCD	
CON(C)CCNCc1ccc2c(c1)CCO2	883172465	HVXIYWYCHCSNKM-UHFFFAOYSA-N	236.315	1.204	10	20	BDCD	
C[C@H](NC1CC1)C(=O)N[C@H](C)c1ccccc1O	870988617	VATPWBINCHFODC-ZJUUUORDSA-N	248.326	1.710	10	20	BDCD	
CC[C@@H](NCc1ccc2c(c1)CCCO2)C(=O)O	900037065	HJQFDBNMJKRLRX-GFCCVEGCSA-N	249.310	1.964	10	20	BDCD	
CCCN(Cc1ccccc1O)[C@@H]1CCOC1=O	76074459	TVXNBXNKAUNTTF-GFCCVEGCSA-N	249.310	1.920	10	20	BDCD	
CC(C)N(C)S(=O)(=O)Nc1ccc(O)cc1	42520479	MNAUVQHWOYAPJP-UHFFFAOYSA-N	244.316	1.389	10	20	BDCD	
CO[C@@H](C)CNCc1cccc(C)c1O	191203655	KNUMPAKDOWJTCS-JTQLQIEISA-N	209.289	1.825	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@H]1C[C@H](O)C1)CC2	850579050	RHOLVERVFLHICK-GMTAPVOTSA-N	219.284	1.492	10	20	BDCD	
CN[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1	128873302	FNHKIBQONQSDNI-ZDUSSCGKSA-N	233.359	1.546	10	20	BDCD	
OC1(CNCc2ccc3c(c2)CCO3)CCC1	134518918	KVTNPSOKHYXUTC-UHFFFAOYSA-N	233.311	1.626	10	20	BDCD	
CNC(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1	42561809	JHTVXEZBDCOCPM-QWRGUYRKSA-N	249.358	1.538	10	20	BDCD	
COC[C@H](C)NCc1cccc(C)c1O	83345896	NFDFIWVXUNPMLF-JTQLQIEISA-N	209.289	1.825	10	20	BDCD	
CCN(CCCO)Cc1cc(F)ccc1O	272292938	OMHWAZNQMYAKDL-UHFFFAOYSA-N	227.279	1.736	10	20	BDCD	
CC[C@H](NCCc1ccc(N)cc1)[C@@H]1CCCN1	817957018	HKBQBXIIDREOTA-GJZGRUSLSA-N	247.386	1.932	10	20	BDCD	
C[C@@H](N[C@@H]1CCNC1)c1ccc(N(C)C)cc1	817944412	BHAQGXOCSNXNLP-DGCLKSJQSA-N	233.359	1.765	10	20	BDCD	
C[C@@H](CN)CN[C@@H](C)c1ccc(N(C)C)cc1	817962960	PSYGJIQEARGIKX-RYUDHWBXSA-N	235.375	1.998	10	20	BDCD	
CN(C)c1ccc(OCC[C@H]2CCNC2=O)cc1	902359459	POUBJSHISZLWPC-LLVKDONJSA-N	248.326	1.658	10	20	BDCD	
C[C@H]1CCN1C(=O)/C=C/c1ccc(O)c(O)c1	914157156	OEQZUFPAQMUVIJ-SGRBOOSSSA-N	233.267	1.732	10	20	BDCD	
Cc1cccc(CN2C[C@@H](N)[C@H](C)C2)c1O	843120225	ACOHKJZBCCNFRA-ZYHUDNBSSA-N	220.316	1.480	10	20	BDCD	
Cc1ccc(O)c(CN2CC(C(=O)O)C2)c1	83416364	SCXQOVGEMAEXHL-UHFFFAOYSA-N	221.256	1.217	10	20	BDCD	
Cc1cccc(O)c1CNCC(=O)NC1CC1	877531593	PEQUYNBLKKQUAN-UHFFFAOYSA-N	234.299	1.069	10	20	BDCD	
COc1cccc(CN2C[C@@H](O)C[C@H]2C)c1O	788269449	NRVMJFHJCGSIIE-KOLCDFICSA-N	237.299	1.356	10	20	BDCD	
CC[C@H](C)[C@H](N)C(=O)Nc1ccc(N)cc1	169816531	OHOVGZVHSMDYTL-KWQFWETISA-N	221.304	1.581	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC(N2CCCC2)CC1	409431441	SJCVINNYBYEDSP-UHFFFAOYSA-N	237.307	1.384	10	20	BDCD	
Cc1ccc(O)c(CNCc2ncnn2C)c1	80531752	OXQAEOUHPXSVKC-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
C[C@H](NC[C@H]1C[C@@H](O)C1)c1ccccc1O	720934539	DDHSKTPLTPNWFL-GARJFASQSA-N	221.300	1.814	10	20	BDCD	
Nc1ccc(CN2C[C@H]3CCC[C@]3(N)C2)cc1	1334754805	RSCDCFAMMBWOFY-OCCSQVGLSA-N	231.343	1.582	10	20	BDCD	
COCCN[C@H](C)c1cc(OC)ccc1O	19881560	BGZSZAZEECOFOQ-SECBINFHSA-N	225.288	1.698	10	20	BDCD	
C[C@H](CN)CNCc1ccc2c(c1)CCCO2	258774055	OIDADNNUZDDCTB-LLVKDONJSA-N	234.343	1.696	10	20	BDCD	
CCn1nncc1CN[C@H](C)c1ccccc1O	845990991	SOKKUBYXECOXNG-SNVBAGLBSA-N	246.314	1.854	10	20	BDCD	
C[C@H](NC[C@H]1CCCNC1=O)c1ccccc1O	838916126	DVFBHNBAXFUJPT-WDEREUQCSA-N	248.326	1.569	10	20	BDCD	
Cc1ccc(O)c(CNCCN2CCC2)c1	309857805	LHBDOHRINVHJRC-UHFFFAOYSA-N	220.316	1.496	10	20	BDCD	
Nc1ccc(CNS(=O)(=O)CC2CC2)cc1	83139674	JKECTWZDLNJYDW-UHFFFAOYSA-N	240.328	1.098	10	20	BDCD	
O=C(c1cccc(O)c1O)N(C1CC1)C1COC1	295894658	ZHSODVLLQMBXKM-UHFFFAOYSA-N	249.266	1.101	10	20	BDCD	
C[C@@](O)(C(=O)NCc1ccccc1O)C1CC1	287326131	OBNQGQVOILPCSE-ZDUSSCGKSA-N	235.283	1.169	10	20	BDCD	
C[C@H](NC[C@H](N)C1CC1)c1cc(F)ccc1O	817965969	XSUNLGJHIFGGPC-UFBFGSQYSA-N	238.306	1.919	10	20	BDCD	
CC[C@H](N[C@H]1CCNC1)c1ccccc1O	817944913	OYTKDFREGPLTGM-JQWIXIFHSA-N	220.316	1.795	10	20	BDCD	
C[C@@](O)(C(=O)Nc1ccc(N)cc1)C1CCC1	904926869	XZXIAKKMRNMAMH-ZDUSSCGKSA-N	234.299	1.758	10	20	BDCD	
C[C@H](CN)NCc1c(O)cccc1Cl	841059374	BNMJYAIMILLHNQ-SSDOTTSWSA-N	214.696	1.482	10	20	BDCD	
C[C@@H](NC(=O)CN1CCCC1)c1ccccc1O	827941433	RVPDITFUWKDDIW-LLVKDONJSA-N	248.326	1.665	10	20	BDCD	
Cc1ccc(CN2CCC[C@@H]2C(N)=O)c(O)c1	877569112	HDWGXMGAGILXEN-LLVKDONJSA-N	234.299	1.150	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1C[C@H](O)C1	720894750	YBLFTQAIQBTAMX-JLIMDTESSA-N	225.263	1.392	10	20	BDCD	
NC1CC(NCc2ccc3c(c2)CCO3)C1	906509239	BVFDJBIZQAHBGP-UHFFFAOYSA-N	218.300	1.201	10	20	BDCD	
C/C=C/C(=O)NCCc1ccc(O)c(O)c1	169273475	COLGNFDNONZNIV-NSCUHMNNSA-N	221.256	1.333	10	20	BDCD	
COc1ccc(O)c(CNCC[C@H](C)OC)c1	271901781	VUEZREMUCJKYEG-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
C[C@H](CC(N)=O)N[C@H]1CCc2cccc(O)c21	383581199	FLIXXCWEWWFSFX-SCZZXKLOSA-N	234.299	1.233	10	20	BDCD	
Cc1c(CNCc2ccc(N)cc2)cnn1C	1334775134	SLRWVNYQGAOUAR-UHFFFAOYSA-N	230.315	1.601	10	20	BDCD	
CN(Cc1ccccc1O)C1(CN)CCC1	385308347	GCBYGPWHRBXLSV-UHFFFAOYSA-N	220.316	1.705	10	20	BDCD	
CCOc1ccc(CN[C@@H]2CC[C@H]2O)c(O)c1	818231933	XKIMGWYJBFGXTN-VXGBXAGGSA-N	237.299	1.404	10	20	BDCD	
COC(=O)N1CCOc2cc(N(C)C)ccc21	742952261	ITPQCVFNAXIDSX-UHFFFAOYSA-N	236.271	1.718	10	20	BDCD	
CC[C@H](C)C[C@H](N)C(=O)Nc1ccc(N)cc1	911660888	NWISYQBOKOCACX-CABZTGNLSA-N	235.331	1.971	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CC2(F)F)c1	862755498	UKEFIWNMUZJLLU-SECBINFHSA-N	241.237	1.972	10	20	BDCD	
CO[C@H]1CCO[C@@]2(CCN(CCN=[N+]=[N-])C2)C1	409434951	RLAKTJYPLLQEDG-QWRGUYRKSA-N	240.307	1.567	10	20	BDCD	
CC[C@@H](CNCc1ccc(C)cc1O)C(=O)O	1573805445	OWOXNOYWJNSYOY-JTQLQIEISA-N	237.299	1.901	10	20	BDCD	
CC(C)(CCO)CNCc1ccccc1O	164975054	RTCJTKYMPJFRPA-UHFFFAOYSA-N	223.316	1.890	10	20	BDCD	
COc1cccc([C@@H](C)NCCO)c1O	38417065	ZQOXRMFLOCGTSQ-MRVPVSSYSA-N	211.261	1.044	10	20	BDCD	
Oc1ccccc1CN1CC[C@@]2(CCNC2)C1	31994583	UAAXXDDKCCMRPL-CQSZACIVSA-N	232.327	1.578	10	20	BDCD	
CCOCCNCc1cc(OC)ccc1O	36228292	BGPGEKFDOMCOIZ-UHFFFAOYSA-N	225.288	1.527	10	20	BDCD	
CN(C(=O)c1cccc(O)c1O)C(C)(C)C	382227917	GMJIZKZEEOVMPA-UHFFFAOYSA-N	223.272	1.968	10	20	BDCD	
COC[C@@H](O)CN[C@H](C)c1cc(F)ccc1O	94618276	SEPVVXWBBRPPTM-SCZZXKLOSA-N	243.278	1.189	10	20	BDCD	
CC(=O)C(=O)COc1cccnc1Cl	808022935	UOLJQFGDNIZZCB-UHFFFAOYSA-N	213.620	1.272	10	20	BDCD	
C[C@H](NC/C=C\c1ccc(N(C)C)cc1)C(=O)O	901463377	RRHRJMSETLVUET-WYGGZMRJSA-N	248.326	1.829	10	20	BDCD	
C[C@@H](C(=O)NCc1ccc(O)cc1O)C1CC1	910950539	HFDBRJYGMQHIEJ-MRVPVSSYSA-N	235.283	1.760	10	20	BDCD	
C[C@H]1C[C@H](N)CCN1Cc1cccc(F)c1O	846701857	DUANCMORAXKYFR-GXSJLCMTSA-N	238.306	1.843	10	20	BDCD	
COC[C@H]1CCN(C(=O)c2cc(O)cs2)C1	740128254	MWBJDYGPZPEISK-QMMMGPOBSA-N	241.312	1.562	10	20	BDCD	
N[C@H](CNCc1cc(Cl)ccc1O)C1CC1	841048156	CGZUBNBRFSCLSK-LLVKDONJSA-N	240.734	1.873	10	20	BDCD	
Oc1ccccc1CN=c1ncnc2[nH][nH]cc1-2	748307779	MDWDHEGAQKRDKP-UHFFFAOYSA-N	241.254	1.044	10	20	BDCD	
CCOc1cccc(CN(C)CCNC)c1O	70303293	WPEPJQUOSVHAFE-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
COC(=O)CC1(NCc2ccc(N)cc2)CCC1	1120268808	JPPPVYMLOZEAMV-UHFFFAOYSA-N	248.326	1.844	10	20	BDCD	
CC[C@H](NCCO)c1ccc(C)cc1O	279988726	FEHVKSCHTZTDLB-NSHDSACASA-N	209.289	1.734	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@@H](CF)C1	711472638	VNVCEDOLIQMHDD-QMMMGPOBSA-N	239.246	1.529	10	20	BDCD	
CC(=O)N1CC[C@@H](NCc2cc(C)ccc2O)C1	152930120	LKLCYUMGHNAJFH-CYBMUJFWSA-N	248.326	1.411	10	20	BDCD	
O=C(O)CCCNCc1ccc2c(c1)CCCO2	258790932	CJUJAEYTOAGQIB-UHFFFAOYSA-N	249.310	1.966	10	20	BDCD	
O[C@H]1C[C@H](NCc2ccc3c(c2)CCCO3)C1	922268067	KPUXPYWQPQTOMB-JOCQHMNTSA-N	233.311	1.625	10	20	BDCD	
C[C@@H]1CCN(Cc2ccc(N)cc2)C[C@@H]1CO	700439449	SRCMMJHNKODLHX-DGCLKSJQSA-N	234.343	1.719	10	20	BDCD	
Cc1ccc(O)c(CNCC2(N(C)C)CC2)c1	398006207	VXFMCQLQHHOJSS-UHFFFAOYSA-N	234.343	1.884	10	20	BDCD	
CNC(=O)[C@H](C)N[C@H](C)c1ccc(F)cc1O	62748173	FKZFUTRGCJQRDI-SFYZADRCSA-N	240.278	1.316	10	20	BDCD	
Cn1ccc(NC(=O)c2cccc(O)c2O)n1	126271453	WASDZIGHQOUMCQ-UHFFFAOYSA-N	233.227	1.084	10	20	BDCD	
C[C@H]1C[C@@H]1CNC(=O)Cc1ccc(N)cc1	136316430	APRVFHMROWSQMG-GXSJLCMTSA-N	218.300	1.584	10	20	BDCD	
CC[C@@H](NCCc1ccc(N)cc1)[C@@H]1CCCN1	817957017	HKBQBXIIDREOTA-CABCVRRESA-N	247.386	1.932	10	20	BDCD	
COc1cccc(N2N=C(C(C)=O)CC2=O)c1	871941424	RPSLDCZEWBDNOI-UHFFFAOYSA-N	232.239	1.377	10	20	BDCD	
CC[C@H](CO)N(C)Cc1ccc(C)cc1O	877556242	NGAJAOCJGOMDPC-GFCCVEGCSA-N	223.316	1.903	10	20	BDCD	
O=C(Nc1cccnc1O)c1cccc(O)c1O	790598171	JRFWLNNRGNBECN-UHFFFAOYSA-N	246.222	1.451	10	20	BDCD	
CCNC(=O)CN[C@H](C)c1ccc(N(C)C)cc1	37262453	KNIWGMSXPFYIOT-LLVKDONJSA-N	249.358	1.539	10	20	BDCD	
CCOC(=O)[C@@H](C)NCc1ccccc1O	49368548	HZXCUGQLDBFLNO-SECBINFHSA-N	223.272	1.433	10	20	BDCD	
COC[C@@H]1CCCN1C(=O)Cc1ccc(N)cc1	83904117	ALCCXGOUQCWKFH-ZDUSSCGKSA-N	248.326	1.449	10	20	BDCD	
CCc1cccc(CNCCOCCO)c1O	691516463	XYCMDNSEWHGACJ-UHFFFAOYSA-N	239.315	1.053	10	20	BDCD	
CO[C@@H](C)CC(=O)NCc1ccc(N)cc1	1263303779	IUEQZZHPZOOYDY-VIFPVBQESA-N	222.288	1.310	10	20	BDCD	
CO[C@H](C)CCNC(=O)Nc1ccc(N)cc1	310325524	KONKLWSBXMJWAI-SECBINFHSA-N	237.303	1.815	10	20	BDCD	
Nc1ccc(NC(=O)NCCOCCF)cc1	702622754	NMPWMEMHDWTRKW-UHFFFAOYSA-N	241.266	1.376	10	20	BDCD	
NC(=O)C[C@@H]1CCN(Cc2ccccc2O)C1	368132270	FHXWATJLWSGQID-JTQLQIEISA-N	234.299	1.090	10	20	BDCD	
CCN(CC)C(=N)NCc1ccccc1O	848985038	YKZGZZBELYCNCV-UHFFFAOYSA-N	221.304	1.758	10	20	BDCD	
CN(C[C@H]1CCOC1)c1ccc(N)cc1	58478084	ULBXWULEMZBLLM-SNVBAGLBSA-N	206.289	1.742	10	20	BDCD	
Cc1cccc(O)c1CNCCCC(=O)O	1605344927	FIYGRWSGLSJXSJ-UHFFFAOYSA-N	223.272	1.655	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C2(O)CCC2)cc1	184602046	KMVYFIAWGMFHAM-UHFFFAOYSA-N	248.326	1.284	10	20	BDCD	
COC[C@H](C)NCc1cc2c(cc1O)OCO2	42879129	GTHBMDQUJHHUNB-QMMMGPOBSA-N	239.271	1.245	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H](O)C2)cc1	84933962	AUOMXQXYXSTDNS-CYBMUJFWSA-N	220.316	1.319	10	20	BDCD	
CNC[C@@H]1CCCN1Cc1ccc(N(C)C)cc1	133047796	BTJJWVSIDQKNJO-HNNXBMFYSA-N	247.386	1.936	10	20	BDCD	
C[C@@H](N[C@@H]1CCNC1)c1cc(F)cc(F)c1O	817944971	QLHSIDGVMVKUSC-VXNVDRBHSA-N	242.269	1.683	10	20	BDCD	
COC(=O)c1cnc(SC[C@H](C)CO)s1	829681476	XHZVVICCBDTSBE-ZCFIWIBFSA-N	247.341	1.650	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=N)N(C)C	849009374	ZPLNBKGBHNIACW-UHFFFAOYSA-N	234.347	1.647	10	20	BDCD	
CCOc1cccc(CNC[C@@H](C)CN)c1O	841049208	OCTWTHFJTCBRPQ-JTQLQIEISA-N	238.331	1.475	10	20	BDCD	
CCOC(C)(C)CNC(=O)c1cc(O)cs1	782064423	GGTLHYUATXMBAD-UHFFFAOYSA-N	243.328	1.999	10	20	BDCD	
CO[C@@H]1CN(Cc2cc(F)ccc2O)CCO1	895969045	VUBNUMIJOISOKD-LBPRGKRZSA-N	241.262	1.336	10	20	BDCD	
CCc1cccc(CN[C@H]2C[C@H](O)C2)c1O	827833317	XEZRYJMLCMSVSR-HAQNSBGRSA-N	221.300	1.568	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)[C@@H](C)CN1C	1120371046	NSKVUXFKFFFPJV-RYUDHWBXSA-N	233.359	1.793	10	20	BDCD	
CCCN[C@@H](C)c1cccc(-c2nn[nH]n2)c1O	1590637872	HKCFAFYUKJQAOV-QMMMGPOBSA-N	247.302	1.633	10	20	BDCD	
Cc1nonc1CNCc1ccccc1O	162953118	VLBRVFPAYINAFS-UHFFFAOYSA-N	219.244	1.373	10	20	BDCD	
CC(C)(CO)NCc1ccc2c(c1)CCCO2	258949137	WXASCEYQGBKWND-UHFFFAOYSA-N	235.327	1.872	10	20	BDCD	
COC(=O)CN(C)Cc1ccc(N(C)C)cc1	53100522	ICMWNKSNPASTOZ-UHFFFAOYSA-N	236.315	1.357	10	20	BDCD	
COCCCC(=O)Nc1ccc(N)cc1	22215469	SNEIYRHICZXZGS-UHFFFAOYSA-N	208.261	1.634	10	20	BDCD	
COCCCNCc1cc(OC)ccc1O	20143038	CWSXKYCTBMSDHD-UHFFFAOYSA-N	225.288	1.527	10	20	BDCD	
C/C=C(\C)C(=O)NCCc1ccc(O)c(O)c1	179685487	OZUXRQAYQDJSBY-YCRREMRBSA-N	235.283	1.723	10	20	BDCD	
CONC(=O)NCc1ccc(N2CCCC2)cc1	77840129	RKJCKYDWWXRYGD-UHFFFAOYSA-N	249.314	1.647	10	20	BDCD	
C[C@H](O)CN[C@@H](C)c1cc(F)ccc1O	87111359	CECSZDLHXUAKEF-YUMQZZPRSA-N	213.252	1.563	10	20	BDCD	
C[C@H]1C[C@@H](NCCc2ccc(N)cc2)CCN1C	817956275	VNRNFJXPDVJFOF-WFASDCNBSA-N	247.386	1.884	10	20	BDCD	
CCOc1ccc(O)c(CN(C)CC(=O)O)c1	820387572	ULZXMQPYIVYWAF-UHFFFAOYSA-N	239.271	1.307	10	20	BDCD	
N[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)C1	906507777	BVFDJBIZQAHBGP-HAQNSBGRSA-N	218.300	1.201	10	20	BDCD	
Cc1cccc(CNC[C@@]2(C)CCC(=O)N2)c1O	835061145	QGFLAKXMNHZZFQ-CQSZACIVSA-N	248.326	1.459	10	20	BDCD	
C[C@H]1COCCN(C(=O)c2cc(O)cs2)C1	754512702	RPGYPMWQUVUEOL-MRVPVSSYSA-N	241.312	1.562	10	20	BDCD	
Cc1ccc(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c(O)c1	877546959	WCYMUEUAFBNMQS-ITGUQSILSA-N	233.311	1.371	10	20	BDCD	
C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1O	897684877	YHTRMTLNWXJSSK-QPUJVOFHSA-N	241.718	1.858	10	20	BDCD	
COc1cc(C(=O)N2CC(N=[N+]=[N-])C2)ccn1	409424876	ZFYVXSWHESKQHI-UHFFFAOYSA-N	233.231	1.225	10	20	BDCD	
Cn1nccc1CCNCc1cc(F)ccc1O	231036701	CMGURJXUDDMBMG-UHFFFAOYSA-N	249.289	1.597	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)C[C@H]1CO	700439447	SRCMMJHNKODLHX-AAEUAGOBSA-N	234.343	1.719	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1	249989825	KOTBDPMCRMBPNV-ITGUQSILSA-N	230.311	1.931	10	20	BDCD	
COc1ccc(CN[C@H]2CCOC2)cc1C	75149827	DVKKARGQHXUIIL-LBPRGKRZSA-N	221.300	1.882	10	20	BDCD	
C[C@@H]1C[C@H](C(=O)NCc2ccccc2O)CCN1	235367741	JIHNZNOYCXUVCU-GHMZBOCLSA-N	248.326	1.397	10	20	BDCD	
CC[C@H](C)C(=O)NCCc1ccc(N)cc1	40675597	BJHGDJGHWVZDQC-JTQLQIEISA-N	220.316	1.974	10	20	BDCD	
Cc1cc(CNCc2ccccc2O)n(C)n1	228416251	MUZKAALDDUNENK-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
C[C@@H](CF)NC(=O)/C=C/c1ccc(O)c(O)c1	292026758	XTBOGXXTOOIKGJ-WGAJWPLOSA-N	239.246	1.585	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1CC(F)C1	828286683	DSHFRVOQXYNNOK-UHFFFAOYSA-N	229.182	1.031	10	20	BDCD	
CN(Cc1ccccc1O)C1(CO)CC1	827903934	QVHUEAPGZMCTOP-UHFFFAOYSA-N	207.273	1.349	10	20	BDCD	
CC[C@@H](N)CNCc1cc(C)ccc1O	841072288	NLGKSRGEWQLZCV-LLVKDONJSA-N	208.305	1.528	10	20	BDCD	
CCc1cccc(CN2CC(=O)N[C@H](C)C2)c1O	848915275	FFZZPBXSAKSMMD-SNVBAGLBSA-N	248.326	1.275	10	20	BDCD	
Cc1cc(O)c(CN[C@@H]2CCN(C)C2)cc1C	776175029	VWYWJPRRHCUJIA-CYBMUJFWSA-N	234.343	1.803	10	20	BDCD	
O=C(NCc1cccnn1)c1cc(O)cs1	774298343	JVHIMPABFZBIFB-UHFFFAOYSA-N	235.268	1.174	10	20	BDCD	
NC[C@H](NCc1ccc(N)cc1)C1CC1	1120371052	NWNOKMXCAQJUMV-LBPRGKRZSA-N	205.305	1.096	10	20	BDCD	
[N-]=[N+]=NCc1c[nH]nc1-c1cnccn1	409441076	QASMUFHJONXORH-UHFFFAOYSA-N	201.193	1.677	10	20	BDCD	
CCN1CC[C@@H](Sc2nccs2)C1=O	1327206368	MMIXVKPBLAOMQP-SSDOTTSWSA-N	228.342	1.856	10	20	BDCD	
CC(C)CNCC(=O)NCCc1ccc(N)cc1	1261434550	MUVNGNCPBHTENY-UHFFFAOYSA-N	249.358	1.173	10	20	BDCD	
CCc1cccc(CNC2(C)CNC2)c1O	1578266772	QELBRBGSSFKYIF-UHFFFAOYSA-N	220.316	1.406	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C[S@](C)=O)c1	164301136	VZIPTOJJZANOFJ-MGPLVRAMSA-N	241.356	1.557	10	20	BDCD	
COc1cccc(O)c1CN(C)CCCN	843050176	AHGIPRAKGINHEQ-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
Cc1ccc(CNC(C)(C)CO)c(O)c1	83345894	DMWNHBBDXVOHEO-UHFFFAOYSA-N	209.289	1.561	10	20	BDCD	
Cn1ccnc(NCc2ccccc2O)c1=O	135240987	GVACFSWGHJKKLU-UHFFFAOYSA-N	231.255	1.098	10	20	BDCD	
COc1ccc(CNCC(C)(C)N)cc1C	258737648	FPFLKXCWKKJSDK-UHFFFAOYSA-N	222.332	1.831	10	20	BDCD	
O=C1O[C@H]2C[C@H]1N(Cc1cc(F)ccc1O)C2	294721945	FOHFNDINDCTHGZ-VHSXEESVSA-N	237.230	1.031	10	20	BDCD	
CNCCNCc1ccc(N(C)C)cc1C	841037772	VMWNHFCDCUXMBX-UHFFFAOYSA-N	221.348	1.370	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](CN)C1CC1	841028252	NSBRQYUTODJVOT-OAHLLOKOSA-N	247.386	1.888	10	20	BDCD	
CCOc1ccc(O)c(CN(C)C[C@@H](C)N)c1	863653488	LFCGHAIXLQHPJA-SNVBAGLBSA-N	238.331	1.570	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C(C)C)c1	862759422	FCAKSKMOLDHVKV-UHFFFAOYSA-N	207.273	1.973	10	20	BDCD	
Cc1cc(Cn2cc(CO)nn2)ccc1N(C)C	881379133	ZPHOBDYEEOCVEM-UHFFFAOYSA-N	246.314	1.193	10	20	BDCD	
COCC1CN(Cc2ccc(N(C)C)cc2)C1	895970851	HIWVKVDVZWODID-UHFFFAOYSA-N	234.343	1.831	10	20	BDCD	
Oc1cc2c(cc1CNCc1ccon1)OCO2	93305899	IPNVQLSQOIQOSE-UHFFFAOYSA-N	248.238	1.399	10	20	BDCD	
C[C@H](NC[C@H]1C[C@H](O)C1)c1ccccc1O	720976137	DDHSKTPLTPNWFL-DCAQKATOSA-N	221.300	1.814	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1C[C@H]1C(=O)O)c1ccccc1O	1599839890	RGDJJZOFJFKJTC-FKTZTGRPSA-N	249.266	1.290	10	20	BDCD	
COc1ccc(N(C)CCN2CCCC2=O)cc1	844353517	QQZXQOZQCOZBRU-UHFFFAOYSA-N	248.326	1.754	10	20	BDCD	
O=C(O)C[C@@H](O)CSc1nccs1	135001409	OZUGGAAOSNLGOL-RXMQYKEDSA-N	219.287	1.071	10	20	BDCD	
CC(=O)NCc1c(O)ccc2c1CCCC2	174515564	VPULCNOEOIBHOX-UHFFFAOYSA-N	219.284	1.907	10	20	BDCD	
NCC[C@H]1CCCN(Cc2ccccc2O)C1	70169759	YVGDPDCQHZNYIB-GFCCVEGCSA-N	234.343	1.953	10	20	BDCD	
Cc1ccc(O)c(CN(CCO)CC(F)F)c1	193027982	QBORWHUNHKQXDP-UHFFFAOYSA-N	245.269	1.760	10	20	BDCD	
C[C@H](O)C[C@H](C)CNC(=O)c1cc(O)cs1	748375770	NDEAFWMGCPLENE-YUMQZZPRSA-N	243.328	1.591	10	20	BDCD	
C[C@@H]1[C@H](O)CCN1C(=O)c1cc(O)cs1	854850345	CONVVCHZKYGLIN-HTRCEHHLSA-N	227.285	1.049	10	20	BDCD	
Cc1ccc(CN[C@H]2C[C@@H](O)C2(C)C)c(O)c1	877430720	POQAZVNFQOALQQ-QWHCGFSZSA-N	235.327	1.950	10	20	BDCD	
Cc1ccc(CN[C@H]2CO[C@@H](C)C2)c(O)c1	877608209	RMPDYCVKXDRFNL-CMPLNLGQSA-N	221.300	1.968	10	20	BDCD	
Cc1ccc(CN[C@@H](C)CCO)c(O)c1	877052116	RLDYHBHHSROUQP-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
CC[C@H](CO)N[C@@H](C)c1c(O)cccc1F	886489734	POEJCEFRAIURLA-DTWKUNHWSA-N	227.279	1.953	10	20	BDCD	
CC[C@H](C(=O)O)N1CCc2cc(OC)ccc21	1776681960	CIPLTXYUYYZBCG-LLVKDONJSA-N	235.283	1.921	10	20	BDCD	
Nc1ccc(CN2CCC[C@H](CO)C2)cc1	36205777	PRZDDEKNIZYWLX-LBPRGKRZSA-N	220.316	1.473	10	20	BDCD	
CCCC[C@H](CN)NC(=O)Cc1ccc(N)cc1	262596513	KZLZQRILGCHSGT-CYBMUJFWSA-N	249.358	1.445	10	20	BDCD	
CC[C@@H](CNC(=O)c1cccc(O)c1O)OC	291881872	HGHGAMLCISFWKU-QMMMGPOBSA-N	239.271	1.253	10	20	BDCD	
C[C@H]1C[C@@H](NC(=O)c2cccc(O)c2O)CO1	401487454	XZWHEORVCJOKKG-JGVFFNPUSA-N	237.255	1.005	10	20	BDCD	
N[C@@H]1CCC[C@H]1CC(=O)NCc1ccccc1O	405228029	UJPXSJWTXKKRJH-CMPLNLGQSA-N	248.326	1.526	10	20	BDCD	
O=C(NC[C@H]1CCC=CO1)c1cccc(O)c1O	380065609	HPVVNTIUNWIVIV-SECBINFHSA-N	249.266	1.520	10	20	BDCD	
OC[C@H]1C[C@H](N[C@@H]2CCc3cccc(O)c32)C1	927149185	XBPKFBOQYPTHQL-YUSALJHKSA-N	233.311	1.740	10	20	BDCD	
O=C(NN1CCCCC1)c1cccc(O)c1O	126514750	IRSYPQUPCKTOQX-UHFFFAOYSA-N	236.271	1.229	10	20	BDCD	
Cc1ccc(O)c(CNCC(F)(F)CO)c1	183869983	WSKLNPDRMMWSRL-UHFFFAOYSA-N	231.242	1.418	10	20	BDCD	
CNC[C@H]1CCN(Cc2ccccc2O)C1	70798652	KONNOAONTYZBHQ-LLVKDONJSA-N	220.316	1.434	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCCCCO)c1	193283057	SZQMSUMCFHQXHY-JTQLQIEISA-N	239.315	1.824	10	20	BDCD	
COc1ccc(CNCCc2ncn[nH]2)cc1C	80603137	QQIOROQGOMYHFW-UHFFFAOYSA-N	246.314	1.454	10	20	BDCD	
CC(C)(C)[C@H](O)C(=O)NCc1ccccc1O	735855406	CDRKSLLPZCANEB-LLVKDONJSA-N	237.299	1.415	10	20	BDCD	
CO[C@H](C(=O)N[C@H](C)c1ccccc1O)C1CC1	827946838	STPONYFXWYKOTQ-RNCFNFMXSA-N	249.310	1.994	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H]1CCCN1	841036585	RKJKIDGAVQQTFJ-CQSZACIVSA-N	247.386	1.903	10	20	BDCD	
CCN(CC)c1ccc(CN[C@H](C)CN)cc1	841059885	KYLUMQASRUJLPW-GFCCVEGCSA-N	235.375	1.970	10	20	BDCD	
CC(C)(O)Cc1cn(-c2ccc(N)cc2)nn1	849134892	UUYGLEPMZQPQHW-UHFFFAOYSA-N	232.287	1.163	10	20	BDCD	
C[C@@H](NCc1nccn1C)c1ccccc1O	71273074	YYPMOROQHVKZLN-SNVBAGLBSA-N	231.299	1.977	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](CO)CC(F)F	894567506	RFCIFACKUACEMM-SECBINFHSA-N	245.269	1.806	10	20	BDCD	
CC[C@H]1CN(c2ccc(N)cc2)CC[C@H]1O	409436079	XYLFIKIJRGJELC-GXFFZTMASA-N	220.316	1.866	10	20	BDCD	
CNC[C@H]1CCCN(Cc2ccc(N)cc2)C1	1337833977	IWPJJSFMHUGBAK-CYBMUJFWSA-N	233.359	1.700	10	20	BDCD	
CCC[C@H](O)C(=O)NCc1ccc(N)cc1	1342021638	MYMISPXFLWZRIW-NSHDSACASA-N	222.288	1.046	10	20	BDCD	
COc1cccc(O)c1CN(C)CCN(C)C	809729616	LYSHGZSUBVWCHU-UHFFFAOYSA-N	238.331	1.394	10	20	BDCD	
COc1ccc(CNC2CC(OC)C2)c(O)c1	230688891	CTVLNVQTLOYIPG-UHFFFAOYSA-N	237.299	1.668	10	20	BDCD	
C[C@@H](O)CCCNCc1cc(F)cc(F)c1O	708485208	LRPMIWWELHDPLQ-MRVPVSSYSA-N	245.269	1.921	10	20	BDCD	
c1cc2c(cc1CNC1CCOCC1)CCO2	37363107	AUBWQIZATNDGKJ-UHFFFAOYSA-N	233.311	1.890	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)CCCO)c1	87358807	UPHVBBLCZFWPJF-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
Nc1ccc(CN2CCC[C@H]2CO)cc1	48859611	QVIXAMXKUNBXRA-LBPRGKRZSA-N	206.289	1.226	10	20	BDCD	
COc1cccc(CN(C)CC(C)(C)O)c1O	93414641	DYPUWFLOYVQDFE-UHFFFAOYSA-N	239.315	1.604	10	20	BDCD	
Oc1ccccc1CN[C@H]1CCc2c[nH]nc2C1	363940275	XOOYODZUZZPZDV-LBPRGKRZSA-N	243.310	1.762	10	20	BDCD	
Cc1ccc(O)c(CN(C)[C@H](C)CO)c1	289517183	VCTYDJQENQJXAZ-SNVBAGLBSA-N	209.289	1.513	10	20	BDCD	
O=C(OCCCCCO)c1cccc(O)c1O	803439421	BGYKOGNDQKTVIG-UHFFFAOYSA-N	240.255	1.417	10	20	BDCD	
Cc1cc(CN(C)CCO)ccc1N(C)C	815015980	QUCROBSYVIIDCK-UHFFFAOYSA-N	222.332	1.485	10	20	BDCD	
CN(CC(=O)O)Cc1c(O)ccc2ccncc12	739631458	HGIPSMLTPBSRRH-UHFFFAOYSA-N	246.266	1.457	10	20	BDCD	
Cc1cccc(CNC[C@@H](C)CN)c1O	841048033	FVYPSPZBXVSEET-VIFPVBQESA-N	208.305	1.385	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@H]1[C@@H]2CNC[C@@H]21	841077231	FINBWUMBNZEGNG-JZYVYDRUSA-N	238.718	1.353	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H](C)[C@@H](O)C2)c1	897681367	SQYCQZDEEOPFET-ZANVPECISA-N	237.299	1.213	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCc2nc[nH]n2)c1	37919247	QIUBJTRTLFSIIE-MRVPVSSYSA-N	248.286	1.370	10	20	BDCD	
CC1(C)OC[C@H]2C[C@]21NCc1ccc(N)cc1	1334753957	KGWMABICENWHJI-RISCZKNCSA-N	232.327	1.926	10	20	BDCD	
COc1cccc(O)c1CN[C@@H]1CO[C@H](C)C1	842773590	BLKJKFCFVAMJDV-ZJUUUORDSA-N	237.299	1.668	10	20	BDCD	
COc1ccc(CNC[C@@H](C)O)cc1C	35052332	SXZXRHPWASCLLV-SNVBAGLBSA-N	209.289	1.474	10	20	BDCD	
CC[C@H](NCc1cnnn1C)c1ccccc1O	287386006	PUGIBNPODSIOBZ-LBPRGKRZSA-N	246.314	1.762	10	20	BDCD	
COCCC(=O)NCc1cccc(OC)c1O	105649724	URJMYMPHMIUOLL-UHFFFAOYSA-N	239.271	1.054	10	20	BDCD	
O=C(Nc1ccccn1)c1cccc(O)c1O	126191945	VUBKCYDTADIBIT-UHFFFAOYSA-N	230.223	1.745	10	20	BDCD	
CN(Cc1cc2c(cc1O)OCO2)C1CC1	46477621	MJSQOBQQQGQXKB-UHFFFAOYSA-N	221.256	1.715	10	20	BDCD	
C[C@@H]1CCN(Cc2cc(F)ccc2O)[C@@H]1CO	191182621	CYVDFJJFHIDGLN-BXKDBHETSA-N	239.290	1.734	10	20	BDCD	
Oc1ccc(F)cc1CN1CCCOCC1	226562556	QUMKBRYMOPOLGI-UHFFFAOYSA-N	225.263	1.754	10	20	BDCD	
CC1=CCCN(C(=O)c2cccc(O)c2O)C1	230812868	AFCWIZPXCALSRU-UHFFFAOYSA-N	233.267	1.890	10	20	BDCD	
CCOc1ccc(N(CC)CC(=O)NC)cc1	269661449	XVIFGRGFEKVNHM-UHFFFAOYSA-N	236.315	1.658	10	20	BDCD	
CCC[C@@](C)(O)C(=O)NCc1ccccc1O	269575254	JDRYJJZSXRFIOH-CYBMUJFWSA-N	237.299	1.560	10	20	BDCD	
C[C@@H](N[C@@H]1COCC[C@H]1O)c1ccccc1O	710891873	UAGPAMFQYRYTEK-IRUJWGPZSA-N	237.299	1.193	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@@H]2CCNC2)c1	817944711	KCWUSYLFTCGDRP-NXEZZACHSA-N	236.315	1.413	10	20	BDCD	
O=C(O[C@H]1CCOC1)c1cc(O)cs1	837512731	CQIGFOCMFVPVSW-ZETCQYMHSA-N	214.242	1.399	10	20	BDCD	
COCC[C@@H](C)CNC(=O)c1cc(O)cs1	839810346	LTFHEIFZKVDOAQ-MRVPVSSYSA-N	243.328	1.856	10	20	BDCD	
COc1ccc(O)c(CN2CC(OC)C2)c1	839131002	LWBOFHGKAMCIOY-UHFFFAOYSA-N	223.272	1.231	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@@H]1CCCNC1	841043866	YBUMHHTUYNGKDL-SECBINFHSA-N	240.734	1.887	10	20	BDCD	
COc1cccc(CNC(=O)c2cnco2)c1O	759608634	PPQKDIAMZNHTTJ-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2(N(C)C)CC2)c1	862755468	SXNDOFDSEXODFO-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
CNC(=O)CCN(C)Cc1c(C)cccc1O	876683747	FXBNPZBXSRENCK-UHFFFAOYSA-N	236.315	1.269	10	20	BDCD	
CN(C(=O)CC1CCNCC1)c1ccc(N)cc1	877078929	JZAVDYCEHNUGDF-UHFFFAOYSA-N	247.342	1.621	10	20	BDCD	
COC(=O)c1cnc(SCOC(C)=O)s1	1119673885	ZITJPZYOKHXUSB-UHFFFAOYSA-N	247.297	1.542	10	20	BDCD	
CN(C(=O)CCC(C)(C)N)c1ccc(N)cc1	877078986	MNRXKGFXCAHFHG-UHFFFAOYSA-N	235.331	1.749	10	20	BDCD	
COC/C=C/C(=O)N(C)Cc1ccccc1O	791384673	CLHAFDOXXCYFFO-VMPITWQZSA-N	235.283	1.553	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC2(CCCCO2)CC1	409427861	LAODDBREWRUYEN-UHFFFAOYSA-N	238.291	1.858	10	20	BDCD	
O=C(O)CCC(=O)N1Cc2cccc(O)c2C1	1594995785	AAACFFTWRJLSGK-UHFFFAOYSA-N	235.239	1.099	10	20	BDCD	
CC(C)(NCc1ccc2c(c1)CCCO2)C(=O)O	258698503	DLNRGPZRZATIIS-UHFFFAOYSA-N	249.310	1.964	10	20	BDCD	
COc1cccc(O)c1CNCc1cncn1C	810160153	WJQVOKFMNZLNPT-UHFFFAOYSA-N	247.298	1.424	10	20	BDCD	
CNC[C@H]1CCCN1Cc1cc(F)ccc1O	220322978	MUEBSCHYTIBLAF-GFCCVEGCSA-N	238.306	1.715	10	20	BDCD	
CCOc1cccc(CN[C@@H](C)CO)c1O	35603281	PSOQUSGHYPBGOA-VIFPVBQESA-N	225.288	1.261	10	20	BDCD	
CCCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1	183480950	ZNXKXPYAKWXBLH-VIFPVBQESA-N	237.299	1.945	10	20	BDCD	
CC[C@H](C(=O)O)N(C)Cc1cc(F)ccc1O	233879725	DQIJKWUQWOYJOF-SNVBAGLBSA-N	241.262	1.826	10	20	BDCD	
C[C@@H]1CC(=O)NCCN1Cc1ccccc1O	377825474	CBLCOWDAIZQUBP-SNVBAGLBSA-N	234.299	1.103	10	20	BDCD	
CC(=O)C(=O)CSc1nncc2ccccc12	808019502	BDBQREVQYDIIJO-UHFFFAOYSA-N	246.291	1.880	10	20	BDCD	
COC1CN(Cc2c(O)ccc3ccncc23)C1	738226521	XOGIBOWGUFSBCQ-UHFFFAOYSA-N	244.294	1.771	10	20	BDCD	
CCn1nnc(C)c1CN(C)c1ccc(N)cc1	863558817	YKRYGLAAFDVBRA-UHFFFAOYSA-N	245.330	1.825	10	20	BDCD	
CN1CC[C@H]1CNCc1ccccc1O	712608580	NBZLBCJVUHGHJX-NSHDSACASA-N	206.289	1.186	10	20	BDCD	
C[C@H](N)CC(=O)N[C@H](C)c1ccccc1O	870987714	BBDQFDQURIUISO-DTWKUNHWSA-N	222.288	1.307	10	20	BDCD	
CO[C@H](C)CNCc1c(C)cccc1O	877463452	DHDVNCIYUYZHOM-SNVBAGLBSA-N	209.289	1.825	10	20	BDCD	
C[C@@H](NCCN(C)C)c1ccc(F)cc1O	62744661	BDVDLAPZIADKLY-SECBINFHSA-N	226.295	1.744	10	20	BDCD	
C[C@@H](O)CCN(C)Cc1cc(F)ccc1O	180170363	OAWOHJLFBNFHAK-SECBINFHSA-N	227.279	1.734	10	20	BDCD	
CNC(=O)[C@H](C)CN(C)Cc1ccc(N)cc1	234378875	PJZWDRICASVBNB-SNVBAGLBSA-N	235.331	1.083	10	20	BDCD	
COc1ccc(O)c(CNC(C)(C)C(=O)O)c1	833733977	XQLXALURLGSENZ-UHFFFAOYSA-N	239.271	1.354	10	20	BDCD	
COCC1(C)CN(Cc2cc(F)ccc2O)C1	839144488	WTSQERFQCUFOCH-UHFFFAOYSA-N	239.290	2.000	10	20	BDCD	
CC(C)[C@](C)(O)CNC(=O)c1cc(O)cs1	743713771	YFRVNOVEUSEZTD-LLVKDONJSA-N	243.328	1.591	10	20	BDCD	
C[C@H]1C[C@@H](CNCCc2ccc(N)cc2)CCN1	841037596	AZTURAPXUIGATL-JSGCOSHPSA-N	247.386	1.789	10	20	BDCD	
CN[C@H]1CCCN(Cc2cccc(C)c2O)C1	843048558	HIASOABELCXPLI-ZDUSSCGKSA-N	234.343	1.884	10	20	BDCD	
Cc1cccc(O)c1CNCCn1ccnc1C	876990702	AGJUDOMVDWNSBD-UHFFFAOYSA-N	245.326	1.995	10	20	BDCD	
OCCNCc1cccc(Br)c1O	42411877	RWVLCXFOTXFWRT-UHFFFAOYSA-N	246.104	1.237	10	20	BDCD	
COc1ccc(CNCc2ccon2)c(O)c1	93305909	BBFARCGWLDFYFQ-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@H]2CCCCO2)cc1	95030806	SEOIYYMXUKFQDT-CYBMUJFWSA-N	248.326	1.844	10	20	BDCD	
Nc1ccc(CNCC[C@H]2CCNC2)cc1	1352790071	OGDLJPKMAZGBIV-LBPRGKRZSA-N	219.332	1.358	10	20	BDCD	
CC[C@@H](NC(=O)c1cccc(O)c1O)C(F)F	833204436	NHZSPGZKPMEUCH-SSDOTTSWSA-N	245.225	1.871	10	20	BDCD	
CCn1ccc(C(=O)NCc2ccccc2O)n1	857471766	KHEAAOSOGHVBKP-UHFFFAOYSA-N	245.282	1.539	10	20	BDCD	
Oc1cc2c(cc1CN[C@@H]1C=CCC1)OCO2	698326604	KKVHZVWXYVFLGV-SNVBAGLBSA-N	233.267	1.929	10	20	BDCD	
C/C=C(\C)C(=O)NCc1cc(OC)ccc1O	176314232	WZGVQKPFPJVLOR-RUDMXATFSA-N	235.283	1.983	10	20	BDCD	
CCNC(=O)N[C@@H](C)c1cc(OC)ccc1O	171730851	PWYLEJUGYLKTTO-QMMMGPOBSA-N	238.287	1.781	10	20	BDCD	
CN(C)c1ccc(CN(C)[C@@H]2CCOC2)cc1	120180020	XHDQNYYLOZCKFB-CQSZACIVSA-N	234.343	1.973	10	20	BDCD	
Cc1cc(O)c(CN2CCN(C)CC2)cc1C	125076860	IEKLEOSKEXLWNI-UHFFFAOYSA-N	234.343	1.756	10	20	BDCD	
COC(=O)[C@H](C)Sc1ncc([N+](=O)[O-])s1	189970627	BYEKVWZAOLJGSX-BYPYZUCNSA-N	248.285	1.705	10	20	BDCD	
CNC(=O)[C@H](C)N[C@@H](C)c1ccccc1O	42560266	OTWYEEWJIQQPFP-IUCAKERBSA-N	222.288	1.177	10	20	BDCD	
C[C@@H](CN)CN[C@@H](C)c1cc(F)cc(F)c1O	817961665	BXTVQJUKHQXSBW-YUMQZZPRSA-N	244.285	1.916	10	20	BDCD	
C[C@@H]1Cc2c(cccc2-c2nccn2C)C(=O)N1	656369662	RHFNVUBRIVBXHG-SECBINFHSA-N	241.294	1.762	10	20	BDCD	
C[C@H](CCCCN)NCCc1ccc(N)cc1	817957060	IDBGCSNCBGXYLX-GFCCVEGCSA-N	235.375	1.918	10	20	BDCD	
C[C@H](N)C[C@H](C)NCCc1ccc(N)cc1	817957705	OJXZJKQEDWOGGP-QWRGUYRKSA-N	221.348	1.527	10	20	BDCD	
CC[C@H](NCc1cccc(C)c1O)[C@H](C)O	386737653	XHQXRQRBRPRZTQ-JQWIXIFHSA-N	223.316	1.950	10	20	BDCD	
CCc1cccc(CN(C)CCO)c1O	848876766	MFJHNEYNNBIYKP-UHFFFAOYSA-N	209.289	1.379	10	20	BDCD	
O=C(N=c1cc[nH]cc1)NCc1ccccc1O	748325594	QPSLAGRNIXESQI-UHFFFAOYSA-N	243.266	1.531	10	20	BDCD	
C[C@H](NC[C@H]1C[C@@H](N)C1)c1cc(F)ccc1O	873252802	VSDALQXVAIZWDZ-ATZCPNFKSA-N	238.306	1.919	10	20	BDCD	
CN(C(=O)C[C@H]1CCCN1)c1ccc(N)cc1	877079261	WJPLKULLJPATAW-LLVKDONJSA-N	233.315	1.374	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C(F)F)cc1F	787267415	NOPJDJQAXGVELL-UHFFFAOYSA-N	246.232	1.773	10	20	BDCD	
OCc1nc(Sc2ncc(Cl)s2)n[nH]1	795163940	QTPDRLNWHOVFEI-UHFFFAOYSA-N	248.720	1.558	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)c1cccnc1	82308508	HLTYTJUGJBZSAI-UHFFFAOYSA-N	244.250	1.423	10	20	BDCD	
C[C@@H](NC[C@H]1CCN1C)c1ccc(F)cc1O	712594665	NPGBUMQSPHPECH-MWLCHTKSSA-N	238.306	1.886	10	20	BDCD	
C[C@H]1CCN(Cc2ccc(N)cc2)[C@@H](C(N)=O)C1	1337838294	NHWXLNKQJIZWLW-GXFFZTMASA-N	247.342	1.355	10	20	BDCD	
Oc1c(Cl)cccc1CNC[C@H]1C[C@H](O)C1	720907064	IRDBTOMZYFPJIR-CZMCAQCFSA-N	241.718	1.906	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C[S@@](C)=O)c1	164301378	VZIPTOJJZANOFJ-QFYYESIMSA-N	241.356	1.557	10	20	BDCD	
OC[C@H]1C[C@H](NCc2ccc3c(c2)CCCO3)C1	923004385	BXFQLLIEGCFIOR-MQMHXKEQSA-N	247.338	1.872	10	20	BDCD	
CC(=O)NCCN(C)Cc1cc(F)ccc1O	308320683	YIEVKUXWHASGPG-UHFFFAOYSA-N	240.278	1.099	10	20	BDCD	
Oc1cc2c(cc1CNCc1cocn1)OCO2	397949137	YPGCBRQNGGSCQP-UHFFFAOYSA-N	248.238	1.399	10	20	BDCD	
C/C=C/C(=O)NCc1ccc(N(C)C)cc1	82237732	PCPXLEODDNWHLT-SNAWJCMRSA-N	218.300	1.945	10	20	BDCD	
Cn1ccc(CNC(=O)c2cccc(O)c2O)c1	229413070	CBAXHXPQAUDXBK-UHFFFAOYSA-N	246.266	1.366	10	20	BDCD	
CC[C@@H](C(=O)O)N(C)Cc1cc(F)ccc1O	234057439	DQIJKWUQWOYJOF-JTQLQIEISA-N	241.262	1.826	10	20	BDCD	
Cc1cc(CN[C@@H](CO)C2CC2)ccc1N(C)C	815090154	JIAUDQMCTFIRQL-AWEZNQCLSA-N	248.370	1.922	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1CC2(CC2)C1	830559322	MUJGUAHDJAAJIM-UHFFFAOYSA-N	247.294	1.904	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@@H]1CCCNC1	841032662	IRETYQPLQSGJAZ-SNVBAGLBSA-N	238.306	1.621	10	20	BDCD	
CCc1cccc(CN2C[C@H](O)C[C@@H]2C)c1O	848905978	OTRSUNDXEVTQFS-GXFFZTMASA-N	235.327	1.910	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2C[C@H](CO)C2)cc1C	923003556	GZHOOFBTVYMQTB-AULYBMBSSA-N	235.327	1.870	10	20	BDCD	
CN1C(=O)/C(=C\c2ccn(C)c2)SC1=S	763284741	VUOGJPBPXSGNGW-VMPITWQZSA-N	238.337	1.856	10	20	BDCD	
CC1(C)[C@@H](O)C[C@H]1NC(=O)c1cc(O)cs1	779454370	OFXYHRFAMFZCKW-BDAKNGLRSA-N	241.312	1.343	10	20	BDCD	
COc1cc(C)cc(CNCCCO)c1O	894145684	GZOQYKCNKPILQF-UHFFFAOYSA-N	225.288	1.181	10	20	BDCD	
Nc1ccc(N2CC(O)(C(F)(F)F)C2)cc1	409426404	CGCDKUVMXPXMKZ-UHFFFAOYSA-N	232.205	1.382	10	20	BDCD	
CCCCN(CC)C(=O)CN1CC(N=[N+]=[N-])C1	409423649	QALHYWRVZJJJOL-UHFFFAOYSA-N	239.323	1.630	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](C)C[C@H](C)O	782977465	FXFSVXNQGGFYMZ-UWVGGRQHSA-N	239.315	1.650	10	20	BDCD	
CCNC(=O)[C@H](C)N[C@H]1CCc2cccc(O)c21	295778212	ARVMKWNVMYQGMP-ONGXEEELSA-N	248.326	1.494	10	20	BDCD	
C[C@H](NC(=O)[C@H]1C[C@H]1C(=O)O)c1ccccc1O	1599899803	RGDJJZOFJFKJTC-UJNFCWOMSA-N	249.266	1.290	10	20	BDCD	
CN(CC1CC1)C(=O)NCCc1ccc(N)cc1	841956791	IKZQQOFMMMXQOT-UHFFFAOYSA-N	247.342	1.863	10	20	BDCD	
Oc1cccc2c1[C@@H](NCC[C@@H]1CCNC1)CC2	817954817	KUFBECSPYBDVDQ-AAEUAGOBSA-N	246.354	1.969	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@@H]2CCNC2)c(O)c1	817944584	HGRSXBNSDIXAFX-GHMZBOCLSA-N	220.316	1.713	10	20	BDCD	
NC1(CN[C@H]2CCc3cccc(O)c32)CC1	902406530	NKMBQZOPWHPIGC-JTQLQIEISA-N	218.300	1.460	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2[C@@H]3CCC(=O)[C@H]32)cc1	911661326	VBMYYTJFOSGCGQ-ADEWGFFLSA-N	230.267	1.432	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)CCCO	840942486	USLXMUYCLRLHBM-UHFFFAOYSA-N	236.359	1.875	10	20	BDCD	
COc1ccc(O)c(CNCCN2CCC2)c1	697389981	JMVDYSGUEZXFLP-UHFFFAOYSA-N	236.315	1.196	10	20	BDCD	
C[C@H](NC/C=C/CO)c1cc(F)cc(F)c1O	850510711	ZSDCAGVEYXHOSJ-SGJFDWMWSA-N	243.253	1.870	10	20	BDCD	
Cc1cccc(O)c1CN(C)CC(=O)N(C)C	876541896	LNZNADBVZSJACV-UHFFFAOYSA-N	236.315	1.221	10	20	BDCD	
COC1(C)CN(Cc2c(C)cccc2O)C1	877532291	DNQFBIPPIFKDPY-UHFFFAOYSA-N	221.300	1.921	10	20	BDCD	
Cc1ccc(CN2CC(C(C)(C)O)C2)c(O)c1	877581098	NLNQBHKGEJFQSH-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
CCO[C@H]1CN(CCN=[N+]=[N-])C[C@@H]1OC	409435869	XAJJCDFTJKYKIA-IUCAKERBSA-N	214.269	1.032	10	20	BDCD	
C[C@H](CN(C)Cc1ccccc1O)C(=O)O	83415492	OFTPSYAJYAQYNP-SECBINFHSA-N	223.272	1.545	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@@H](N)C2CC2)cc1	1342023217	UBAQYNIYEXCHTP-GFCCVEGCSA-N	233.315	1.012	10	20	BDCD	
CNC[C@H](C)CNCc1cc(F)cc(F)c1O	1578627611	RWSJNMOIQXTMPS-QMMMGPOBSA-N	244.285	1.616	10	20	BDCD	
C[C@@H]1C[C@H](N)CCN1Cc1ccccc1O	168844814	LCYJMLUNZJSYGT-ZYHUDNBSSA-N	220.316	1.704	10	20	BDCD	
C[C@H](N)C(=O)NCc1c(O)ccc2c1CCCC2	157364185	QXSRCUCOMYOENR-VIFPVBQESA-N	248.326	1.234	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@H]1C[C@H](O)C1)CC2	850579049	RHOLVERVFLHICK-DCAQKATOSA-N	219.284	1.492	10	20	BDCD	
CCN(CC)CC(=O)NCCc1ccc(N)cc1	236842143	JQMWCLZKRWDKGS-UHFFFAOYSA-N	249.358	1.269	10	20	BDCD	
CCON(CC)C(=O)c1cccc(O)c1O	831466924	AIQLJMDAADGXHH-UHFFFAOYSA-N	225.244	1.511	10	20	BDCD	
COCCNCc1cc(OC)ccc1O	20085633	LLNJGAQAFAVVJU-UHFFFAOYSA-N	211.261	1.137	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CC[C@@H](O)C2)c1O	187987366	BVFAMUXVBMKLCW-DGCLKSJQSA-N	235.327	1.951	10	20	BDCD	
CN(C)c1ccc(CN2C[C@H]3CNC[C@@H]3C2)cc1	90320320	PSEWQDCDKADKLK-ZIAGYGMSSA-N	245.370	1.404	10	20	BDCD	
CC[C@@H](NCc1cc(C)ccc1O)[C@H](C)O	386712220	PSBIXMMZGFSQIF-CMPLNLGQSA-N	223.316	1.950	10	20	BDCD	
CC[C@H]1CN(C)CCN1Cc1ccccc1O	816660765	OMPUITCXWNTFCO-ZDUSSCGKSA-N	234.343	1.918	10	20	BDCD	
Cc1cc(O)c(CN(C)C2(CO)CC2)cc1C	827903483	IMFQDKCBPMEYRR-UHFFFAOYSA-N	235.327	1.966	10	20	BDCD	
CCNC(=S)NCc1cc(OC)ccc1O	733905642	BZIXSVIHUNHWBJ-UHFFFAOYSA-N	240.328	1.385	10	20	BDCD	
CNCCN(C)Cc1ccc(N(C)C)cc1C	843057361	JGNABIYNHHRBFY-UHFFFAOYSA-N	235.375	1.712	10	20	BDCD	
C[C@H]1NC(=O)N(Cc2ccc(N(C)C)cc2)C1=O	272119989	QCEOPJICZFPTCA-SECBINFHSA-N	247.298	1.193	10	20	BDCD	
C[C@H](O)[C@H](N)c1cc(Cl)ccc1O	95672764	KCZAICOPPILPEW-CDUCUWFYSA-N	201.653	1.426	10	20	BDCD	
CN(C)c1ccc(CNC(=O)C(F)F)cc1	218688143	BYKKWHAVHQKDDM-UHFFFAOYSA-N	228.242	1.634	10	20	BDCD	
CC1(C)CN[C@H]1C(=O)NCc1ccccc1O	710039299	KJCJDIMDKYHEHQ-NSHDSACASA-N	234.299	1.006	10	20	BDCD	
C[C@@H](CN(C)Cc1ccccc1O)C(=O)O	83415489	OFTPSYAJYAQYNP-VIFPVBQESA-N	223.272	1.545	10	20	BDCD	
COC(=O)C(=O)c1ccc(C=S)cc1	514264984	TYVOMOZSFSNTML-UHFFFAOYSA-N	208.238	1.390	10	20	BDCD	
CCN1C[C@H](N[C@@H](C)c2ccccc2O)CC1=O	391595245	HINVPNHIUZEKSQ-WDEREUQCSA-N	248.326	1.664	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)CCCO1	61912850	BQWQYPRTWLEMNY-NSHDSACASA-N	220.316	1.880	10	20	BDCD	
Cc1ccc(C(=O)NCc2cc[nH]n2)c(O)c1O	181987812	NFOOAOHVBCGAKE-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)c2nncn2C)c1	71407591	WOEUHNSRBRVAGE-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
C[C@H](O)CN[C@H]1CCc2cccc(O)c21	295809568	CRYGRDVUZQCENP-WPRPVWTQSA-N	207.273	1.350	10	20	BDCD	
CC(=O)C(=O)CSc1nc2ccccc2n1C	288947861	SCUJWNKZUPDNBZ-UHFFFAOYSA-N	248.307	1.824	10	20	BDCD	
Cc1noc(CNC(=O)c2cc(O)cs2)n1	732276139	SSGJTAVCXFEJPR-UHFFFAOYSA-N	239.256	1.075	10	20	BDCD	
NC1CC(NCc2c(O)ccc(Cl)c2F)C1	906510588	MNIOBRYYZLGTHE-UHFFFAOYSA-N	244.697	1.764	10	20	BDCD	
C[C@@H](CCO)N(C)Cc1ccccc1O	846110945	LNVLAFAKOHTMKA-JTQLQIEISA-N	209.289	1.595	10	20	BDCD	
CN(C(=O)[C@@H]1C[C@]12CCNC2)c1ccc(N)cc1	877077683	QVYSMSKSXUFYON-JSGCOSHPSA-N	245.326	1.231	10	20	BDCD	
C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@H]1O	897681469	VRPWTDDILCOTIQ-GZMMTYOYSA-N	241.718	1.858	10	20	BDCD	
Nc1ccc(CNC[C@@H]2C[C@H](F)CN2)cc1	1335288901	JORANYNLHUKDDB-JQWIXIFHSA-N	223.295	1.058	10	20	BDCD	
Cc1ccc(CN[C@H]2C[C@H](C(=O)O)C2)c(O)c1	1605277710	LVQKRYIJAFMSOG-XYPYZODXSA-N	235.283	1.653	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1C[C@@H]1F	1123769327	IQRYPLKOAVMFQE-IUCAKERBSA-N	209.220	1.366	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C[C@H](C)O)c1O	164591495	AQYRANUDWXQLOD-QWRGUYRKSA-N	223.316	1.950	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCCCO1	157935856	FCLRUGPSCBRJPA-GFCCVEGCSA-N	235.283	1.578	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1CO[C@@H](C)C1	877607928	OBFIIFDQGUOLJU-WDEREUQCSA-N	221.300	1.968	10	20	BDCD	
Oc1ccccc1CNC[C@H](O)C1CCC1	316032019	VABWYEDLKJGOFS-ZDUSSCGKSA-N	221.300	1.643	10	20	BDCD	
OCCNCc1cc(Cl)cc(Cl)c1O	20596982	FLPKVAMANMYKPF-UHFFFAOYSA-N	236.098	1.781	10	20	BDCD	
Nc1ccc(NC(=O)CO[C@H]2CCOC2)cc1	110525548	BPZVSMCCBADBRO-NSHDSACASA-N	236.271	1.013	10	20	BDCD	
CCN(C(=O)Cc1ccc(N)cc1)C1CC1	37079236	YZMRICDLSBNCAL-UHFFFAOYSA-N	218.300	1.822	10	20	BDCD	
CNCCN(C)Cc1c(O)cccc1Cl	128335528	IDDRLLRPGQLCEL-UHFFFAOYSA-N	228.723	1.697	10	20	BDCD	
CN(Cc1cc2c(cc1O)OCO2)CC1CC1	193999373	SYKIFHYGGKWSGA-UHFFFAOYSA-N	235.283	1.963	10	20	BDCD	
c1csc(SC[C@H]2CCOCO2)n1	264649920	OQEOYQFFDNEOFO-SSDOTTSWSA-N	217.315	1.998	10	20	BDCD	
CC[C@H](N)CN[C@H](C)c1cc(OC)ccc1O	817980867	XQJKKTRMAGGVFJ-ZJUUUORDSA-N	238.331	1.789	10	20	BDCD	
Cc1ccc(C(=O)N2CCO[C@@H]3C[C@@H]32)c(O)c1O	816901420	LQFKTCLNXCDHGP-VHSXEESVSA-N	249.266	1.020	10	20	BDCD	
Cn1nccc1NC(=O)c1cc(O)cs1	732285517	IOLDQLZAYSDFLC-UHFFFAOYSA-N	223.257	1.440	10	20	BDCD	
CCOc1ccc(N(C)C[C@@H]2CCC(=O)N2)cc1	844299200	QUCLRZVNAIUBHO-NSHDSACASA-N	248.326	1.800	10	20	BDCD	
Cc1ccc(CNCC2(C)COC2)c(O)c1	877031846	VYTJGZIEEWBYJK-UHFFFAOYSA-N	221.300	1.827	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](O)C1)c1cc(F)cc(F)c1O	850578466	LJEXDUAEJVWNTA-FTLITQJKSA-N	243.253	1.844	10	20	BDCD	
CC(C)(CC(=O)O)NCc1ccccc1O	694046756	FBNXENQCPIZJPV-UHFFFAOYSA-N	223.272	1.735	10	20	BDCD	
C[C@@H](O)CCNCc1cc(Cl)ccc1O	78780795	HFOMDRBSDDPXMV-MRVPVSSYSA-N	229.707	1.906	10	20	BDCD	
CC[C@@H](NCc1ccc(N(C)C)cc1)C(=O)NC	697851060	HCMAIPIEKPBCDK-CYBMUJFWSA-N	249.358	1.367	10	20	BDCD	
Nc1ccc(CN[C@@H]2CC(=O)N(C3CC3)C2)cc1	1337838789	UKGHGXWNTFCMTD-GFCCVEGCSA-N	245.326	1.122	10	20	BDCD	
CO[C@@H](C)CC(=O)NCc1cccc(O)c1O	1520508511	DDNATWZUATUZGP-QMMMGPOBSA-N	239.271	1.139	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)C[S@](C)=O	877310525	NQQGBSLUTOYRMO-QFYYESIMSA-N	241.356	1.557	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccncc1F	134994923	VIMFIJJNXPBTAT-UHFFFAOYSA-N	246.241	1.856	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1CCSC1	131513564	DRTFJPIYLUNUPU-SNVBAGLBSA-N	237.324	1.762	10	20	BDCD	
CN(CC(=O)O)Cc1cc(Cl)ccc1O	83403425	VNJUROGVSRYFOV-UHFFFAOYSA-N	229.663	1.562	10	20	BDCD	
CC(C)(O)CCNCc1ccccc1O	162953851	OAVIHESRMSRLJE-UHFFFAOYSA-N	209.289	1.643	10	20	BDCD	
OCC1(CNCc2ccc3c(c2)CCO3)CCC1	184358666	IGYARFSIOGPTEJ-UHFFFAOYSA-N	247.338	1.874	10	20	BDCD	
CNCCN[C@@H]1CCc2cccc(O)c21	817952650	RZBKCELBNXOGHL-SNVBAGLBSA-N	206.289	1.189	10	20	BDCD	
CNCCN[C@H]1CCc2cccc(O)c21	817952648	RZBKCELBNXOGHL-JTQLQIEISA-N	206.289	1.189	10	20	BDCD	
C[C@@H]1C[C@H](O)CN(Cc2cc(F)ccc2O)C1	825315400	AAJXTUISEHYUCD-SKDRFNHKSA-N	239.290	1.734	10	20	BDCD	
COc1cccc([C@H](C)NCC[C@H](C)O)c1O	846147948	WFSPZEKLITUWHP-UWVGGRQHSA-N	239.315	1.822	10	20	BDCD	
C[C@@H]1NCCC[C@@H]1NCc1cccc(F)c1O	841063782	OJUNBJJPPCLVMW-CABZTGNLSA-N	238.306	1.761	10	20	BDCD	
CNCCN(C)Cc1cc(OC)ccc1O	69800701	WYIWJFWPOIQSTF-UHFFFAOYSA-N	224.304	1.052	10	20	BDCD	
Cc1ncc(C(=O)NCc2ccc(O)c(O)c2)[nH]1	778923482	QIMRKIPIUJYUHH-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
O=C(OCc1cccnc1)c1cccc(O)c1O	776282078	NGVNRQOAEJTDNM-UHFFFAOYSA-N	245.234	1.850	10	20	BDCD	
Cn1cc(COC(=O)c2cccc(O)c2O)cn1	790072794	BQSICHKJCFISSE-UHFFFAOYSA-N	248.238	1.188	10	20	BDCD	
COc1cc(C(=O)NCc2ccc(N)cc2)on1	704743698	PFQYPJDMZOBHGM-UHFFFAOYSA-N	247.254	1.195	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@H]1CCCNC1	699704008	YUORTUJPCBFGQL-RYUDHWBXSA-N	234.343	1.870	10	20	BDCD	
CN(C(=O)c1cc(O)cs1)C(C)(C)C(=O)O	1605980119	JMIHRUXNOPJWOS-UHFFFAOYSA-N	243.284	1.389	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](C)CC(=O)O	1594131623	HMUVHAOCEHPXNI-QMMMGPOBSA-N	239.271	1.354	10	20	BDCD	
C[C@H](CC(N)=O)NCc1c(O)cccc1Cl	158895988	MUYRELKHUHQZDZ-SSDOTTSWSA-N	242.706	1.399	10	20	BDCD	
Cc1ccc(CNC2CSC2)c(O)c1	877634593	SJVPENNHOGJUKT-UHFFFAOYSA-N	209.314	1.906	10	20	BDCD	
C[C@H](C(=O)O)C(=O)N[C@H](C)c1ccccc1O	868461439	FOMRBHXOOUZMRZ-JGVFFNPUSA-N	237.255	1.290	10	20	BDCD	
Nc1ccc(CN2CCC[C@]23CCOC3=O)cc1	1352790013	MYIQYAKGQVXBPE-CQSZACIVSA-N	246.310	1.550	10	20	BDCD	
COc1cc(Cl)cc(CN[C@H](C)CO)c1O	128612378	SVEWLCDKTNZBMZ-SSDOTTSWSA-N	245.706	1.525	10	20	BDCD	
C[C@@H](N[C@H]1CCCCNC1=O)c1ccccc1O	36977399	OQROCBIXQYSZNS-PWSUYJOCSA-N	248.326	1.712	10	20	BDCD	
O=C(NCc1ccccc1O)C1CCOCC1	133773916	LOCQJQDWXDFGSI-UHFFFAOYSA-N	235.283	1.435	10	20	BDCD	
CNC(=O)[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1	42561811	JHTVXEZBDCOCPM-MNOVXSKESA-N	249.358	1.538	10	20	BDCD	
C[C@H]1CCN(Cc2cc(F)ccc2O)[C@H]1CO	249039815	CYVDFJJFHIDGLN-CABZTGNLSA-N	239.290	1.734	10	20	BDCD	
COc1ccc(CNC(=O)C(C)(F)F)c(O)c1	808469170	XIBNXDFNTAXQMR-UHFFFAOYSA-N	245.225	1.672	10	20	BDCD	
C[C@@H](CN)CN[C@@H](C)c1cc(F)ccc1O	817962472	MTBXEYZVGZKRDF-IUCAKERBSA-N	226.295	1.777	10	20	BDCD	
CN(CC(N)=O)Cc1cc(Cl)c(F)cc1O	816484421	BOXYXFUZVDQIFA-UHFFFAOYSA-N	246.669	1.102	10	20	BDCD	
CCOCCOC(=O)c1ccc(C)c(O)c1O	744911040	WJIFHYNFKZFPAW-UHFFFAOYSA-N	240.255	1.600	10	20	BDCD	
OC[C@H]1C[C@@H](NCc2cc(F)cc(F)c2O)C1	708441770	LBCPTKKQRVXUJH-WKFQBHICSA-N	243.253	1.531	10	20	BDCD	
OCCCCNCc1cc(Cl)ccc1O	193281879	WAQNTQXOZGXGOG-UHFFFAOYSA-N	229.707	1.908	10	20	BDCD	
CN[C@@H](C)CCNCc1c(O)cccc1OC	1345100991	YFZODANSUVBAFD-JTQLQIEISA-N	238.331	1.488	10	20	BDCD	
Oc1cc2c(cc1CN1C[C@H]3C=C[C@H]1C3)OCO2	1262053579	DKZFWVQXHGSCJL-ONGXEEELSA-N	245.278	1.881	10	20	BDCD	
Nc1ccc(CNC(=O)C=C2CCC2)cc1	1524008833	LBAAMSCXIPTQQC-UHFFFAOYSA-N	216.284	1.995	10	20	BDCD	
CN1C(=O)/C(=C/c2ccn(C)c2)SC1=S	160305901	VUOGJPBPXSGNGW-YVMONPNESA-N	238.337	1.856	10	20	BDCD	
Cc1cccc(CN(C)[C@H]2CCN(C)C2=O)c1O	271797279	KFONHAUTTFENHS-LBPRGKRZSA-N	248.326	1.363	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cn(C)cn1	178207954	DIEXMCUGSTYYST-UHFFFAOYSA-N	245.282	1.398	10	20	BDCD	
C[C@@H](NC(=O)C(C)(C)CN)c1ccccc1O	870988212	JBPUJKQSPSCEOP-SECBINFHSA-N	236.315	1.554	10	20	BDCD	
Cc1cc(N2C(=O)[C@H]3[C@H](C2=O)C3(C)C)ccc1N	113661604	BRAYONAHCCZIDS-GHMZBOCLSA-N	244.294	1.723	10	20	BDCD	
CN(C)c1ccc(CN2CCC[C@@H](CO)C2)cc1	66057169	MGMJUDQGJJPKPT-CQSZACIVSA-N	248.370	1.957	10	20	BDCD	
CC1(C)CN(C(=O)Cc2ccc(N)cc2)CCN1	841854890	BQBPARSULFLQIK-UHFFFAOYSA-N	247.342	1.022	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1(N)CCCC1	37823799	LLYOJBPZRNELSL-UHFFFAOYSA-N	248.326	1.622	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC(C)=O)c1	238379648	CXNPCTWLWKKCHA-ZETCQYMHSA-N	209.245	1.598	10	20	BDCD	
C[C@@H](NCCCO)c1cc([N+](=O)[O-])ccc1O	273441743	YSAMYZGQCMVLFH-MRVPVSSYSA-N	240.259	1.333	10	20	BDCD	
CCc1c[nH]c(SCC(=O)C(C)=O)n1	289787810	XLAOYMMBJOSHGD-UHFFFAOYSA-N	212.274	1.222	10	20	BDCD	
CCNCCNCc1cc(C)ccc1O	841037213	QQYSKRHLJSNGSY-UHFFFAOYSA-N	208.305	1.400	10	20	BDCD	
C[C@@H](O)CN(Cc1cc(F)ccc1O)C1CC1	848929743	ZMILPRWUJUBOCW-SECBINFHSA-N	239.290	1.877	10	20	BDCD	
Cc1cc(CN2C[C@@H]3C[C@H]2CN3)ccc1N(C)C	923410999	LQHKUAMLBKMVLP-KBPBESRZSA-N	245.370	1.607	10	20	BDCD	
Cc1ccc(CNCCN2CCC2)c(O)c1	877113006	XPUXBHPZTJLAAE-UHFFFAOYSA-N	220.316	1.496	10	20	BDCD	
O=C(O)[C@H](CF)NCc1cc(F)cc(F)c1O	1601650297	OVYOEGFIFVJGLK-QMMMGPOBSA-N	249.188	1.183	10	20	BDCD	
C[C@H]1C[C@@H](N)CCN1Cc1ccccc1O	168845093	LCYJMLUNZJSYGT-JQWIXIFHSA-N	220.316	1.704	10	20	BDCD	
N#Cc1ccc(C(=O)NCc2ccccc2O)o1	393269509	QHRCSSDJICKWNO-UHFFFAOYSA-N	242.234	1.787	10	20	BDCD	
CCn1cc(COc2ccc(N)cc2)nn1	881390768	BCMOUVXUWZEVFR-UHFFFAOYSA-N	218.260	1.459	10	20	BDCD	
CC1(C)[C@H](O)C[C@H]1NCc1ccc2c(c1)CCO2	129578425	ZCALMRZPUBUJTQ-ZIAGYGMSSA-N	247.338	1.871	10	20	BDCD	
CC[C@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1	37801171	MRCBIXLYLNTNBP-ZDUSSCGKSA-N	249.358	1.448	10	20	BDCD	
COc1cc(C)cc(CN2CCOCC2)c1O	125231829	KTNJGEMFRVRRBB-UHFFFAOYSA-N	237.299	1.541	10	20	BDCD	
C[C@H]1[C@@H](C)OCCN1Cc1ccc(N)cc1	380443506	SCMGSQBNQXGIAO-WDEREUQCSA-N	220.316	1.878	10	20	BDCD	
OCC1(NCc2ccccc2O)CCOCC1	227214168	YDGNSURRZHOOSY-UHFFFAOYSA-N	237.299	1.023	10	20	BDCD	
C[C@@H](NCC1CNC1)c1ccc(N(C)C)cc1	817965138	MOBVMOKLUUSNCA-LLVKDONJSA-N	233.359	1.623	10	20	BDCD	
Cc1cccc(CNCCCNC2CC2)c1O	841094412	XVRQZMYIBHFGBR-UHFFFAOYSA-N	234.343	1.932	10	20	BDCD	
C[C@H](CNCc1cc(F)cc(F)c1O)C(=O)O	1119549078	DWZKIAYTLMADQV-ZCFIWIBFSA-N	245.225	1.481	10	20	BDCD	
O=C(NC[C@@H]1CCSC1)c1cc(O)cs1	791059548	BYTRYXBUXKASBQ-ZETCQYMHSA-N	243.353	1.937	10	20	BDCD	
CNC[C@@H](C)CNCc1cc(Cl)ccc1O	1345100669	USKRMWJVLVMJTR-SECBINFHSA-N	242.750	1.991	10	20	BDCD	
NCC[C@H]1CCCN(Cc2ccc(N)cc2)C1	1352791646	YVVGHIIGAXBEGX-GFCCVEGCSA-N	233.359	1.830	10	20	BDCD	
CCOc1ccc(N(C)C)c(C(=O)O)c1	1597106799	SJTCDOYLOQAJHC-UHFFFAOYSA-N	209.245	1.850	10	20	BDCD	
C[C@H]1C[C@@H](NCc2ccc(N(C)C)cc2)CCN1	692161739	QPMROOJYOUYADP-JSGCOSHPSA-N	247.386	1.983	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCCN1)c1ccccc1O	870987736	CAATWVJZYIMGHD-MWLCHTKSSA-N	234.299	1.321	10	20	BDCD	
CCOc1cccc(CN(CC)CCN)c1O	306044622	UTOGLNXTPUXNKD-UHFFFAOYSA-N	238.331	1.572	10	20	BDCD	
CC[C@@H](O)CCNCc1ccc2c(c1)CCO2	127390610	YKCPOVLXYWVJDP-CYBMUJFWSA-N	235.327	1.872	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN1	37823726	SJRPNYJELHNESX-NSHDSACASA-N	234.299	1.103	10	20	BDCD	
CC[C@@H](NC[C@@H](O)COC)c1ccccc1O	71269705	CBJJIYBUZVNTMR-ZYHUDNBSSA-N	239.315	1.440	10	20	BDCD	
COCCNCc1cc(Cl)cc(OC)c1O	76274270	PQWFXDVVWDLROE-UHFFFAOYSA-N	245.706	1.790	10	20	BDCD	
COc1ccc(CN[C@@H]2CCOC2)cc1C	75149824	DVKKARGQHXUIIL-GFCCVEGCSA-N	221.300	1.882	10	20	BDCD	
Nc1ccc(CCNC(=O)C2[C@H]3CCC[C@H]23)cc1	132692507	RJQILCDUHNKRHY-STQMWFEESA-N	244.338	1.974	10	20	BDCD	
COCCC1(C(=O)NCc2ccccc2O)CC1	269476376	AALRDMFFXWDZKN-UHFFFAOYSA-N	249.310	1.825	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCn2nccc21	825298267	YDTUUVUSQGLWTH-UHFFFAOYSA-N	249.295	1.701	10	20	BDCD	
Cc1cc(O)c(CN(C)CC(=O)O)cc1C	738463458	FDMKZJZVODQWGS-UHFFFAOYSA-N	223.272	1.525	10	20	BDCD	
Cc1cc(O)c(CN[C@@H]2CCNC2)cc1C	841045406	UHSXANOXIOPWEJ-GFCCVEGCSA-N	220.316	1.461	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H]2CCCN2)c1	841035045	HFOUWFFLZKNDLJ-NSHDSACASA-N	236.315	1.242	10	20	BDCD	
COc1cccc(CNC(=O)OCCF)c1O	859006846	VBCXYDMDCAASCF-UHFFFAOYSA-N	243.234	1.597	10	20	BDCD	
Cc1cccc(CN[C@H](C)C2(CO)CC2)c1O	696064434	VUEOKZWBDXQVIM-LLVKDONJSA-N	235.327	1.951	10	20	BDCD	
COCC1(NCc2ccc(C)cc2O)CC1	877109610	CSUCXPUETCGYIQ-UHFFFAOYSA-N	221.300	1.969	10	20	BDCD	
CNC[C@H](C)CN[C@H]1CCc2cccc(O)c21	1118122432	WTXWLGFKGBANEA-JQWIXIFHSA-N	234.343	1.825	10	20	BDCD	
CC1(C)CN(C(=O)c2cc(O)cs2)C[C@@H]1O	791083156	OSRAZUMQXOLBAP-VIFPVBQESA-N	241.312	1.297	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@@H](O)[C@H](CC2CC2)C1	409435129	SMRNRWQBUDHJHO-NXEZZACHSA-N	238.291	1.306	10	20	BDCD	
Nc1ccc(NC(=O)CCCC(=O)O)cc1	90636045	HAAKNHRXFVHSSG-UHFFFAOYSA-N	222.244	1.462	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H]2C[C@H]2F)cc1	1263063233	PPYKCVZKBOTWTH-WDEREUQCSA-N	222.263	1.286	10	20	BDCD	
CNCCNCc1ccc2c(c1)CCCO2	161276728	LVGVOJDNYQWALI-UHFFFAOYSA-N	220.316	1.321	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)CC(N)=O)c1	160802897	OHVJGYJRIDASNN-SECBINFHSA-N	222.288	1.054	10	20	BDCD	
Cc1ccc([C@H](C)N[C@@H](C)CC(N)=O)c(O)c1	168830055	UWARYVFRIYZWSG-UWVGGRQHSA-N	236.315	1.615	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)[C@H](C)C(=O)O	901443927	BRGRNHOYYKWIOT-UWVGGRQHSA-N	249.310	1.820	10	20	BDCD	
Oc1ccccc1CNC[C@@H](O)C1CCC1	316032014	VABWYEDLKJGOFS-CYBMUJFWSA-N	221.300	1.643	10	20	BDCD	
C[C@H]1C[C@H](N)CN1Cc1ccc(N(C)C)cc1	702668273	JJOZGPLCTDLMAC-AAEUAGOBSA-N	233.359	1.674	10	20	BDCD	
Cc1cc(C(=O)NCc2ccccc2O)n[nH]1	706283416	NOAQMKHPPFLDOG-UHFFFAOYSA-N	231.255	1.354	10	20	BDCD	
C[C@@H](O)CCN(C)Cc1ccc(N)cc1	130957390	SJVDMPHYXXSQHV-SNVBAGLBSA-N	208.305	1.472	10	20	BDCD	
Cc1nc(CN[C@H](C)c2ccccc2O)no1	223660544	YKGANLGKKPKGFT-MRVPVSSYSA-N	233.271	1.934	10	20	BDCD	
Nc1ccc(CC(=O)NCc2nccs2)cc1	41011454	GHLIUBSWHASNBM-UHFFFAOYSA-N	247.323	1.584	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](C)OC)c1	191204783	GUQZTYYIHCMZGT-SECBINFHSA-N	225.288	1.525	10	20	BDCD	
CO[C@@H]1CC[C@H](NC(=O)Nc2ccc(N)cc2)C1	234927223	KFCDGYVSDBYNKV-NWDGAFQWSA-N	249.314	1.958	10	20	BDCD	
C[C@@H]1CCNC(=O)[C@@H]1NCc1ccccc1O	193687278	BUNGSUKQRXSLDE-BXKDBHETSA-N	234.299	1.006	10	20	BDCD	
C[C@@H](N[C@H](CN)C1CC1)c1cc(F)ccc1O	817959295	FJIHXJJFTGQVFB-PRHODGIISA-N	238.306	1.919	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1C[C@@H](O)C1	820880169	XTMZQDJVRSLFIF-PHIMTYICSA-N	235.283	1.122	10	20	BDCD	
Cc1cccc(CN2CCC[C@H]2C(=O)O)c1O	821112365	VQECCROIRGMVOU-NSHDSACASA-N	235.283	1.750	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@]2(C)CCC(=O)N2)c1	835061645	UGXLYVUTJMHPMM-CQSZACIVSA-N	248.326	1.459	10	20	BDCD	
Cc1n[nH]c(NC(=O)c2cc(O)cs2)n1	741285835	OIJNXXHMVKQGBU-UHFFFAOYSA-N	224.245	1.133	10	20	BDCD	
CC(=O)C(=O)CSc1ccc2c(c1)CCO2	840212119	MUADHLAHAOMDAQ-UHFFFAOYSA-N	236.292	1.872	10	20	BDCD	
Cc1cc(N(C)C)ccc1[C@@H]1NC(=O)CN1C	840804623	NINUHEVGPWLXKQ-CYBMUJFWSA-N	233.315	1.121	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H](O)C(C)C)c1	862756102	QHOKHQIJERBXIJ-LBPRGKRZSA-N	237.299	1.334	10	20	BDCD	
C[C@H]1C[C@@H](O)CN1Cc1ccccc1O	788268581	GKHCDJNANZDBNI-GXSJLCMTSA-N	207.273	1.347	10	20	BDCD	
CC[C@@H](NCCO)c1ccc(C)cc1O	279988724	FEHVKSCHTZTDLB-LLVKDONJSA-N	209.289	1.734	10	20	BDCD	
COc1cccc(CN[C@H](C)CC(=O)O)c1O	1611066622	FBYYPMKNMHTONW-MRVPVSSYSA-N	239.271	1.354	10	20	BDCD	
CC(C)N1CCN(Cc2ccc(N)cc2)CC1	19726898	UNKISFPBKIOGBY-UHFFFAOYSA-N	233.359	1.795	10	20	BDCD	
COc1ccc(N(C)CCn2cncn2)cc1	844355708	RNBYWRNAQKFIAK-UHFFFAOYSA-N	232.287	1.423	10	20	BDCD	
O=C(NCc1ccccc1O)[C@]12CC[C@H]1CNC2	1357499331	MPFYTGHGIBRREB-FZMZJTMJSA-N	246.310	1.008	10	20	BDCD	
Nc1ccc(NC(=O)C[C@@H]2CCNC2)cc1	127613736	CWQVMXDQZOFEKK-VIFPVBQESA-N	219.288	1.207	10	20	BDCD	
C[C@@H](NC[C@@H]1COCCN1)c1ccccc1O	530218582	CVRWBYJEPWMBMJ-GHMZBOCLSA-N	236.315	1.031	10	20	BDCD	
O=C(O)[C@@H]1CCN(Cc2ccccc2O)C1	83413617	BBSGSCVFNYIJCI-SNVBAGLBSA-N	221.256	1.299	10	20	BDCD	
COc1ccc(N(C)C[C@H](C)O)cc1F	192742043	SKXMHSZMYAEWQZ-QMMMGPOBSA-N	213.252	1.651	10	20	BDCD	
CCC[C@](C)(N)C(=O)Nc1ccc(N)cc1	294702130	GPQNSQWNUDBQOK-LBPRGKRZSA-N	221.304	1.725	10	20	BDCD	
Cc1n[nH]c(C)c1CNCCc1ccc(N)cc1	841034587	DNPWNRWSBNTRTN-UHFFFAOYSA-N	244.342	1.941	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@@H](C)CCO)c1	846111439	OZYXHNRNKZCPFQ-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
Cc1noc(C(=O)N(C)Cc2ccccc2O)n1	791390767	SNMDKCXVHUUQIU-UHFFFAOYSA-N	247.254	1.356	10	20	BDCD	
CC[C@H](N[C@@H]1CC(=O)N(C)C1)c1ccccc1O	274859954	CQOUTCQKYXWLAW-PWSUYJOCSA-N	248.326	1.664	10	20	BDCD	
CCc1cccc(CNCCOC)c1O	709416332	MHXMHQDILVDKKL-UHFFFAOYSA-N	209.289	1.691	10	20	BDCD	
CSCC(=O)NCc1cccc(O)c1O	1548790828	NWAPDLZZPDIVQO-UHFFFAOYSA-N	227.285	1.077	10	20	BDCD	
C[C@H](NCc1cccc(Cl)c1O)C(=O)O	165157830	OMFMMDPURROWJV-LURJTMIESA-N	229.663	1.608	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC(F)(F)C1	313309031	BGDKAQBEWMHBPD-UHFFFAOYSA-N	243.209	1.579	10	20	BDCD	
N[C@H]1CCCN(Cc2c(O)cccc2Cl)C1	128318010	IKIACLOQNGNAKQ-VIFPVBQESA-N	240.734	1.969	10	20	BDCD	
Cc1cc(NC(=O)c2cccc(O)c2O)no1	126195790	UFEFMYMUHYJURN-UHFFFAOYSA-N	234.211	1.647	10	20	BDCD	
NC[C@H]1CCCN(Cc2ccccc2O)C1	44527857	XZMNGNPNTAKLTM-LLVKDONJSA-N	220.316	1.563	10	20	BDCD	
C[C@@H](CCO)N[C@H](C)c1ccccc1O	132433190	HATLBZPDAXAMOR-VHSXEESVSA-N	209.289	1.814	10	20	BDCD	
COc1cc(CN(C)CC(=O)O)c(O)cc1C	820763819	DYBOOCWPSARVER-UHFFFAOYSA-N	239.271	1.226	10	20	BDCD	
CCCN(c1ccc(CN)cc1)[C@@H](C)C(=O)O	904234088	CGPDPJUHAADBSO-JTQLQIEISA-N	236.315	1.835	10	20	BDCD	
CCN[C@H](C)CNCc1c(O)cccc1OC	841065346	IZFAZTHDZIBQFS-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
c1cc(N2CCCC2)ccc1CN[C@H]1CCNC1	841045512	XOALYSPSIXPVJU-AWEZNQCLSA-N	245.370	1.738	10	20	BDCD	
O=C(NC1CC=CC1)c1cc(O)cs1	760150989	UITUQGPKFKHLDV-UHFFFAOYSA-N	209.270	1.902	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@H](CO)C1	769246243	YGKPVIDPQMTBMF-JTQLQIEISA-N	237.299	1.215	10	20	BDCD	
Cc1ccc(CNCc2ccno2)c(O)c1	877322423	GKSFLQTYWUEUHM-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
Cc1ccc(CNCC[C@@H](O)C2CC2)c(O)c1	898195702	YWPMNKBALSYCGN-CYBMUJFWSA-N	235.327	1.951	10	20	BDCD	
COC[C@H](C)NC(=O)NCc1ccc(N)cc1	1262598429	SDGXBHRGNWKMAK-VIFPVBQESA-N	237.303	1.103	10	20	BDCD	
CSC[C@@H](C)NC(=O)Cc1ccc(N)cc1	158427619	XNOCHWDDIVUHNX-SECBINFHSA-N	238.356	1.679	10	20	BDCD	
Cc1cccc(CN[C@H]2CC[C@H](CN)C2)c1O	841084089	FZVVQSXDDKLBTG-AAEUAGOBSA-N	234.343	1.918	10	20	BDCD	
CCC(=O)NCCc1ccc(O)c(O)c1	11638251	DNJPNZATKVPLOH-UHFFFAOYSA-N	209.245	1.167	10	20	BDCD	
OCCCCNCc1ccc2c(c1)CCCO2	258998224	MEMUEGJECZFOBJ-UHFFFAOYSA-N	235.327	1.874	10	20	BDCD	
CC[C@@H](N[C@H](CO)COC)c1ccccc1O	233899630	KESVOTAXZBYOJP-ZYHUDNBSSA-N	239.315	1.440	10	20	BDCD	
Cn1cc(CN[C@H]2CCc3cccc(O)c32)nn1	389815587	OSISAHSVDJQPMQ-NSHDSACASA-N	244.298	1.298	10	20	BDCD	
O=C(NCc1ccccc1O)c1ncccc1F	857472673	VYMHDZZUGKKSNJ-UHFFFAOYSA-N	246.241	1.856	10	20	BDCD	
CN(Cc1cc2c(cc1O)OCO2)CC(F)F	103458782	YRAMHDITSHYZOA-UHFFFAOYSA-N	245.225	1.818	10	20	BDCD	
C[C@H](CCO)NCc1ccc(N(C)C)c(F)c1	119654569	YSNGHHGMFFIHDR-SNVBAGLBSA-N	240.322	1.752	10	20	BDCD	
C[C@H]1OCC[C@@H]1NCc1ccc2c(c1)CCO2	120821226	GJLMVLIBOKYEQM-MFKMUULPSA-N	233.311	1.889	10	20	BDCD	
Cc1ccc(O)c(CNc2cnn(CCO)c2)c1	305775468	JYFLCXLTIVPSEV-UHFFFAOYSA-N	247.298	1.502	10	20	BDCD	
C[C@H](O)CCN(C)Cc1ccccc1O	128553241	LSZUNGOHHAEWRB-JTQLQIEISA-N	209.289	1.595	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](C)N(C)C)c1	70955272	LGBBPDOMHHELPT-NSHDSACASA-N	222.332	1.740	10	20	BDCD	
OC[C@H](CCF)NCc1c(O)cccc1Cl	846096565	IRYVPPGSYCMYGH-QMMMGPOBSA-N	247.697	1.856	10	20	BDCD	
C[C@@H](NC(=O)[C@H]1CCCOC1)c1ccccc1O	827930633	NPJVDNMXIYCGBY-MNOVXSKESA-N	249.310	1.996	10	20	BDCD	
COc1ccc(CNC[C@@H](N)C2CC2)cc1C	841049740	NKPDJAYAELMHQV-CYBMUJFWSA-N	234.343	1.831	10	20	BDCD	
COCCOC(=O)c1ccc(C)c(O)c1O	750620640	ZZKVESFSVDNAQU-UHFFFAOYSA-N	226.228	1.209	10	20	BDCD	
CO[C@H](C)CC(=O)NCc1cc(C)ccc1O	862758968	RHKPJMPLMYAOOQ-SNVBAGLBSA-N	237.299	1.742	10	20	BDCD	
C[C@@H]1NCC[C@@H]1C(=O)N(C)c1ccc(N)cc1	877077503	KXFKDULTSBYITR-CABZTGNLSA-N	233.315	1.230	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H](C)C(=O)O)c1	49353976	IPTYVMQUEVGTEZ-JGVFFNPUSA-N	239.271	1.525	10	20	BDCD	
[N-]=[N+]=NCCN1CCC2(CC1)C[C@@H](O)CCO2	409427236	KBVSDTVTCJHEPY-JTQLQIEISA-N	240.307	1.303	10	20	BDCD	
COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(N)cc1	1578832585	DPXFUDYEVPOIPE-OLZOCXBDSA-N	248.326	1.700	10	20	BDCD	
O=C(O)C1(CNCc2ccc3c(c2)CCO3)CC1	259006169	WXBPOUNZZODJOK-UHFFFAOYSA-N	247.294	1.576	10	20	BDCD	
COc1cccc(O)c1CN(C)C[C@H](C)OC	809717037	CCTXCWNQQDZBCN-JTQLQIEISA-N	239.315	1.868	10	20	BDCD	
Cc1cccc(CNCCCOCCO)c1O	227521820	PSIQZBWMXYJGMB-UHFFFAOYSA-N	239.315	1.189	10	20	BDCD	
CN(CC(=O)NC1CC1)c1ccc2c(c1)OCO2	121257415	AHSVWAOLYWFEJF-UHFFFAOYSA-N	248.282	1.130	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CCOC1	181252524	BYHKQNLRRVMKAS-YWNRKNDBSA-N	249.266	1.016	10	20	BDCD	
CC[C@@H](O)CCNCc1ccccc1O	131702176	MTOUGAIKRSRFFX-LLVKDONJSA-N	209.289	1.643	10	20	BDCD	
Cn1cccc1CNC(=O)c1cccc(O)c1O	229412980	FKONPLBZIVDGGV-UHFFFAOYSA-N	246.266	1.366	10	20	BDCD	
CN(C)C(=O)CCCC(=O)Nc1ccc(N)cc1	237133968	NBFNTYLQZAQEDI-UHFFFAOYSA-N	249.314	1.466	10	20	BDCD	
Cc1nonc1C(=O)N(C)Cc1ccccc1O	265412182	NBMMTUYBNHKDEK-UHFFFAOYSA-N	247.254	1.356	10	20	BDCD	
CO[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1	271181775	LNESRFGQUBROBK-AWEZNQCLSA-N	234.343	1.973	10	20	BDCD	
C[C@H]1CN(C(=O)c2cc(O)cs2)[C@@H](C)CO1	731868506	HAZFGEBOASWYFR-YUMQZZPRSA-N	241.312	1.703	10	20	BDCD	
CC(C)(CC(=O)O)NCc1cccc(F)c1O	833456210	OACUJKFNBQDOJN-UHFFFAOYSA-N	241.262	1.874	10	20	BDCD	
C[C@H]1NCC[C@@H]1C(=O)N(C)c1ccc(N)cc1	877077505	KXFKDULTSBYITR-SKDRFNHKSA-N	233.315	1.230	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](O)[C@@H](C)C2)c(O)c1	877434747	TZKCBRDXGPDEQK-WCQYABFASA-N	235.327	1.903	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1C[C@H](C)[C@H](O)C1	897680118	PIGUGQQMCIHYCD-SWLSCSKDSA-N	248.370	1.874	10	20	BDCD	
Cc1nc([C@H](C)NCc2c(C)cccc2O)n[nH]1	894778863	TUXGVSCNGXXTAV-VIFPVBQESA-N	246.314	1.978	10	20	BDCD	
COc1ccc(CN[C@H]2C[C@@H](CO)C2)cc1C	707487463	DRZBKSSHLHSJHL-BETUJISGSA-N	235.327	1.864	10	20	BDCD	
Cc1cc(O)c(CNCC[C@H](C)O)cc1C	164578833	NSBQZVDXPBSWGA-NSHDSACASA-N	223.316	1.870	10	20	BDCD	
C[C@H]1NCCC[C@@H]1NCc1ccc2c(c1)CCO2	841064777	JLAWDFRSBBKWGC-RISCZKNCSA-N	246.354	1.852	10	20	BDCD	
CCN(CC(N)=O)Cc1ccc(N(C)C)cc1	7250723	NMKJUFVFBPAOEZ-UHFFFAOYSA-N	235.331	1.060	10	20	BDCD	
C[C@H](O)CN[C@@H](C)c1ccc(F)cc1O	62745808	XANCXORUHDNVIG-YUMQZZPRSA-N	213.252	1.563	10	20	BDCD	
CCOC(=O)c1cc(O)c(O)c(Cl)c1	44547411	WHRIRTCGDOQQGB-UHFFFAOYSA-N	216.620	1.928	10	20	BDCD	
COC[C@@H](C)N(C)C(=O)Cc1ccc(N)cc1	37815704	CDEQMHSSNBHHBF-SNVBAGLBSA-N	236.315	1.305	10	20	BDCD	
CC[C@H](C)OCC(=O)NCc1ccccc1O	269852686	YEPUCSQVTLKDEN-JTQLQIEISA-N	237.299	1.824	10	20	BDCD	
CNCCN[C@H](C)c1ccc(C)cc1O	817952435	PSKYLHVBYOGTSZ-SNVBAGLBSA-N	208.305	1.571	10	20	BDCD	
CCCONC(=O)N(C)Cc1ccccc1O	828246735	GIWGHYGWZXEJTG-UHFFFAOYSA-N	238.287	1.875	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@@H](C)CN	841047766	CMCXAJHRCDXWQJ-NSHDSACASA-N	235.375	1.745	10	20	BDCD	
Cc1cccc(O)c1CN1CC(=O)N[C@H](C)C1	877567112	GOMOKKHXHKRWPL-SNVBAGLBSA-N	234.299	1.021	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@@H](O)C[C@@H]2C)c1	788266906	CXUXWLXMQHACHS-JQWIXIFHSA-N	221.300	1.656	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CCCO2)c1O	83351373	VDUVSYJXBGXLOF-LBPRGKRZSA-N	221.300	1.969	10	20	BDCD	
CN1CC[C@@H](NCc2ccc3c(c2)CCO3)C1	42546030	XQFLFERGZXYKHM-CYBMUJFWSA-N	232.327	1.415	10	20	BDCD	
CCc1cccc(CN[C@@H](C)CCO)c1O	691471926	BKURADCYTIZALB-JTQLQIEISA-N	223.316	1.815	10	20	BDCD	
Cc1c(CN[C@@H]2CNOC2)n(C)c2ccccc12	1579534933	XXRUOHMRGMAVHD-LLVKDONJSA-N	245.326	1.480	10	20	BDCD	
Oc1c(F)cccc1CNCC1[C@@H]2CNC[C@@H]12	1580888756	YCFLRXGSPZQERU-QWRGUYRKSA-N	236.290	1.086	10	20	BDCD	
NC[C@H]1CCC[C@H]1NCc1ccc2c(c1)CCO2	841028538	BEPXDNDAURPTBT-ZIAGYGMSSA-N	246.354	1.839	10	20	BDCD	
CCNC(=O)NCc1cc(OC)ccc1O	114581186	QAKHIEMKQDWALU-UHFFFAOYSA-N	224.260	1.220	10	20	BDCD	
C[C@H](N[C@H]1CCCCNC1=O)c1ccccc1O	36977397	OQROCBIXQYSZNS-JQWIXIFHSA-N	248.326	1.712	10	20	BDCD	
Cc1cccc(CN2CCNC(=O)[C@H]2C)c1O	179920699	SNWZCCFIPYJOHV-SNVBAGLBSA-N	234.299	1.021	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCOC2)cc1	40941340	SONXXYUIUDJGCC-QMMMGPOBSA-N	206.245	1.244	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)C(=O)O	49358132	DQIPLPMWERRABJ-QMMMGPOBSA-N	221.256	1.184	10	20	BDCD	
CC1(C)CCN[C@H]1C(=O)NCc1ccccc1O	852882875	BUEILKBWAAZYQQ-LBPRGKRZSA-N	248.326	1.397	10	20	BDCD	
Cc1ccc([C@H](C)NC/C=C\CO)c(O)c1	717531290	DPJUROGCWZQKRK-BYCRGOAPSA-N	221.300	1.900	10	20	BDCD	
OC[C@@H](CCF)N[C@@H]1CCc2cccc(O)c21	846210318	XZNCRZMAPNEVPG-GHMZBOCLSA-N	239.290	1.690	10	20	BDCD	
CN(Cc1cn(C)nn1)c1ccc2c(c1)OCO2	761705946	ZDWOGOUHJKLOHO-UHFFFAOYSA-N	246.270	1.180	10	20	BDCD	
Cc1ccc(CN[C@@H]2C(=O)NCC[C@@H]2C)c(O)c1	877499634	RNAYJPSLONIVJV-GWCFXTLKSA-N	248.326	1.315	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](O)C[C@H]2C)c1	788266910	CXUXWLXMQHACHS-ZYHUDNBSSA-N	221.300	1.656	10	20	BDCD	
Cc1occc1CNC(=O)c1cccc(O)c1O	790571532	SXMAEFPQNQVRFU-UHFFFAOYSA-N	247.250	1.929	10	20	BDCD	
O=C(O)[C@H]1C[C@@H](C(=O)NCc2ccccc2O)C1	1520182207	RYUWNQWEKLBEEG-AOOOYVTPSA-N	249.266	1.119	10	20	BDCD	
CC(C)C[C@@H]1CN(C(=O)CN=[N+]=[N-])CC[C@@H]1O	409435402	UKIFTHBFHMVZFN-ZJUUUORDSA-N	240.307	1.552	10	20	BDCD	
Cc1ccc(CNC(C)(C)C(=O)O)c(O)c1	1607782979	JRHVCDKYEWHBKS-UHFFFAOYSA-N	223.272	1.653	10	20	BDCD	
CCNC(=O)NCCCSc1nccs1	175600450	OWDQYZQIASFFIJ-UHFFFAOYSA-N	245.373	1.944	10	20	BDCD	
C[C@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)CCO1	235666089	WPUYCNRRKVZPHP-GWCFXTLKSA-N	248.326	1.495	10	20	BDCD	
CCCN(CCCN)Cc1ccccc1O	221636520	NXKFDPJTYBOYND-UHFFFAOYSA-N	222.332	1.953	10	20	BDCD	
COC(=O)C1(C)CN(Cc2cc(C)ccc2O)C1	822534447	GUQNPVANOJUCGT-UHFFFAOYSA-N	249.310	1.696	10	20	BDCD	
O=C(NC[C@H]1CCCOC1)c1cc(O)cs1	732274392	HWKSKOFBMGGJHU-MRVPVSSYSA-N	241.312	1.610	10	20	BDCD	
Cc1cc(O)c(CN[C@@H](CN)C2CC2)cc1C	841027658	DTYZWRVHVPQZRY-ZDUSSCGKSA-N	234.343	1.836	10	20	BDCD	
O=C(NCc1ncc[nH]1)c1cc(O)cs1	748315407	VBJHWDDGIAWBNA-UHFFFAOYSA-N	223.257	1.107	10	20	BDCD	
CCn1cc(CNCCc2ccc(N)cc2)cn1	841034526	HDKFNMIHYJTAEE-UHFFFAOYSA-N	244.342	1.818	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CCCNCC2)c1	841056784	FEIBOYUQTVLVBV-ZDUSSCGKSA-N	234.343	1.932	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(C)cc2O)C[C@H]1O	876814353	DZQCRRINBWYFHW-SMDDNHRTSA-N	235.327	1.903	10	20	BDCD	
Oc1ccccc1CN1CC[C@H](C2OCCO2)C1	896383886	GDFMPMQGEJJFPT-LBPRGKRZSA-N	249.310	1.587	10	20	BDCD	
C[C@@H](NC(=O)CCNC1CC1)c1ccccc1O	870988422	OWRCQFPXGLXZDR-SNVBAGLBSA-N	248.326	1.712	10	20	BDCD	
Cc1ccc(C(=O)N(C)c2cn[nH]c2)c(O)c1O	1319949845	NUIBRIGBNTYVNZ-UHFFFAOYSA-N	247.254	1.406	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC[C@@H](CF)C1	409429090	NTJDMKFZIQLKLX-ZETCQYMHSA-N	200.217	1.505	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H]2CNC[C@H]2C1	770396046	YEDGDTPMKQPWST-QWRGUYRKSA-N	248.326	1.052	10	20	BDCD	
CCC1(C)CN(C(=O)c2cccc(O)c2O)C1	291046409	IZEVLQBAFKHGDB-UHFFFAOYSA-N	235.283	1.970	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2CC[C@@H](CO)C2)c1	295122456	WVCFCBNPSORDRH-YPMHNXCESA-N	235.327	1.951	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC(C(F)F)C1	706479163	REXAIBZWAJCLFD-UHFFFAOYSA-N	243.209	1.435	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@H]1C[C@@H](O)C1	825256996	QHNCVLLUKRDOEW-DTORHVGOSA-N	227.691	1.659	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2CCCS2)cc1	69979618	LSAVVPUSZXQQLZ-NSHDSACASA-N	236.340	1.781	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)OCCCO	38436381	GMDYWBJIXKLGEX-HYXAFXHYSA-N	238.239	1.037	10	20	BDCD	
C[C@@H](N)[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1	126809660	IZIWIZHNIOPASS-OCCSQVGLSA-N	247.386	1.922	10	20	BDCD	
CN(C)[C@H]1CCCN(Cc2ccccc2O)C1	156069371	KDLUGPITGMXEEF-ZDUSSCGKSA-N	234.343	1.918	10	20	BDCD	
Cc1cccc(O)c1CN(C)CC(=O)O	1605344987	KRBKDMQVKLNKIC-UHFFFAOYSA-N	209.245	1.217	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@@H](C)[C@@H](C)O	840949033	OPSMMOOGILMMSE-NWDGAFQWSA-N	236.359	1.920	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)CCCN)c1	841081371	WBMNQUBSWVRPOH-LLVKDONJSA-N	222.332	1.918	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCO[C@H]2C)c1	862757865	GXVFXQLDVFRQQG-CMPLNLGQSA-N	249.310	1.742	10	20	BDCD	
Cc1cccc(O)c1CN1Cc2cnn(C)c2C1	877632484	ASALIMNTWUQDPB-UHFFFAOYSA-N	243.310	1.950	10	20	BDCD	
COc1cc(C)cc(CN(C)C[C@H](C)O)c1O	894450731	NYUTUUAREXJFQH-JTQLQIEISA-N	239.315	1.522	10	20	BDCD	
COc1ccc(CNC(=O)C(C)C)c(O)c1	794381685	ODIPIVDZCJDOPS-UHFFFAOYSA-N	223.272	1.673	10	20	BDCD	
CC[C@H](C)C(=O)NCc1ccc(N)cc1	37666231	JNFJRAYWLVRTRP-VIFPVBQESA-N	206.289	1.931	10	20	BDCD	
Nc1ccc(CCNC(=O)CC(F)(F)F)cc1	40675594	YQRXGJADRMBLAH-UHFFFAOYSA-N	246.232	1.880	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@@H](C)c1cc(F)ccc1O	168830317	DSQBONJJNUCYSL-YUMQZZPRSA-N	240.278	1.446	10	20	BDCD	
CCNC(=O)[C@@H](C)N[C@H]1CCc2cccc(O)c21	295778203	ARVMKWNVMYQGMP-KOLCDFICSA-N	248.326	1.494	10	20	BDCD	
COCC(COC)N[C@@H](C)c1ccccc1O	388444261	URZVLQJXSNRQHY-JTQLQIEISA-N	239.315	1.704	10	20	BDCD	
Cc1ccc(CN2C[C@@H](C)[C@H](C(=O)O)C2)c(O)c1	1607781316	OTZLAOMIWGPOOB-ZYHUDNBSSA-N	249.310	1.853	10	20	BDCD	
CN(CCn1ccnc1)Cc1ccccc1O	131927056	RDRULOYNFWIIEL-UHFFFAOYSA-N	231.299	1.721	10	20	BDCD	
COC[C@H](CCO)N[C@H](C)c1ccccc1O	228793936	SPWVTWJNSOXVAH-MNOVXSKESA-N	239.315	1.440	10	20	BDCD	
COc1ccc(N(C)CCOCCN)cc1	86435619	IANDZTUSJPJWMI-UHFFFAOYSA-N	224.304	1.107	10	20	BDCD	
CC[C@]1(C(=O)NCc2ccccc2O)CCNC1	228422933	MVLGQPMDVSXFBV-AWEZNQCLSA-N	248.326	1.398	10	20	BDCD	
CNC(=O)NCc1c(C)c2ccccc2n1C	336453664	UJXGBTGZIHYVSL-UHFFFAOYSA-N	231.299	1.916	10	20	BDCD	
C[C@@H](CNCc1c(O)cccc1Cl)C(=O)O	848638835	WJVWAOAONRFAEE-ZETCQYMHSA-N	243.690	1.856	10	20	BDCD	
O=C(c1cc(O)cs1)N1C[C@@H]2[C@@H](C1)C2(F)F	846665107	RNWSWKPBGJLIFT-RNFRBKRXSA-N	245.250	1.791	10	20	BDCD	
C[C@H](NC/C=C\CO)c1cc(F)cc(F)c1O	850510710	ZSDCAGVEYXHOSJ-KZUAUGPASA-N	243.253	1.870	10	20	BDCD	
CC[C@@H](C)N(CCO)Cc1ccccc1O	862386734	BBNILDCQPWUILM-LLVKDONJSA-N	223.316	1.985	10	20	BDCD	
CN(C(=O)NCc1ccc(N)cc1)C1CC1	1337019752	UISNFOLBMJMXEV-UHFFFAOYSA-N	219.288	1.573	10	20	BDCD	
Cc1nc2n(n1)CCN(Cc1ccc(N)cc1)C2	1356083093	JODKTQMAOYQMDW-UHFFFAOYSA-N	243.314	1.185	10	20	BDCD	
COCCC(=O)N(C)Cc1ccccc1O	66074666	WJKZLQKDEKSZLV-UHFFFAOYSA-N	223.272	1.387	10	20	BDCD	
Oc1cc2c(cc1CN1CC[C@@H](F)C1)OCO2	689857749	GAUOXBXHELNZRN-SECBINFHSA-N	239.246	1.665	10	20	BDCD	
C[C@@H](Sc1nccs1)C(=O)C(=O)O	1609806626	OVSRZKTTZPPXFT-SCSAIBSYSA-N	217.271	1.277	10	20	BDCD	
C[C@H](O)CN[C@H](C)c1cc(C(=O)O)ccc1O	1593462540	MEEDHNAQPMNZNY-JGVFFNPUSA-N	239.271	1.122	10	20	BDCD	
CNCCNCc1ccc(N(C)C)cc1	161284412	VDRMUHNVKNRZOE-UHFFFAOYSA-N	207.321	1.062	10	20	BDCD	
Cc1cccc(CNCC[C@H](C)O)c1O	162864911	TZPPMRGDNYVTQU-JTQLQIEISA-N	209.289	1.561	10	20	BDCD	
COc1ccc(CN[C@@H](C)CCN)cc1C	841051445	QALXRUOVMGCWMD-NSHDSACASA-N	222.332	1.831	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H](C)CCO)c1	132435069	KVZYOEUWXVLTME-ZJUUUORDSA-N	239.315	1.822	10	20	BDCD	
CCN1CCN(Cc2ccccc2O)CC1=O	273534550	VXODEMAIJNSCKI-UHFFFAOYSA-N	234.299	1.056	10	20	BDCD	
CO[C@H](C)CNC(=O)c1c(F)ccc(O)c1O	295153055	BXXSDQMIJZEYQF-ZCFIWIBFSA-N	243.234	1.002	10	20	BDCD	
C[C@H](CC(=O)O)C(=O)NCc1ccccc1O	827296636	VQGQKJXZWCAZMF-MRVPVSSYSA-N	237.255	1.119	10	20	BDCD	
Cc1cccc(CN[C@@H](C)CCN)c1O	841049742	GWNSUOGHENUFIM-JTQLQIEISA-N	208.305	1.528	10	20	BDCD	
Cc1cccc(CN2CCC(N)CC2)c1O	843047074	FOOFCYQKBKJUBA-UHFFFAOYSA-N	220.316	1.624	10	20	BDCD	
CCN(CC)c1ccc(CNCCNC)cc1	841035651	LMKITGVWZVRQJV-UHFFFAOYSA-N	235.375	1.842	10	20	BDCD	
CCOCc1nc(Cc2ccc(N)cc2)no1	843159458	PVCBEWAXFLHIFV-UHFFFAOYSA-N	233.271	1.779	10	20	BDCD	
Oc1ccc(F)cc1CN1CCc2c[nH]nc2C1	779021461	YXTSMBCBHSESMT-UHFFFAOYSA-N	247.273	1.813	10	20	BDCD	
COC[C@@H]1CN(CCN=[N+]=[N-])CC1(C)C	409436070	XXCSVIBSQGJWLX-VIFPVBQESA-N	212.297	1.901	10	20	BDCD	
[N-]=[N+]=NCC(=O)N(C1CCOCC1)C1CC1	409431712	KBNNMFYTDHOTFX-UHFFFAOYSA-N	224.264	1.467	10	20	BDCD	
COc1cccc(CN[C@@H](C)[C@H](C)OC)c1O	189106839	HKNJXTOKHNKFBH-UWVGGRQHSA-N	239.315	1.914	10	20	BDCD	
C[C@H](CC(=O)O)NCc1ccc(N(C)C)cc1	738891143	NIYLFHZHMSIAAU-SNVBAGLBSA-N	236.315	1.705	10	20	BDCD	
C[C@@H]1C[C@H]1CNC(=O)NCc1ccc(N)cc1	1346191589	OESOVZTXCSDJNQ-KOLCDFICSA-N	233.315	1.724	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@@H]1CCc2cccc(O)c21	383581200	FLIXXCWEWWFSFX-WCBMZHEXSA-N	234.299	1.233	10	20	BDCD	
C[C@H]1[C@H](CO)CCN1C(=O)Cc1ccc(N)cc1	385964776	ZIXICMMDTUAGQM-JQWIXIFHSA-N	248.326	1.041	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1COCCO1	1333027933	OPTMLZJYRPROTL-LBPRGKRZSA-N	237.299	1.239	10	20	BDCD	
CO[C@@H]1CCN(Cc2cccc(C)c2O)C1	300046732	ZEZXCMFAXGJTIF-GFCCVEGCSA-N	221.300	1.921	10	20	BDCD	
CN(C)c1ccc(CNCc2nncn2C)cc1	37988969	RCHZEVVIBOTYSG-UHFFFAOYSA-N	245.330	1.171	10	20	BDCD	
C[C@H](NCCCO)c1ccc(N(C)C)cc1	37236428	VTLAZVNAWSMSSZ-NSHDSACASA-N	222.332	1.786	10	20	BDCD	
COc1cccc(CNC2CSC2)c1O	380277700	YAGYZFJCQCHTSW-UHFFFAOYSA-N	225.313	1.606	10	20	BDCD	
Cc1nc(NCc2ccc(N(C)C)cc2)n(C)n1	162454957	XPBXVYMVBISOLG-UHFFFAOYSA-N	245.330	1.802	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CC23CCNCC3)cc1	237988702	WXRPEZBWVBXEAW-LBPRGKRZSA-N	245.326	1.597	10	20	BDCD	
COCc1noc(CN(C)c2ccc(N)cc2)n1	863558605	OWLITHRIKGRBGH-UHFFFAOYSA-N	248.286	1.435	10	20	BDCD	
C[C@@H]1COCC[C@@H]1NCCc1ccc(N)cc1	817957637	NHBJGIHSTBYUOL-RISCZKNCSA-N	234.343	1.826	10	20	BDCD	
CCc1cccc(CN[C@@H](CO)CCF)c1O	848918722	JNMCZADOOVPYEO-GFCCVEGCSA-N	241.306	1.765	10	20	BDCD	
CNC[C@H](C)N[C@@H](C)c1cc(OC)ccc1O	854231374	GSKJPQUSAUWNCD-UWVGGRQHSA-N	238.331	1.659	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H](C)CCCO	877109244	DDQWYKCVDSTAIA-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
CN(c1ccc(N)cc1)C(=O)[C@H]1C[C@@H](O)C1	877076103	JTLXKNXKFAZTMX-DKTWLAJQSA-N	220.272	1.003	10	20	BDCD	
CC1(C)CN(C(=O)/C=C\c2ccc(O)c(O)c2)C1	790236538	HHEPTPUUILTPST-XQRVVYSFSA-N	247.294	1.979	10	20	BDCD	
C[C@@H](NCCNC(=O)C1CC1)c1ccccc1O	167431595	NVBZARJTRSCYCU-SNVBAGLBSA-N	248.326	1.569	10	20	BDCD	
CCN(CCN)Cc1cc(F)ccc1O	300875565	YDMTVGRCMRYQPH-UHFFFAOYSA-N	212.268	1.312	10	20	BDCD	
C[C@@H](NC1CC(C(=O)O)C1)c1ccccc1O	1594206137	AHQNASOQWKOVFL-XNWIYYODSA-N	235.283	1.906	10	20	BDCD	
NC1CCC(NCc2ccc3c(c2)CCO3)CC1	51694469	CYJFVYKTDUWOSR-UHFFFAOYSA-N	246.354	1.981	10	20	BDCD	
CC[C@H](N[C@H](C)CN)c1ccc(F)cc1O	817966432	NSIQBHHHRDHMIB-KCJUWKMLSA-N	226.295	1.919	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC(=O)C2CC2)c1	728984502	QQFQPKTZHBELJE-QMMMGPOBSA-N	235.283	1.988	10	20	BDCD	
C[C@@H](NC1CC1)C(=O)Nc1ccc(N)cc1	832243987	CRQIOLQTTDZFAQ-MRVPVSSYSA-N	219.288	1.348	10	20	BDCD	
CN(C)c1ccc(CN[C@@H]2CCNC2)cc1F	841044396	FAEWSUWSUUWZOM-LLVKDONJSA-N	237.322	1.343	10	20	BDCD	
Oc1ccc(Cl)c(F)c1CN[C@H]1CCNC1	841045052	MHQWMMGABDFHOP-ZETCQYMHSA-N	244.697	1.636	10	20	BDCD	
O=C(N[C@@H]1CCCC[C@H]1O)c1cc(O)cs1	757904120	FUGUVIWVVHRKIM-RKDXNWHRSA-N	241.312	1.487	10	20	BDCD	
CC1=NO[C@H](C(=O)NCc2cc(C)ccc2O)C1	862754985	MOOBWGPQBNEYLV-LBPRGKRZSA-N	248.282	1.482	10	20	BDCD	
COc1ccc(CNC2(C)COC2)cc1C	877691356	NSXSUECMRVFAJY-UHFFFAOYSA-N	221.300	1.882	10	20	BDCD	
CCC[C@@H]1CNCCN1Cc1ccc(N)cc1	1236133115	QAOHMUOIJAZARY-CQSZACIVSA-N	233.359	1.843	10	20	BDCD	
C[C@H](N[C@H]1CC(=O)N(C)C1)c1ccccc1O	272919353	XULWYGVCQKNPKI-UWVGGRQHSA-N	234.299	1.274	10	20	BDCD	
CC[C@](C)(O)CNCc1cccc(OC)c1O	96478745	DJPNKXXXJXTXBD-ZDUSSCGKSA-N	239.315	1.651	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@@H]2CCCC[C@]2(CO)C1	409430787	JAMHTIXHJPZXIK-GXSJLCMTSA-N	238.291	1.308	10	20	BDCD	
C[C@@]1(NC(=O)Cc2ccc(N)cc2)CCOC1	119127735	FNHMEGGUINJQGN-CYBMUJFWSA-N	234.299	1.107	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2cn[nH]c2)c1	114543047	KLSKXXGPBYUUPD-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
CCN1CC(=O)N[C@@H]1c1cccc(Cl)c1O	189862626	SFODHKDZNPTIOC-NSHDSACASA-N	240.690	1.496	10	20	BDCD	
COC[C@H](C)CNCc1ccccc1O	45655969	IFNALPYDBKWDBG-SNVBAGLBSA-N	209.289	1.764	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@@H]2CCOC2)c1	131191501	NPVIULSMWWYILP-VHSXEESVSA-N	237.299	1.840	10	20	BDCD	
Oc1ccccc1CN1CC[C@H](n2cncn2)C1	364506965	HHSNOSAITZGYSQ-LBPRGKRZSA-N	244.298	1.431	10	20	BDCD	
CC[C@H](CO)N(C)Cc1ccc(N(C)C)cc1	295150875	RDBSMFOJRKHLGT-CYBMUJFWSA-N	236.359	1.955	10	20	BDCD	
CCCONC(=O)/C=C\c1ccc(O)c(O)c1	844085267	LCCIIXLHWDFJOX-XQRVVYSFSA-N	237.255	1.569	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](C)CCN	841052047	UEQJDLWDOXDERU-VIFPVBQESA-N	224.304	1.228	10	20	BDCD	
CCOCC(C)(C)NC(=O)c1cc(O)cs1	846654064	DAALUIKYBFKOJV-UHFFFAOYSA-N	243.328	1.999	10	20	BDCD	
CC1(C)CNCC[C@@H]1NCc1ccc(N)cc1	1120370574	AYTKKQLKEFBIQU-ZDUSSCGKSA-N	233.359	1.747	10	20	BDCD	
NC[C@H]1CCN(Cc2cc(Cl)ccc2O)C1	50245124	SQZWEWHZIIVYDR-SECBINFHSA-N	240.734	1.826	10	20	BDCD	
O=C(O)[C@H](NCc1ccc2c(c1)CCO2)C1CC1	86758681	KCUGSCJRFFIYIF-CYBMUJFWSA-N	247.294	1.574	10	20	BDCD	
CCO[C@@H]1CN(CCN=[N+]=[N-])C[C@@H]1OC	409435868	XAJJCDFTJKYKIA-DTWKUNHWSA-N	214.269	1.032	10	20	BDCD	
CC(C)CN(CC(N)=O)Cc1ccc(N)cc1	35366628	HBZIIPYXNIVQMO-UHFFFAOYSA-N	235.331	1.212	10	20	BDCD	
Cc1cccc(CNCC2(C)COC2)c1O	162863229	ZWPAEOLVTIEOLP-UHFFFAOYSA-N	221.300	1.827	10	20	BDCD	
CNC(=O)[C@@]1(C)CCN(Cc2ccccc2O)C1	228099597	XNAHWMJRMPYMGI-AWEZNQCLSA-N	248.326	1.350	10	20	BDCD	
C[C@H](NCc1cncn1C)c1ccccc1O	271722138	YCXITRLCRPMZHO-JTQLQIEISA-N	231.299	1.977	10	20	BDCD	
Oc1cccc2c1[C@H](NCc1ncccn1)CC2	702323150	HADSMENJEUUAGW-LLVKDONJSA-N	241.294	1.959	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H]3NCC[C@H]3C2)c1	381309954	CSJMYALGJNEVFZ-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
Cn1cncc1CN[C@@H]1CCc2cccc(O)c21	388384445	YXMFTGXCELOSCI-GFCCVEGCSA-N	243.310	1.903	10	20	BDCD	
COC(=O)[C@@H]1C[C@@H]1C(=O)N(C)c1ccc(N)cc1	877076875	WCFYBADGBWANRO-WDEREUQCSA-N	248.282	1.041	10	20	BDCD	
C[C@@]1(CN)CCN(Cc2cc(F)ccc2O)C1	310379971	PIBZKIIYWGNPCA-ZDUSSCGKSA-N	238.306	1.702	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)CCNC1CC1	37823801	ZRMITQFJCNEJDZ-UHFFFAOYSA-N	248.326	1.493	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C(N)=O	73137434	CYJXPDORDCZSJP-UHFFFAOYSA-N	207.277	1.263	10	20	BDCD	
CC[C@@H](COC)NCc1ccccc1O	70625069	WCUWUYYMGRCPAH-NSHDSACASA-N	209.289	1.907	10	20	BDCD	
CO[C@]1(CNCc2ccccc2O)CCOC1	122961308	XSBIVXDZLSJNFO-ZDUSSCGKSA-N	237.299	1.287	10	20	BDCD	
Nc1ccc(CN(CCCO)C2CC2)cc1	43444339	MDWADQKHPHKNHG-UHFFFAOYSA-N	220.316	1.616	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@H]2CCCN2)cc1	40429879	KGQCVPRKMQGKOJ-CYBMUJFWSA-N	247.342	1.121	10	20	BDCD	
C[C@H](O)CCN[C@@H](C)c1cc(F)ccc1O	87111419	IMBXBDCOBBKTQQ-IUCAKERBSA-N	227.279	1.953	10	20	BDCD	
CC(C)N(CCO)Cc1ccc(N(C)C)cc1	267966150	UQAHWZVQOPUJSA-UHFFFAOYSA-N	236.359	1.955	10	20	BDCD	
Oc1cc2c(cc1CN1CCO[C@@H]3C[C@@H]31)OCO2	368313083	SOVQWRZILGRGEJ-GXSJLCMTSA-N	249.266	1.094	10	20	BDCD	
COc1cccc([C@H](C)NCCCCO)c1O	846163982	CVMARBGNKMFGQA-JTQLQIEISA-N	239.315	1.824	10	20	BDCD	
C[C@@H](CNCc1cccc(Cl)c1O)C(=O)O	848638195	QFSBHJIXZGQMFS-ZETCQYMHSA-N	243.690	1.856	10	20	BDCD	
C[C@@H](NC/C=C/c1ccc(N(C)C)cc1)C(=O)O	854240300	RRHRJMSETLVUET-SGUJLRQBSA-N	248.326	1.829	10	20	BDCD	
Cc1ccc(CNC[C@H]2CCOC2)c(O)c1	876930127	LVUHOSLKDNYDNH-LLVKDONJSA-N	221.300	1.827	10	20	BDCD	
CN(C(=O)[C@@H](N)C1CCC1)c1ccc(N)cc1	877076978	ZJDVKZCFAGQLMN-LBPRGKRZSA-N	233.315	1.359	10	20	BDCD	
CCN(CCO)Cc1c(C)cccc1O	876526879	JFMNJUFNUFNRLX-UHFFFAOYSA-N	209.289	1.515	10	20	BDCD	
Cc1ccc(CN2CCNC(=O)C2(C)C)c(O)c1	876689674	JMOHEWASILLXFZ-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
CCOc1cccc(CNCC[C@H](C)O)c1O	78780162	TWWKFCXJXOZHEK-JTQLQIEISA-N	239.315	1.651	10	20	BDCD	
Nc1ccc(CC(=O)N2CC[C@@H](CF)C2)cc1	711436040	WQMXARZMADWBFQ-NSHDSACASA-N	236.290	1.629	10	20	BDCD	
C[C@H](CO)CNCc1cccc(F)c1O	165167633	KHFQLCJVABJKNJ-QMMMGPOBSA-N	213.252	1.249	10	20	BDCD	
Nc1ccc(NC(=O)NC2(CO)CCCC2)cc1	841300957	XUOBVYMPIFXCLH-UHFFFAOYSA-N	249.314	1.695	10	20	BDCD	
Oc1ccc(F)cc1CNCC1=CCCOC1	290176187	NHFCDXURGYYZBM-UHFFFAOYSA-N	237.274	1.968	10	20	BDCD	
CC(C)[C@H](Sc1nccs1)C(N)=O	308135125	DWRCOGQHCAJPMT-LURJTMIESA-N	216.331	1.745	10	20	BDCD	
CC(C)(O)CNCc1cc([N+](=O)[O-])ccc1O	111385810	OPTGWXSJFYWGHF-UHFFFAOYSA-N	240.259	1.161	10	20	BDCD	
CC(C)N(C)CC(=O)Nc1ccc(N)cc1	22218413	BXKBLNQMVDQPBK-UHFFFAOYSA-N	221.304	1.548	10	20	BDCD	
CC1(O)CCN(Cc2ccccc2O)CC1	179576310	FVLITFIKVJIFOH-UHFFFAOYSA-N	221.300	1.739	10	20	BDCD	
CN(CCN1CCOCC1)Cc1ccc(N)cc1	35063940	DDCGDERSAORYTH-UHFFFAOYSA-N	249.358	1.033	10	20	BDCD	
C[C@@H](O)CNCc1ccc2c(c1)CCO2	37363048	IUALAJFTRVNAJV-SECBINFHSA-N	207.273	1.092	10	20	BDCD	
Cc1ccc(O)c(CN2CCS(=O)CC2)c1	132682866	RMDGMBQOBSJRQZ-UHFFFAOYSA-N	239.340	1.265	10	20	BDCD	
CN(C)c1ccc(CN(CCO)C2CC2)cc1	133103849	BAUKKRUFJKUESU-UHFFFAOYSA-N	234.343	1.709	10	20	BDCD	
COC[C@@H](O)CCNCc1cc(F)ccc1O	226618234	UMQYVAZUSLPPNA-NSHDSACASA-N	243.278	1.018	10	20	BDCD	
C[C@@H](NCC(F)(F)CN)c1cc(F)ccc1O	817966655	SOHAVPVWDXVRPK-SSDOTTSWSA-N	248.248	1.776	10	20	BDCD	
C[C@H]1NCCN(Cc2cccc(F)c2O)[C@@H]1C	843057226	GXSVQLWCTJRGIF-NXEZZACHSA-N	238.306	1.714	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)CCCN)c1	841081358	VLANYNTUUOZFON-JTQLQIEISA-N	238.331	1.618	10	20	BDCD	
Cc1cccc(O)c1CN(C)CC(C)(C)O	876737275	PHWQNPFRIUAZOF-UHFFFAOYSA-N	223.316	1.903	10	20	BDCD	
C[C@@H]1C[C@H](O)CN1Cc1ccc(N(C)C)cc1	788268491	DLEGAVLLHHKIBJ-RISCZKNCSA-N	234.343	1.708	10	20	BDCD	
CN[C@H](C)CCNCc1cccc(OC)c1O	1326076597	PSMPUNJNBWTYKK-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@H]2C[C@H](O)C2)c(O)c1	850577891	DYLBHEQSEROZOG-GMTAPVOTSA-N	221.300	1.875	10	20	BDCD	
CN(C)c1ccc(CNC(=O)N2CCC2)cc1	53984643	AWKAXFPXMBMECZ-UHFFFAOYSA-N	233.315	1.668	10	20	BDCD	
CC(=O)OC1CCN(Cc2ccccc2O)CC1	179576056	LIDMDNIEUVJATH-UHFFFAOYSA-N	249.310	1.920	10	20	BDCD	
COC(=O)[C@@H](C)NCc1c(O)cccc1Cl	127312781	JAHYFRZSLKQRHK-SSDOTTSWSA-N	243.690	1.697	10	20	BDCD	
Cc1noc(CN(C)c2ccc3c(c2)OCO3)n1	121306762	SHPQAHZEAGHVNC-UHFFFAOYSA-N	247.254	1.743	10	20	BDCD	
Nc1ccc(NC(=O)C[C@@H]2CCCO2)cc1	83522083	YOAMXLWJTZLDHK-NSHDSACASA-N	220.272	1.776	10	20	BDCD	
Cc1cccc(CNC[C@@](C)(O)C2CC2)c1O	383612951	SYXXJPIKQFZEQV-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
CC1(NC(=O)c2cccc(O)c2O)CC1	163279273	HRLNIOYIPZZNTG-UHFFFAOYSA-N	207.229	1.380	10	20	BDCD	
OC/C=C\CNCc1c(O)cccc1Cl	717536377	XXBKHSLRCJHQFF-UPHRSURJSA-N	227.691	1.684	10	20	BDCD	
CC(C)[C@@H](N)CN[C@@H]1CCc2cccc(O)c21	817959135	PODWISYSHDBUES-NWDGAFQWSA-N	234.343	1.952	10	20	BDCD	
CCN(CC(C)=O)C(=O)c1cc(O)cs1	908387343	LMKSHAITYBRQTF-UHFFFAOYSA-N	227.285	1.505	10	20	BDCD	
NC1(CN[C@@H]2CCc3cccc(O)c32)CC1	902406532	NKMBQZOPWHPIGC-SNVBAGLBSA-N	218.300	1.460	10	20	BDCD	
CC(C)(N)CNCCc1ccc(N)cc1	843125507	ATTSIKYNSRBFHT-UHFFFAOYSA-N	207.321	1.138	10	20	BDCD	
C[C@@H](O)C(=O)NCc1cc(Cl)ccc1O	846474347	UUVOVMCBTBNQOE-ZCFIWIBFSA-N	229.663	1.043	10	20	BDCD	
Cc1cc(CN2C[C@H](N)C[C@@H]2C)ccc1N(C)C	923412915	KYJIUBWCPIEFQH-GXTWGEPZSA-N	247.386	1.983	10	20	BDCD	
C[C@H](c1ccc(N(C)C)cc1)N1C(=O)CNC1=O	761577384	GWEDYLXWSVNGIR-SECBINFHSA-N	247.298	1.365	10	20	BDCD	
Cc1ccc(CN[C@H](CO)CC2CC2)c(O)c1	877117536	GRRUUMDXVJZOOT-ZDUSSCGKSA-N	235.327	1.951	10	20	BDCD	
Cc1ccc(CN2C[C@H]3C[C@H]2C(=O)O3)c(O)c1	877561154	HZJCVPBKRVZHOY-MNOVXSKESA-N	233.267	1.200	10	20	BDCD	
COc1cccc(O)c1CN1C[C@H]2C[C@@]2(CO)C1	783735432	QEODIIAWHJBMJX-YGRLFVJLSA-N	249.310	1.215	10	20	BDCD	
COC(=O)[C@@H](N[C@H](C)c1ccccc1O)C1CC1	879649593	WYSNYYPVYGJVGW-RNCFNFMXSA-N	249.310	1.994	10	20	BDCD	
COc1ccc(O)c(CNCc2ncc(C)[nH]2)c1	693491870	JLSXRPQFRQKTRK-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
COC(=O)CC(C)(C)NCc1ccc(N)cc1	1336116049	ANZVJBNTQNRLOB-UHFFFAOYSA-N	236.315	1.700	10	20	BDCD	
CC(C)CC(=O)NCc1ccc(O)c(O)c1	159035635	LJNBUEGKWCFQBF-UHFFFAOYSA-N	223.272	1.760	10	20	BDCD	
Cc1nc(C(=O)NCc2ccccc2O)co1	801614773	ZTXCHKQPELOLDW-UHFFFAOYSA-N	232.239	1.619	10	20	BDCD	
CO[C@@H](C)C(=O)N[C@H](C)c1ccccc1O	827930225	FJXLTLNFXKAGFR-BDAKNGLRSA-N	223.272	1.604	10	20	BDCD	
Oc1ccccc1CNC[C@H]1CC[C@@H](O)C1	188818690	IWYRJVOFKJLDAE-CMPLNLGQSA-N	221.300	1.643	10	20	BDCD	
Cc1ccc(O)c(CN(C)Cc2nnc[nH]2)c1	179797244	BLOBJIWTWDEMHY-UHFFFAOYSA-N	232.287	1.451	10	20	BDCD	
C[C@@H](O)CN(C)Cc1ccc(N(C)C)cc1	130820481	JCJRTEGZBHURBL-LLVKDONJSA-N	222.332	1.565	10	20	BDCD	
C[C@@H]1CCN(C(=O)c2cccc(O)c2O)[C@@H]1C	193127098	XUBKEMNLZXOFHM-RKDXNWHRSA-N	235.283	1.968	10	20	BDCD	
COC(=O)c1cnc(S[C@H]2CCOC2)s1	295426451	YSSMWDJPQHCPQB-LURJTMIESA-N	245.325	1.811	10	20	BDCD	
O=C(NOC1CCC1)c1cccc(O)c1O	812793767	DFABQPNJAXDUTC-UHFFFAOYSA-N	223.228	1.312	10	20	BDCD	
C[C@H](NC[C@@H](N)C1CC1)c1ccccc1O	817964728	GJAJFKWPQPJNHI-JOYOIKCWSA-N	220.316	1.780	10	20	BDCD	
CN1CC[C@H](NCc2ccc3c(c2)CCCO3)C1	386486401	WVZRIKMEJRXMKM-AWEZNQCLSA-N	246.354	1.805	10	20	BDCD	
C[C@H]1CNC[C@@H](C)N1Cc1ccc(N(C)C)cc1	843066595	YNZMZPAHCYDCES-BETUJISGSA-N	247.386	1.935	10	20	BDCD	
N=C(N)NCc1cc(Cl)cc(Cl)c1O	849077371	FGPLACLFOUMQQN-UHFFFAOYSA-N	234.086	1.682	10	20	BDCD	
CC(C)[C@@H](O)COC(=O)c1cccc(O)c1O	1118459101	STTSALAQDITJGL-JTQLQIEISA-N	240.255	1.272	10	20	BDCD	
Cc1cccc(O)c1CN1CCc2nn[nH]c2C1	877641608	BDFLPOIFHHBWRN-UHFFFAOYSA-N	244.298	1.377	10	20	BDCD	
C[C@H](N[C@H](C)CCO)c1c(O)cccc1F	886530088	CUFFGJFBAVBWRI-BDAKNGLRSA-N	227.279	1.953	10	20	BDCD	
Cc1ccc(CN[C@H]2C[C@H](CO)C2)c(O)c1	897355076	CSDIWPKTQSFKDR-UMSPYCQHSA-N	221.300	1.561	10	20	BDCD	
Nc1ccc(CC(=O)NCC[C@H](O)C2CC2)cc1	1358499675	DPAZUIYGLSFKTI-ZDUSSCGKSA-N	248.326	1.089	10	20	BDCD	
C[C@@H](N)[C@H]1CCCN(Cc2ccc(N)cc2)C1	1334774815	OXZWRQCUCPYWFC-YPMHNXCESA-N	233.359	1.828	10	20	BDCD	
CC(C)[C@@H](F)C(=O)NCc1cccc(O)c1O	1350300757	YAJOYWGMQUSVKD-SNVBAGLBSA-N	241.262	1.708	10	20	BDCD	
C[C@@H](NCc1ccc(N2CCCC2)cc1)C(N)=O	37261369	XBEFWSVOUBMNNG-LLVKDONJSA-N	247.342	1.250	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)c1cn[nH]c1	37842144	VASYMROZVJZZCN-UHFFFAOYSA-N	231.255	1.388	10	20	BDCD	
C[C@H]1C(=O)NCCN1Cc1ccc(N(C)C)cc1	123385230	AYLPATVYSGDERT-NSHDSACASA-N	247.342	1.073	10	20	BDCD	
Cc1cccc(CNCCc2ccn(C)n2)c1O	230943486	QSZJIAPTZKGMRK-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
C[C@@H](O)C(=O)NCc1ccc(N2CCCC2)cc1	276107039	UZCHFHGZRCNKSY-LLVKDONJSA-N	248.326	1.284	10	20	BDCD	
CCOc1ccc(N(C)CC[S@@](C)=O)cc1	827872631	FARGVXWUAJJKGD-MRXNPFEDSA-N	241.356	1.900	10	20	BDCD	
COc1ccc2c(c1)CCCN2CCO	748815198	LKVIYEIACFTXOU-UHFFFAOYSA-N	207.273	1.440	10	20	BDCD	
CC(C)[C@H](C(=O)O)C(=O)Nc1ccc(N)cc1	849364954	UBHDZRMPQHQEAX-JTQLQIEISA-N	236.271	1.564	10	20	BDCD	
COC[C@H](O)CCNCc1cccc(C)c1O	224933010	BWHUPOHPEJYIIJ-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
Nc1ccc(NC(=O)NOCC2CC2)cc1	841298406	CRZCBNYUEVYVDM-UHFFFAOYSA-N	221.260	1.732	10	20	BDCD	
CCN(CC(=O)O)C(=O)c1cc(O)cs1	1596219466	UPEZGSDACQSZMV-UHFFFAOYSA-N	229.257	1.000	10	20	BDCD	
CN1C[C@@H](N[C@@H]2CCc3cccc(O)c32)CC1=O	297509533	CLBFIDQYEITBBP-WDEREUQCSA-N	246.310	1.200	10	20	BDCD	
COC(=O)[C@@H](C)N1CCCc2cc(CN)ccc21	700925749	WBVAGOPCEICEFH-SNVBAGLBSA-N	248.326	1.459	10	20	BDCD	
C[C@H](N)CCC(=O)N(C)Cc1ccccc1O	70316960	VVYRBYGKLLBAIU-JTQLQIEISA-N	236.315	1.478	10	20	BDCD	
C[C@@H](CNCc1ccc2c(c1)CCO2)N(C)C	38087507	CRIANRBOOFQNRQ-NSHDSACASA-N	234.343	1.661	10	20	BDCD	
Cc1[nH]ccc1C(=O)NCc1ccc(O)c(O)c1	130166734	JOSAFLHPBIFDNX-UHFFFAOYSA-N	246.266	1.664	10	20	BDCD	
O=C(/C=C/c1c[nH]cn1)N1CCCc2n[nH]cc21	282818741	PTZUZWVHZHZHED-ONEGZZNKSA-N	243.270	1.125	10	20	BDCD	
CN(Cc1cccc(F)c1O)[C@@H]1CCC[C@H]1O	289224621	CSDGLUBQIDOJSE-VXGBXAGGSA-N	239.290	1.877	10	20	BDCD	
C[C@@H](NCC1(N)CC1)c1cc(F)cc(F)c1O	902408627	ZSASWMKLYRTFCK-SSDOTTSWSA-N	242.269	1.812	10	20	BDCD	
COCCCNC(=O)c1cc(O)cs1	731866864	SQUFISASMXMYAW-UHFFFAOYSA-N	215.274	1.220	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1CC2(CC2)C1	833316544	HFZDBFAJXRIODH-UHFFFAOYSA-N	237.230	1.473	10	20	BDCD	
CC[C@@H](C(=O)NCc1ccccc1O)[C@@H](C)O	842230018	OXGFCCMLTQUKCC-MWLCHTKSSA-N	237.299	1.415	10	20	BDCD	
CCc1cccc(CN2CC[C@@H](O)C2)c1O	848881550	QTVREAYXXJBDCP-GFCCVEGCSA-N	221.300	1.521	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=N)N1CCC1	849009329	VITNNJJJECLLDL-UHFFFAOYSA-N	246.358	1.791	10	20	BDCD	
C[C@@H](CCN)NCc1cc(F)ccc1O	841052380	UUGCNFOEJDMKHI-QMMMGPOBSA-N	212.268	1.358	10	20	BDCD	
C[C@H](CN)N(C)Cc1cc(Cl)cc(F)c1O	843050857	AIQJFOAFPVCXKF-SSDOTTSWSA-N	246.713	1.964	10	20	BDCD	
C[C@@H](N)CN(C)Cc1c(O)ccc(Cl)c1F	863651142	BJIUVNWWRAICPX-SSDOTTSWSA-N	246.713	1.964	10	20	BDCD	
Cn1ncc2c1CN(Cc1ccccc1O)C2	877633043	WYBCHDBRWMTSOQ-UHFFFAOYSA-N	229.283	1.642	10	20	BDCD	
CCc1cccc(CN(C)CCC(=O)O)c1O	1593642498	QJKXHNWFYRCPQS-UHFFFAOYSA-N	237.299	1.861	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC=C(F)C1	279835179	NQNHCVDLTOAHKN-UHFFFAOYSA-N	237.230	1.797	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCCCC1	126194829	YFVZLYBIGHFNIH-UHFFFAOYSA-N	221.256	1.724	10	20	BDCD	
Cc1ccc([C@H](C)NC[C@H](C)CO)c(O)c1	83219206	DMCHHMIEBFEDPQ-QWRGUYRKSA-N	223.316	1.980	10	20	BDCD	
C[C@H](NC/C=C/CO)c1cc(F)ccc1O	717573892	AIIHKDDQBHZAPC-HPOULIHZSA-N	225.263	1.730	10	20	BDCD	
C[C@@H](O)CNCCCSc1nccs1	819063330	KQNABMIRZAQJSR-MRVPVSSYSA-N	232.374	1.596	10	20	BDCD	
CO[C@H](C)CCNC(=O)c1cc(O)cs1	732282018	HHWMZLNBMQCHGF-SSDOTTSWSA-N	229.301	1.609	10	20	BDCD	
C[C@H](NCC1(N)CC1)c1ccc(F)cc1O	902408159	XHNRYSFAHYHBKH-QMMMGPOBSA-N	224.279	1.673	10	20	BDCD	
CC[C@@H](NC(=O)c1cc(O)cs1)[C@H](C)O	839783351	XDWINTFTYXVJGV-POYBYMJQSA-N	229.301	1.343	10	20	BDCD	
Oc1cccc(Cl)c1CNC[C@@H]1CCCN1	841035685	JSOXUVIJGJNIHX-VIFPVBQESA-N	240.734	1.887	10	20	BDCD	
CCc1cccc(CN[C@@H]2C=C[C@H](CO)C2)c1O	848900196	CWJWVAUTDNJMAW-SMDDNHRTSA-N	247.338	1.981	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1CCCCN1	854428933	ZZNVEROJEZXXFR-GQCTYLIASA-N	248.282	1.238	10	20	BDCD	
CC[C@H](NC(=O)Cc1ccc(N)cc1)C(F)F	877455511	KNDQXUIRUVLEAR-JTQLQIEISA-N	242.269	1.971	10	20	BDCD	
COCC(COC)NCc1ccc(C)cc1O	877568492	PCQPYQPVUSAPTP-UHFFFAOYSA-N	239.315	1.452	10	20	BDCD	
CCCN[C@H](C)C(=O)N(C)c1ccc(N)cc1	877077792	USFPRZXMRQFWMK-SNVBAGLBSA-N	235.331	1.620	10	20	BDCD	
C[C@H](OC(=O)c1cc(O)cs1)C(=O)C1CC1	798615824	MTDVGZFMPMDGKE-LURJTMIESA-N	240.280	1.978	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)[C@H]1C[C@H]1F	1519816682	GNYPEYBYCDOQRW-DTWKUNHWSA-N	239.246	1.115	10	20	BDCD	
CN(CCNC(=O)Cc1ccc(N)cc1)C1CC1	59931479	LHPSJYCMFYHLFH-UHFFFAOYSA-N	247.342	1.022	10	20	BDCD	
CCc1cccc(CNCC2(O)CCC2)c1O	691496189	UZYHWAFCIYZNQE-UHFFFAOYSA-N	235.327	1.959	10	20	BDCD	
CN1CC[C@H](NCc2ccc3c(c2)CCO3)C1	42546028	XQFLFERGZXYKHM-ZDUSSCGKSA-N	232.327	1.415	10	20	BDCD	
Nc1ccc(CNC(=O)CC2CCNCC2)cc1	1515332562	KNYJMCTVSCSMRZ-UHFFFAOYSA-N	247.342	1.275	10	20	BDCD	
CC[C@H](CCO)NCc1cccc(C)c1O	162669069	FFFXCDGDOFBEIE-GFCCVEGCSA-N	223.316	1.951	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)C1CNC1	817902009	GPSPWEHLIQSBMW-JTQLQIEISA-N	232.327	1.319	10	20	BDCD	
OC[C@@H](NCc1ccccc1O)C1CC1	308903670	KMOLYIRVBCRSQN-LLVKDONJSA-N	207.273	1.253	10	20	BDCD	
COc1cccc(O)c1CNCC(F)F	839092100	RJZYLQVVSLSKDW-UHFFFAOYSA-N	217.215	1.756	10	20	BDCD	
CCN(CC)c1ccc(CNC(=O)[C@@H](C)N)cc1	178712078	SKIKPTIAJPBJAW-LLVKDONJSA-N	249.358	1.496	10	20	BDCD	
Cc1cc(CNC(=O)c2cccc(O)c2O)no1	126356308	YLQADULGTBUGEJ-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
CO[C@H]1CCN(Cc2cccc(C)c2O)C1	234900549	ZEZXCMFAXGJTIF-LBPRGKRZSA-N	221.300	1.921	10	20	BDCD	
CC(C)N(C)C(=O)c1cccc(O)c1O	163267555	QBISLUOGUATFHV-UHFFFAOYSA-N	209.245	1.578	10	20	BDCD	
C[C@@H](CN)CN[C@@H](C)c1ccc(F)cc1O	817962953	PSQFSFXASMLSHY-IUCAKERBSA-N	226.295	1.777	10	20	BDCD	
CC[C@@H](N)CNCc1ccc(OC)c(C)c1	841070118	LPCHJGXOVQAGKX-GFCCVEGCSA-N	222.332	1.831	10	20	BDCD	
Cc1ccc(CNC[C@]2(C)CCC(=O)N2)c(O)c1	877578106	UZEUDJGCTVFPCX-AWEZNQCLSA-N	248.326	1.459	10	20	BDCD	
COC(=O)C(C)(C)NCc1ccccc1O	37085328	AFRUNIBFTVZMQW-UHFFFAOYSA-N	223.272	1.433	10	20	BDCD	
NC1CC(NCc2ccc(N3CCCC3)cc2)C1	1336325235	OYAWGCPRGFBJEW-UHFFFAOYSA-N	245.370	1.866	10	20	BDCD	
C[C@H]1COC[C@@H]1NCc1ccc2c(c1)CCO2	710894170	UBGSNECJFNWOOJ-GWCFXTLKSA-N	233.311	1.746	10	20	BDCD	
C[C@H]1COCCN(Cc2ccccc2O)C1	369450279	CJGUVPJQMVVUJQ-LLVKDONJSA-N	221.300	1.861	10	20	BDCD	
C[C@]1(CNC(=O)Nc2ccc(N)cc2)CCOC1	397113564	FANPINLRUUXLTC-CYBMUJFWSA-N	249.314	1.817	10	20	BDCD	
Nc1ccc(CC(=O)NC2CCC(N)CC2)cc1	51694804	PFFGYMKJOTXCFN-UHFFFAOYSA-N	247.342	1.197	10	20	BDCD	
C[C@H](O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1	272522030	LLUSNCXLJKZVMF-GXTWGEPZSA-N	248.370	1.955	10	20	BDCD	
Cn1ncc2c1CN(C(=O)c1cc(O)cs1)C2	857878351	YJCZVCVQSGWVFP-UHFFFAOYSA-N	249.295	1.343	10	20	BDCD	
C[C@H](CCNCc1ccccc1O)N(C)C	697884607	ATRVLMGKIVBHJJ-LLVKDONJSA-N	222.332	1.822	10	20	BDCD	
CC[C@@](C)(O)CNCc1ccc(C)cc1O	876915367	QIZBPBHQUBRDSE-CYBMUJFWSA-N	223.316	1.951	10	20	BDCD	
C[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1	768443970	KEISHHWBFQAHRR-RNCFNFMXSA-N	249.310	1.660	10	20	BDCD	
CCO[C@@H](CC)C(=O)NCc1ccccc1O	769364250	ZGAOGRCHMQGXAD-LBPRGKRZSA-N	237.299	1.824	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]2F)c1	1123941181	WRSYRKRLVBNGEU-ZJUUUORDSA-N	223.247	1.675	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3C[C@@]3(CO)C2)c1O	783744653	SXYJTZBFYABHGH-JSGCOSHPSA-N	233.311	1.515	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCC[C@@H]2CO)c1O	224886263	YOEFETNRHUJYQX-CHWSQXEVSA-N	235.327	1.951	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1CCOC1	111235622	FQXUJVDNVKZTOZ-NSHDSACASA-N	221.300	1.861	10	20	BDCD	
Oc1ccc(F)cc1CN1C[C@H]2COC[C@H]2C1	718251686	SLFQFJAPZOQHOV-PHIMTYICSA-N	237.274	1.610	10	20	BDCD	
CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	5097783	JKWXVJGHRJHYCY-AWEZNQCLSA-N	249.358	1.491	10	20	BDCD	
O[C@@H](CNCc1ccc2c(c1)CCCO2)C1CC1	921742618	XAZQAGMDSKFWPT-AWEZNQCLSA-N	247.338	1.872	10	20	BDCD	
OC[C@@H]1CC[C@H](NCc2ccc3c(c2)CCO3)C1	295128633	XSMKMZBQAKVDNZ-OCCSQVGLSA-N	247.338	1.872	10	20	BDCD	
CC[C@H]1COCCN1Cc1ccc(N)cc1	36322308	LJKDKPYAZQABHQ-ZDUSSCGKSA-N	220.316	1.880	10	20	BDCD	
C[C@]1(CNC(=O)Cc2ccc(N)cc2)CCCO1	83946110	VJXFLRQGSUKOAG-CQSZACIVSA-N	248.326	1.497	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@@H]1CCCN1)CC2	817953602	OXXXQNLHKJOAEM-RYUDHWBXSA-N	232.327	1.721	10	20	BDCD	
Cc1cccc(CN[C@H]2[C@@H]3CNC[C@@H]32)c1O	841079112	YOWSSFFFZDFMEK-GDNZZTSVSA-N	218.300	1.008	10	20	BDCD	
C[C@H](CN)CNCc1c(O)cccc1Cl	841049157	NRUSLVXXYPEHME-MRVPVSSYSA-N	228.723	1.730	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2(C)COC2)c1	862757144	IYRSVFHSTUTWCU-UHFFFAOYSA-N	235.283	1.353	10	20	BDCD	
CN(C(=O)[C@H]1NCCC1(C)C)c1ccc(N)cc1	877074289	FPLVYLHXGOKNNN-GFCCVEGCSA-N	247.342	1.620	10	20	BDCD	
CN1CCCC[C@@H]1C(=O)Nc1ccc(N)cc1	832244124	LFXGPATUEFHMLQ-GFCCVEGCSA-N	233.315	1.692	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC[C@H](C)O)c1	35629072	WFPWAOXCHZCBEI-UWVGGRQHSA-N	209.289	1.732	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1[C@H]2CCC[C@@H]12	182519367	BQAVFRWWJSOAKM-HWYHXSKPSA-N	247.294	1.760	10	20	BDCD	
COc1ccc(O)c(CNCc2cc[nH]n2)c1	41014818	PZLGKQZASOVTHN-UHFFFAOYSA-N	233.271	1.414	10	20	BDCD	
CN(C)c1ccc(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1	367786568	YLBZAGHQPZDHSA-FICVDOATSA-N	246.354	1.423	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@@H]1COCC[C@H]1O)CC2	710859856	JFSMXELLICTNTH-QJPTWQEYSA-N	249.310	1.119	10	20	BDCD	
Cc1cccc(CN2C[C@@H](CN)C[C@H]2C)c1O	843057263	HQPKZQKXOPMRLL-VXGBXAGGSA-N	234.343	1.870	10	20	BDCD	
COCCCCN(C)C(=O)c1cc(O)cs1	842276923	ADRKMLWKNPSHKU-UHFFFAOYSA-N	243.328	1.952	10	20	BDCD	
C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)CNC1=O	761577388	GWEDYLXWSVNGIR-VIFPVBQESA-N	247.298	1.365	10	20	BDCD	
Oc1cc2c(cc1CN1CCO[C@@H]3C[C@@H]31)CCC2	793617530	KXOJYLMJHJHIQT-DZGCQCFKSA-N	245.322	1.854	10	20	BDCD	
O=C(O)C1=NO[C@@H](CSc2nccs2)C1	1601739868	MLQBGQUQQPJWAH-RXMQYKEDSA-N	244.297	1.465	10	20	BDCD	
C[C@H]1NCC[C@@H]1NCc1cccc(Cl)c1O	1579505042	GMMYFOBTZVZNEC-KCJUWKMLSA-N	240.734	1.886	10	20	BDCD	
Cc1cccc(CN[C@@H](C)CC(N)=O)c1O	162704708	ZIQVBPYOGJWKIE-VIFPVBQESA-N	222.288	1.054	10	20	BDCD	
CC[C@@H](OC)C(=O)NCCc1ccc(N)cc1	269150002	NUYBTKQNQVFTCT-GFCCVEGCSA-N	236.315	1.353	10	20	BDCD	
O=C(O)c1cncnc1NCc1ccccc1O	1602543309	KXQYADHJXJRAIP-UHFFFAOYSA-N	245.238	1.493	10	20	BDCD	
CC(C)CNC(=O)c1cccc(O)c1O	126191250	MEMRACIIMUMOLA-UHFFFAOYSA-N	209.245	1.484	10	20	BDCD	
COc1ccc(O)c(CN2CCO[C@H](C)C2)c1	131950350	ADMZEWQUVKWXCD-SNVBAGLBSA-N	237.299	1.622	10	20	BDCD	
C[C@H]1C[C@H](NCCO)c2c(O)ccc(F)c21	381259262	RNMDJPJGVGWXFE-CBAPKCEASA-N	225.263	1.662	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@@H]1CCOC1)CC2	381496008	BFMOYAIFBIECIT-MNOVXSKESA-N	219.284	1.758	10	20	BDCD	
CCN(C)C(=O)CN(C)Cc1ccccc1O	264716402	NNMDDQNYRQUZQD-UHFFFAOYSA-N	236.315	1.302	10	20	BDCD	
C[C@@H](OCC1CC1)C(=O)NCc1ccc(N)cc1	837303347	IEXSJHMIXWVJGX-SNVBAGLBSA-N	248.326	1.700	10	20	BDCD	
C[C@H](N[C@@H](CO)CCF)c1cc(F)ccc1O	846208311	IGFCZLBSEFVSLV-WCBMZHEXSA-N	245.269	1.902	10	20	BDCD	
CCOc1ccc(CNCC(C)(C)N)c(O)c1	841031608	XUFMMTLCBWNACO-UHFFFAOYSA-N	238.331	1.618	10	20	BDCD	
CC(=O)N[C@H]1CCN(Cc2c(C)cccc2O)C1	877594988	PADZZHIBWSENRI-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
OC[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C1	893985815	HOWZSQBZHDVHRB-MRVPVSSYSA-N	243.253	1.485	10	20	BDCD	
Nc1ccc(N2CC[C@H](O)[C@H](CCF)C2)cc1	409425353	AJLIYYXIJJINKF-MFKMUULPSA-N	238.306	1.816	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)/C=C/c2cccnc2)C1	409423383	NWIOFSJDCPPMHS-ONEGZZNKSA-N	229.243	1.616	10	20	BDCD	
COC(=O)[C@@H](C)NCc1c(O)cccc1OC	793358282	PFEOOHZQEORAAW-MRVPVSSYSA-N	239.271	1.052	10	20	BDCD	
Nc1ccc(CNC(=O)c2ccco2)cc1	32013095	PKKBAMNHRSOQAB-UHFFFAOYSA-N	216.240	1.792	10	20	BDCD	
C[C@H](NCc1ccc(N(C)C)cc1)C1CNC1	686220788	YWABALFTSQBXIR-NSHDSACASA-N	233.359	1.450	10	20	BDCD	
O=C(NC[C@@H]1CCC=CO1)c1cccc(O)c1O	380065610	HPVVNTIUNWIVIV-VIFPVBQESA-N	249.266	1.520	10	20	BDCD	
C[C@@H](NCCCn1cncn1)c1ccccc1O	381847177	ZHZFBEQBKCRFOO-LLVKDONJSA-N	246.314	1.725	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)c1ccon1	156637925	SKNUOHGCNURBQV-UHFFFAOYSA-N	248.238	1.058	10	20	BDCD	
C[C@H]1CCN(Cc2ccccc2O)[C@H]1CO	249148792	ZVPANAHJGCLZTH-JQWIXIFHSA-N	221.300	1.595	10	20	BDCD	
CC(=O)C(=O)CSc1nccs1	288298402	BXULHYWWWHBIMF-UHFFFAOYSA-N	201.272	1.393	10	20	BDCD	
CCO[C@H]1C[C@H]1C(=O)N[C@H](C)c1ccccc1O	827930231	FKEOHCMQWMJLFJ-XWIASGKRSA-N	249.310	1.994	10	20	BDCD	
COc1cccc(O)c1CN(C)[C@H](C)CCO	846111896	RWSUWEZFHJWZPJ-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@H]1CCCNC1	841043868	YBUMHHTUYNGKDL-VIFPVBQESA-N	240.734	1.887	10	20	BDCD	
C[C@H](O)CN(C)Cc1ccc(N(C)C)c(F)c1	776521537	SAKXSUDSCYASGQ-JTQLQIEISA-N	240.322	1.704	10	20	BDCD	
CO[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	83916807	PYFKRBXDVISIAI-LBPRGKRZSA-N	234.299	1.059	10	20	BDCD	
[N-]=[N+]=NCCN1CCC[C@]2(C[C@H](O)CCO2)C1	409428590	GSWDXHIUAAGPCR-MNOVXSKESA-N	240.307	1.303	10	20	BDCD	
Nc1ccc(CNC(=O)NOCC2CC2)cc1	1335526227	VICMMLCVFDUXKS-UHFFFAOYSA-N	235.287	1.410	10	20	BDCD	
CC(C)(C)ONC(=O)c1c(F)ccc(O)c1O	1338903010	DGUDHTNEKYDKLM-UHFFFAOYSA-N	243.234	1.697	10	20	BDCD	
CCC(N)(CC)CNCc1ccc(N)cc1	1336287266	ZXTSOSFBTPLXHE-UHFFFAOYSA-N	221.348	1.876	10	20	BDCD	
CC(C)(C)C(=O)C(=O)NCc1ccc(N)cc1	1515332091	HSJDPTNLDKEUGL-UHFFFAOYSA-N	234.299	1.500	10	20	BDCD	
CN(C)c1ccc(OCC2(C(=O)O)CC2)cc1	1606058729	LWVQYIBNWASGBK-UHFFFAOYSA-N	235.283	1.996	10	20	BDCD	
CN[C@@H]1CCN(Cc2c(O)cccc2OC)C1	843045422	QHEBEENYHXYDPA-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@@H]1CCC[C@H]1O)CC2	834912299	CGOGVPDACVZEKX-GRYCIOLGSA-N	233.311	1.883	10	20	BDCD	
CCN(CC(=O)O)Cc1ccc(N(C)C)cc1	33465780	MRYTWNLOWWENHE-UHFFFAOYSA-N	236.315	1.659	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](CO)C2)c1	92764597	VEQYQCRGMKYXLI-LLVKDONJSA-N	221.300	1.515	10	20	BDCD	
COCCC(=O)NCc1ccc(N(C)C)cc1	263855463	GBXCRGKLZOGTSD-UHFFFAOYSA-N	236.315	1.405	10	20	BDCD	
CC(C)(C)C(=O)C(=O)NCCc1ccc(N)cc1	269150855	QGUWFNOPWFDVLC-UHFFFAOYSA-N	248.326	1.543	10	20	BDCD	
CC[C@@H](NCc1cccc(C)c1O)[C@@H](C)O	386737655	XHQXRQRBRPRZTQ-ZYHUDNBSSA-N	223.316	1.950	10	20	BDCD	
CC[C@@H](NCc1ccc(OC)c(C)c1)C(=O)O	818316908	HRXSEXBHHOROHJ-LLVKDONJSA-N	237.299	1.956	10	20	BDCD	
CCNCCN[C@H](C)c1cc(C)ccc1O	817951610	HIDRLLHWRJWMBD-LLVKDONJSA-N	222.332	1.961	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1(N(C)C)CC1	830141468	UZFMLEPWHZNAFG-UHFFFAOYSA-N	248.326	1.445	10	20	BDCD	
COc1ccc(N(C)C[C@@H](O)CSC)cc1	844352677	BZLVMAYGEAKZBI-LLVKDONJSA-N	241.356	1.855	10	20	BDCD	
C[C@@H](CN)CNCc1c(O)cccc1Cl	841049159	NRUSLVXXYPEHME-QMMMGPOBSA-N	228.723	1.730	10	20	BDCD	
Cc1cccc(O)c1CNCCC[C@@H](C)O	877484822	PCCRGPNVXWSGCK-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
Cc1c[nH]cc1C(=O)NCc1ccc(O)c(O)c1	778918917	OTYOHTUAXATWGJ-UHFFFAOYSA-N	246.266	1.664	10	20	BDCD	
COCC(=O)N(C)Cc1ccc(N(C)C)cc1	52843758	DZYMTEBGMHFYBW-UHFFFAOYSA-N	236.315	1.357	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)CCCO1	61913560	MFECNYQSMIEEOM-NSHDSACASA-N	248.326	1.449	10	20	BDCD	
CN(Cc1cnc[nH]1)Cc1ccccc1O	91956770	LAGLCFQZLOZQCH-UHFFFAOYSA-N	217.272	1.747	10	20	BDCD	
CC1(C)NCC[C@@H]1NCc1ccc(N)cc1	1335288434	FVNJPZYTAHVBET-LBPRGKRZSA-N	219.332	1.499	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2COC[C@@H]2C)c1	699482840	ZXPHGQAODWQMES-JQWIXIFHSA-N	221.300	1.825	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1CCC[C@@H]1O	305745875	OXXVDSISGAZFLD-OCCSQVGLSA-N	235.327	1.985	10	20	BDCD	
COC[C@@](C)(O)CNCc1cc(F)ccc1O	382583597	ZBIZPCYYYCKFAN-LBPRGKRZSA-N	243.278	1.018	10	20	BDCD	
CSCCCNC(=O)Cc1ccc(N)cc1	68993523	MZSVJFHBOCMDSD-UHFFFAOYSA-N	238.356	1.681	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)CC[C@H]1O	253210665	ZQJZFEQYCCMRLU-GXFFZTMASA-N	220.316	1.472	10	20	BDCD	
O=C(NCCC1CC1)c1c(F)ccc(O)c1O	295053665	SUKJNRYVWQSSGL-UHFFFAOYSA-N	239.246	1.767	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H]2CCCCN2)c1	841033042	NDPFSQFFWMIRSC-ZDUSSCGKSA-N	234.343	1.932	10	20	BDCD	
COC(=O)NCc1ccc(N(C)C)c(F)c1	746864702	UJDCLXUPHSKFDO-UHFFFAOYSA-N	226.251	1.748	10	20	BDCD	
Cc1ccc(CNCC(=O)NCC2CC2)c(O)c1	877166573	BTXBPMOVTUBMDB-UHFFFAOYSA-N	248.326	1.316	10	20	BDCD	
COCCN(C)Cc1ccc(C)cc1O	876564788	ONJKLJNPBYFUOO-UHFFFAOYSA-N	209.289	1.779	10	20	BDCD	
COc1cc(C)cc(CN[C@H]2CCOC2)c1O	894355518	XXPZQEGEABLBCV-NSHDSACASA-N	237.299	1.588	10	20	BDCD	
CN[C@H](C)CCNCc1cc(OC)ccc1O	1325268070	OTPFSAPTEBMEDF-SNVBAGLBSA-N	238.331	1.488	10	20	BDCD	
Cc1noc(C)c1CC(=O)N1CC(N=[N+]=[N-])C1	409423525	OVIBHAZOKVVSHY-UHFFFAOYSA-N	235.247	1.355	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccncc2)C1	409422408	DSVUSGITJWYYSG-UHFFFAOYSA-N	203.205	1.216	10	20	BDCD	
C[C@@H](CC(=O)O)C(=O)N1Cc2cccc(O)c2C1	1604094261	MIPJTNOYFLOCJW-QMMMGPOBSA-N	249.266	1.345	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1(F)CCC1	1548791640	TXIKDHQLTBGLQG-UHFFFAOYSA-N	239.246	1.606	10	20	BDCD	
C[C@@H]1OCC[C@@H]1C(=O)NCc1ccccc1O	163138790	ZHECCSVZLJFIQE-ONGXEEELSA-N	235.283	1.433	10	20	BDCD	
CNC[C@@H]1CCCN(Cc2ccccc2O)C1	40592062	AGPZNXNIQVDWLB-LBPRGKRZSA-N	234.343	1.824	10	20	BDCD	
Cc1ccc(C(=O)N[C@H]2CC2(C)C)c(O)c1O	272760550	LJXIBRABVHXWAX-VIFPVBQESA-N	235.283	1.935	10	20	BDCD	
CC[C@H]1CN(Cc2cc(F)ccc2O)C[C@H]1O	272355108	DQWGERXUKJTDKS-TVQRCGJNSA-N	239.290	1.734	10	20	BDCD	
CCC(=O)c1ccc(OCC(=O)C(C)=O)cc1	289520204	DBVSYMTVVVQZTB-UHFFFAOYSA-N	234.251	1.816	10	20	BDCD	
C[C@H](N)CCN[C@@H](C)c1cc(F)ccc1O	817952777	MKKIPYFWHAJXRO-IUCAKERBSA-N	226.295	1.919	10	20	BDCD	
CNCCN[C@@H](C)c1ccc(F)cc1O	817952450	QAINUKMRODSFQO-QMMMGPOBSA-N	212.268	1.401	10	20	BDCD	
C[C@H](NCC(C)(C)N)c1ccc(F)cc1O	817959652	FRDBJXXKQRFDQT-QMMMGPOBSA-N	226.295	1.919	10	20	BDCD	
CC(C)(C)[C@H](N)CC(=O)Nc1ccc(N)cc1	911659546	BTMYXQINZYNVBV-LLVKDONJSA-N	235.331	1.971	10	20	BDCD	
NC1CCN(Cc2cccc(F)c2O)CC1	843047244	HQXWSTIEQKGEBC-UHFFFAOYSA-N	224.279	1.454	10	20	BDCD	
CN(C)CC(C)(C)NC(=O)c1cc(O)cs1	854903302	XXGQFZZTSSMQLZ-UHFFFAOYSA-N	242.344	1.524	10	20	BDCD	
COc1cccc([C@@H](C)N[C@H]2C[C@H](O)C2)c1O	850578605	LZMMZDFMZMCHJO-OPRDCNLKSA-N	237.299	1.575	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)CCCCO)c1	869411957	XQCNANQACCWSAV-UHFFFAOYSA-N	237.299	1.479	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCC[C@@H](N)C2)cc1	1120370687	DMIFOOCYBKCMMR-CHWSQXEVSA-N	219.332	1.628	10	20	BDCD	
COc1cc(C)cc(CNC[C@@H](C)O)c1O	894359465	PNZGJBMQKBSBHZ-SECBINFHSA-N	225.288	1.180	10	20	BDCD	
C[C@@H](NC(=O)[C@@H](N)C1CCC1)c1ccccc1O	870988562	SNMSONWTUKBZNJ-RNCFNFMXSA-N	248.326	1.697	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@H]2CCCC[C@@]2(CO)C1	409430790	JAMHTIXHJPZXIK-KOLCDFICSA-N	238.291	1.308	10	20	BDCD	
C[C@@]1(C(=O)NCCc2ccc(N)cc2)CCOC1	687370432	ZQNAJMNRROXSGI-CQSZACIVSA-N	248.326	1.354	10	20	BDCD	
Oc1ccccc1CN[C@@H]1C[C@H]2CC[C@@H]1O2	87689765	LMGIFYVRRWQZES-WZRBSPASSA-N	219.284	1.802	10	20	BDCD	
Cc1ccc(O)c(CNS(=O)(=O)C2CC2)c1	1348156403	FWJSOQZTTQNJLX-UHFFFAOYSA-N	241.312	1.282	10	20	BDCD	
C[C@@H]1CNCCN1Cc1ccc(N(C)C)cc1	107091911	XOEMATUJMZRSBG-GFCCVEGCSA-N	233.359	1.546	10	20	BDCD	
c1cc2c(cc1CNCc1csnn1)CCO2	398266937	XTTBLAHFJSGXSQ-UHFFFAOYSA-N	247.323	1.763	10	20	BDCD	
C[C@H](CO)N[C@H](C)c1cc(F)cc(F)c1O	134914128	IXANYTFAWCRUIM-RNFRBKRXSA-N	231.242	1.702	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@](C)(O)C2)cc1C	180189386	CODGJUKULRVKEF-CQSZACIVSA-N	235.327	1.966	10	20	BDCD	
C[S@](=O)CCCNCc1cc(F)ccc1O	226610844	QENBEQZXFQCHPN-INIZCTEOSA-N	245.319	1.390	10	20	BDCD	
CCC[C@H](NCc1ccc2c(c1)CCO2)C(=O)O	86733671	TVKVWIOFVSEZQC-LBPRGKRZSA-N	249.310	1.964	10	20	BDCD	
C[C@H](O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O	273427508	UPVQRPWTOYJBDI-JGVFFNPUSA-N	240.259	1.332	10	20	BDCD	
Nc1ccc(CN2C[C@H]3COC[C@H]3C2)cc1	718161738	MDBVSCFAHUSVDT-TXEJJXNPSA-N	218.300	1.347	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1CC=CCC1	828012434	PAJXUFAIWAMGHG-UHFFFAOYSA-N	237.230	1.639	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CC[C@@H](CN)C1	843048427	SZCAGGJMVUEUPG-ZDUSSCGKSA-N	247.386	1.842	10	20	BDCD	
C[C@@H](CN)NCc1c(O)cccc1Cl	841062721	BNMJYAIMILLHNQ-ZETCQYMHSA-N	214.696	1.482	10	20	BDCD	
C[C@H](O)CN(C(=O)c1cc(O)cs1)C1CC1	848391599	BFOVGBGTMGELEZ-ZETCQYMHSA-N	241.312	1.439	10	20	BDCD	
CS[C@H](C)CNC(=O)c1cc(O)cs1	752632558	VRCLVLOPJSTQRV-ZCFIWIBFSA-N	231.342	1.935	10	20	BDCD	
C[C@@H]1COC[C@@H]1NCc1cc(F)ccc1O	699745844	UQIKLMXBKNDMST-KCJUWKMLSA-N	225.263	1.656	10	20	BDCD	
COc1cccc(O)c1CN1CC[C@@H](CO)C1	769246244	YGKPVIDPQMTBMF-SNVBAGLBSA-N	237.299	1.215	10	20	BDCD	
CC(C)C[C@@H](O)CNC(=O)c1cc(O)cs1	771051109	TWNMJGBFIXTVIA-MRVPVSSYSA-N	243.328	1.591	10	20	BDCD	
CC(F)(F)C(=O)NCCc1ccc(N)cc1	393236941	LTCLNHZTRCTEGM-UHFFFAOYSA-N	228.242	1.583	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NCc1cc(F)ccc1O	694336425	WJTGABNQLKQJHJ-NEPJUHHUSA-N	225.263	1.798	10	20	BDCD	
O=C(O)c1ccc(CNCc2ccccc2O)[nH]1	1610828167	DPMYXADZEZSTAO-UHFFFAOYSA-N	246.266	1.708	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCNC(=O)CC2)cc1	1580445718	RFIKSSJCFYPSBK-LBPRGKRZSA-N	233.315	1.027	10	20	BDCD	
CC(C)(NCc1ccccc1O)C(=O)O	136207726	NQHRLNPHUUMUPZ-UHFFFAOYSA-N	209.245	1.345	10	20	BDCD	
CC(C)OCC(=O)NCc1ccc(O)cc1O	910953399	ALKAJWJFGCSZTC-UHFFFAOYSA-N	239.271	1.139	10	20	BDCD	
CN(C[C@@H](O)C1CC1)C(=O)c1cc(O)cs1	760805993	VYTVRYGLKKVZNH-SECBINFHSA-N	241.312	1.297	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H](O)C2CC2)c1	862755381	GGKVOYQCJLIBGF-GFCCVEGCSA-N	235.283	1.088	10	20	BDCD	
C[C@@H](NC(=O)CC1(CN)CC1)c1ccccc1O	870988497	QTNHRFIKNFBICQ-SNVBAGLBSA-N	248.326	1.698	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)Cn1cnnc1	776756300	NTKXIXJRDSUDIL-UHFFFAOYSA-N	245.330	1.434	10	20	BDCD	
COC[C@@H]1CN(C(=O)CN=[N+]=[N-])C[C@@H]1C	409434042	NYFJDOPLAUFQQR-YUMQZZPRSA-N	212.253	1.038	10	20	BDCD	
N[C@H]1C[C@H](NCc2ccc(N3CCCC3)cc2)C1	1334823399	OYAWGCPRGFBJEW-HDJSIYSDSA-N	245.370	1.866	10	20	BDCD	
COc1ccc(N(C)CCN(C)CCO)cc1	844401736	PDFCMKPQDPGEJS-UHFFFAOYSA-N	238.331	1.056	10	20	BDCD	
Cc1ccc(O)c(CN2CCN[C@H](C)[C@@H]2C)c1	379473030	UKARXLNTWNJFGE-NEPJUHHUSA-N	234.343	1.883	10	20	BDCD	
Cc1cccc(O)c1CN1CCOCC1	876509416	FTGQFQVKPFAWPL-UHFFFAOYSA-N	207.273	1.533	10	20	BDCD	
CC[C@@H](COC)NC(=O)c1cccc(O)c1O	126436732	QENOEEKGMGRMRK-QMMMGPOBSA-N	239.271	1.253	10	20	BDCD	
CC(C)[C@@H](O)CNCc1ccccc1O	123922727	VSPGAJVZUBTMOC-LBPRGKRZSA-N	209.289	1.499	10	20	BDCD	
CNC(=O)[C@H]1CCCCN1Cc1ccccc1O	133042699	BBMNPYSGKVEWLD-GFCCVEGCSA-N	248.326	1.493	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)C[C@@H](C)N	829764537	OFCUCJHXMLCCKJ-LLVKDONJSA-N	249.358	1.415	10	20	BDCD	
C[C@@H]1OCC[C@@H]1C(=O)N[C@H](C)c1ccccc1O	827940335	AWBVTEWEMKHXSR-SCVCMEIPSA-N	249.310	1.994	10	20	BDCD	
Cc1nnc(CNC(=O)c2cc(O)cs2)o1	732273145	YKXRJARBBYSYKN-UHFFFAOYSA-N	239.256	1.075	10	20	BDCD	
Cc1cccc(CNCC2(N)CC2)c1O	904449916	NAFYNTVWIPYRHZ-UHFFFAOYSA-N	206.289	1.282	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCN[C@H](C)C1	840908963	ZLNGSKWBLIMDJK-CYBMUJFWSA-N	247.386	1.855	10	20	BDCD	
CC1(C)CCN1C(=O)C(=O)Nc1ccc(N)cc1	841108316	UXWHRUVEPFZFCD-UHFFFAOYSA-N	247.298	1.218	10	20	BDCD	
CCNC(=N)NCc1ccc(OC)cc1O	849025017	JUOSLGWPWJQLQS-UHFFFAOYSA-N	223.276	1.035	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H](C)CO	840930585	LYXJFGLDOBQEJE-LLVKDONJSA-N	222.332	1.531	10	20	BDCD	
COc1cccc(CNCc2cc(C)no2)c1O	44985741	IPIQJWHMBWXHEF-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)C(=O)CO	270842475	VYLUSHHOLWKVFV-UHFFFAOYSA-N	236.315	1.093	10	20	BDCD	
CCOC(=O)[C@@H](C)N(C)Cc1ccccc1O	109770183	ZHJHTPVUDZPAOE-SNVBAGLBSA-N	237.299	1.776	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1C[C@]12CCOC2	764251179	QBEHQKIRUCHMGI-FZMZJTMJSA-N	247.294	1.435	10	20	BDCD	
NC[C@H]1CC[C@@H](NCc2ccc(N)cc2)C1	1335288131	DNZDXVMAVLVUEB-WCQYABFASA-N	219.332	1.486	10	20	BDCD	
CNC(=O)C[C@@H](C)N[C@H]1CCc2cccc(O)c21	322803382	RBGVDAMXOJVPJO-KOLCDFICSA-N	248.326	1.494	10	20	BDCD	
CNC(=O)C[C@H](C)NCc1ccc2c(c1)CCO2	322833327	ZYQFLTSOYSFXMI-JTQLQIEISA-N	248.326	1.236	10	20	BDCD	
CC(C)C1(O)CN(C(=O)Nc2ccc(N)cc2)C1	384043128	KJOSBQNHGPZFTA-UHFFFAOYSA-N	249.314	1.503	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)N1CCC1	115854066	GKLKZMLPNZKQIN-UHFFFAOYSA-N	247.342	1.976	10	20	BDCD	
CC1(C)C[C@@H]1C(=O)NCCc1ccc(O)c(O)c1	122445727	AUVLOXOXSYQXQH-SNVBAGLBSA-N	249.310	1.803	10	20	BDCD	
C[C@]1(O)CCCN(Cc2cc(F)ccc2O)C1	180185811	PLQIKNHCYYPJTE-ZDUSSCGKSA-N	239.290	1.878	10	20	BDCD	
CCN1CCc2cc([C@H](N)CO)ccc21	72198026	HAVQZUGUHLDTBY-LLVKDONJSA-N	206.289	1.061	10	20	BDCD	
COc1ccc(N(C)CC[C@H](C)O)cc1	49971348	UOQWLEXUKVFLBC-JTQLQIEISA-N	209.289	1.902	10	20	BDCD	
C[C@H](N[C@@H](C)c1ccccc1O)C(=O)O	49353265	APSSINNZPFUMQH-YUMQZZPRSA-N	209.245	1.516	10	20	BDCD	
COCC[C@H](C)NC(=O)Cc1ccc(N)cc1	81704190	GZPSTYIUYAGJLW-JTQLQIEISA-N	236.315	1.353	10	20	BDCD	
CC[C@@H](NC/C=C\CO)c1ccccc1O	717533783	ZNXRWDODVZPDFP-FOQNGQEVSA-N	221.300	1.981	10	20	BDCD	
C[C@@H](Cn1cccn1)NCCc1ccc(N)cc1	841033845	BXOBHBASLRUZHH-LBPRGKRZSA-N	244.342	1.686	10	20	BDCD	
CCOc1ccc(O)c(CNC/C=C\CO)c1	850357526	MNURYDNZCLSPTH-ARJAWSKDSA-N	237.299	1.429	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@@H](C(=O)O)C2)cc1	874047280	NRKRWDHOQKLCFP-TXEJJXNPSA-N	248.326	1.705	10	20	BDCD	
Cc1cccc(CN2C[C@@H](O)C[C@H]2C)c1O	788266743	BIEMVSZAHQVWEI-PWSUYJOCSA-N	221.300	1.656	10	20	BDCD	
C[C@H]1COCCN(Cc2ccc(N)cc2)C1	399068806	GBUQUNMTAYEWQA-LLVKDONJSA-N	220.316	1.737	10	20	BDCD	
Nc1ccc(CN2C[C@H]3[C@H](N)CCC[C@H]3C2)cc1	1337833997	JOIHHEALCWOPMG-NWANDNLSSA-N	245.370	1.828	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1CCCCN1)CCO2	258800266	CWLLXBLVRKMGBU-CQSZACIVSA-N	246.354	1.853	10	20	BDCD	
Cc1ccc([C@@H](C)NC[C@H](C)O)c(O)c1	35601541	YPIMBHDITIXSNT-VHSXEESVSA-N	209.289	1.732	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)CC[C@@H]1N	832736869	FIQGNKIABHFZIO-GWCFXTLKSA-N	247.342	1.007	10	20	BDCD	
O[C@@H]1CC[C@H]1NCc1ccc2c(c1)CCO2	378741520	PIOHNTBBPWCBAW-VXGBXAGGSA-N	219.284	1.234	10	20	BDCD	
C[C@H](O)CN(C(=O)Nc1ccc(N)cc1)C1CC1	709493297	XBLYPGWYKVFNAZ-VIFPVBQESA-N	249.314	1.646	10	20	BDCD	
CCNCC(=O)N[C@H](C)c1ccccc1O	877256122	NTDJDVQPIQWOBP-SECBINFHSA-N	222.288	1.179	10	20	BDCD	
C[C@H](CCCCN)NCc1ccccc1O	309307489	DNRSQSJKBUVTDJ-LLVKDONJSA-N	222.332	1.999	10	20	BDCD	
CSCCNC(=O)Nc1ccc(N)cc1	69015597	YXLVIQFQVATEGJ-UHFFFAOYSA-N	225.317	1.753	10	20	BDCD	
Cc1ccc(O)c(CNC(C)(C)CCO)c1	127140685	ASRZNOJRJMGWDY-UHFFFAOYSA-N	223.316	1.951	10	20	BDCD	
Cc1cccc(CNC[C@@H]2COCCO2)c1O	124719244	NWYFNYOQBQJJML-GFCCVEGCSA-N	237.299	1.206	10	20	BDCD	
Cc1ccc(O)c(CNC2CCOCC2)c1	70955213	QCXDAUIGPCTWTD-UHFFFAOYSA-N	221.300	1.969	10	20	BDCD	
COC[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	81039798	FPNYQLYLUTUKNX-GFCCVEGCSA-N	248.326	1.306	10	20	BDCD	
CC[C@H]1CN(Cc2cc(C)ccc2O)C[C@@H]1O	271407551	WZSGUNHIKIWNIY-FZMZJTMJSA-N	235.327	1.903	10	20	BDCD	
Cc1cc(CN2CC[C@H](O)C2)ccc1N(C)C	815037894	YSYPBJQPPHRDFR-ZDUSSCGKSA-N	234.343	1.628	10	20	BDCD	
C[C@@H](CCO)CCNC(=O)c1cc(O)cs1	833221149	DRHXKIJRXFXEOT-MRVPVSSYSA-N	243.328	1.592	10	20	BDCD	
CNCCNCc1cc(C)c(C)cc1O	841037320	YJJALRUMJRSOLK-UHFFFAOYSA-N	208.305	1.318	10	20	BDCD	
CC[C@H]1CN(C(=O)c2cc(O)cs2)C[C@@H]1O	760978882	CRLMGALHHGWRGG-CBAPKCEASA-N	241.312	1.297	10	20	BDCD	
CC(=O)[C@@H](C)OC(=O)c1cccc(O)c1O	776281737	JNWZNPKRQIULRN-SSDOTTSWSA-N	224.212	1.232	10	20	BDCD	
Nc1ccc(NC(=O)CCNCC2CC2)cc1	870932473	GDZWAJRAJCHWTI-UHFFFAOYSA-N	233.315	1.597	10	20	BDCD	
C[C@@H](NCCN1CCC1)c1c(O)cccc1F	886555363	QQONVHWXBYDXBZ-SNVBAGLBSA-N	238.306	1.888	10	20	BDCD	
CN(CC(=O)O)Cc1c(O)ccc(Cl)c1F	1593721254	BAPWUGADYADPFM-UHFFFAOYSA-N	247.653	1.701	10	20	BDCD	
NC1(CNCc2ccc3c(c2)CCO3)CC1	259000459	FEJUYUOBJSXXFM-UHFFFAOYSA-N	218.300	1.202	10	20	BDCD	
Cc1cccc(CNCc2cncn2C)c1O	291453303	CQKDBQGZIDVPIF-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CC[C@H](C(N)=O)C2)c1	825279035	LRRWIQFTDKJAAG-CMPLNLGQSA-N	248.326	1.444	10	20	BDCD	
COc1nc(C(=O)NCc2ccc(N)cc2)co1	1579321318	HHQIAVMTVVTLQZ-UHFFFAOYSA-N	247.254	1.195	10	20	BDCD	
OC[C@@H]1CCCN(Cc2cc(F)ccc2O)C1	183244129	CGXZDIJNOKCLCH-SNVBAGLBSA-N	239.290	1.736	10	20	BDCD	
Cc1ccc(O)c(CN2CCN[C@@H](C)C2)c1	83814061	JFWZSKPYFWRNAJ-NSHDSACASA-N	220.316	1.494	10	20	BDCD	
CC[C@H](O)CN[C@H](C)c1ccc(F)cc1O	229964464	FMWBNHUDXHVKFK-SCZZXKLOSA-N	227.279	1.953	10	20	BDCD	
C[C@](O)(CNCc1ccc2c(c1)CCO2)C1CC1	386593133	DXFUHTJGURBGIX-HNNXBMFYSA-N	247.338	1.872	10	20	BDCD	
CN(C)c1ccc(OCC2OCCO2)cc1	289475523	XKHZRKTWALVXGH-UHFFFAOYSA-N	223.272	1.504	10	20	BDCD	
C[C@H](N[C@@H]1CCNC1)c1ccccc1O	817944564	GZWQSMVUSHXFHV-VHSXEESVSA-N	206.289	1.405	10	20	BDCD	
Cc1ccc(CN[C@@H](C)C[S@](C)=O)c(O)c1	877311336	VUJHZZQRXFOGIF-QFYYESIMSA-N	241.356	1.557	10	20	BDCD	
C[C@H]1NCC[C@H]1C(=O)N(C)c1ccc(N)cc1	877077502	KXFKDULTSBYITR-BXKDBHETSA-N	233.315	1.230	10	20	BDCD	
CN(Cc1cnc[nH]1)c1ccc2c(c1)OCO2	776102164	MWNLZIKTOGUCMP-UHFFFAOYSA-N	231.255	1.775	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2C[C@@H]2F)c1	1123941178	WRSYRKRLVBNGEU-UWVGGRQHSA-N	223.247	1.675	10	20	BDCD	
C[C@H]1C[C@@H](NC(=O)NCc2ccc(N)cc2)CO1	1335602860	GOZYLOKPQURLSB-JOYOIKCWSA-N	249.314	1.245	10	20	BDCD	
NC[C@@H]1CCCC[C@@H]1NCc1ccc(N)cc1	1352788134	DBEWNIAXPIFPQA-JSGCOSHPSA-N	233.359	1.876	10	20	BDCD	
COc1ccc(O)c(CNC(=O)[C@H](C)OC)c1	114541975	VEFUXKJDCPOMTF-QMMMGPOBSA-N	239.271	1.052	10	20	BDCD	
Cc1cccc(CN2CCNC(=O)C2(C)C)c1O	180050822	CSPONZYIOGSALT-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
Oc1ccccc1CNC[C@@H](O)C(F)(F)F	136401523	OWMKUCAMPTXCLI-SECBINFHSA-N	235.205	1.405	10	20	BDCD	
C[C@@H](CO)N[C@H](C)c1cc(F)ccc1O	87111365	KYKZMGFKYQAOSP-JGVFFNPUSA-N	213.252	1.563	10	20	BDCD	
Nc1ccc(NC(=O)N[C@H]2CCSC2)cc1	231356541	GSJJVPUXDQVGGK-JTQLQIEISA-N	237.328	1.896	10	20	BDCD	
Nc1ccc(CN2CCCN3CCC[C@H]3C2)cc1	250014930	YFFJMQXOWJOMAZ-HNNXBMFYSA-N	245.370	1.939	10	20	BDCD	
Cc1ccc(O)c(CN2CC(=O)N(C3CC3)C2)c1	279090457	AEVQRCJMQWLCCZ-UHFFFAOYSA-N	246.310	1.465	10	20	BDCD	
CCCCCC(=O)OCC(=O)C(C)=O	808487499	NDKFYYAXXCONNV-UHFFFAOYSA-N	200.234	1.268	10	20	BDCD	
OC/C=C\CNCc1cc(Cl)cc(F)c1O	826937653	REPYYPGUEMUBTE-UPHRSURJSA-N	245.681	1.823	10	20	BDCD	
CC1(C)C[C@@H]1C(=O)NCc1ccc(O)cc1O	910949333	JKSCLGGOTWQLFC-SNVBAGLBSA-N	235.283	1.760	10	20	BDCD	
CN(C)c1ccc([C@H](N)CNCC2CC2)cc1	841042077	HKJLFBXWGXPBIJ-CQSZACIVSA-N	233.359	1.752	10	20	BDCD	
CNC[C@H](C)NCc1cc(C)ccc1O	853248807	KFTWFVRKFDDYTF-JTQLQIEISA-N	208.305	1.398	10	20	BDCD	
Cc1ccc(CN2CC[C@H](CC(N)=O)C2)c(O)c1	877535515	PEVQBNRFOAXRDH-LLVKDONJSA-N	248.326	1.398	10	20	BDCD	
CC(C)[C@@H](C(=O)N(C)c1ccc(N)cc1)N(C)C	877077475	JOYQZAIWTPUCQY-ZDUSSCGKSA-N	249.358	1.818	10	20	BDCD	
Cc1cnc(NC(=O)c2cc(O)cs2)[nH]1	771037333	MYOOWSZPDHUJCN-UHFFFAOYSA-N	223.257	1.738	10	20	BDCD	
Cc1cccc(CN2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)c1O	1610521999	KJYCFBPZZYZGRB-GDNZZTSVSA-N	247.294	1.463	10	20	BDCD	
C[C@@H](CNCc1ccc2c(c1)CCO2)CC(=O)O	258853660	JEIZFMPHOGUGAF-SNVBAGLBSA-N	249.310	1.822	10	20	BDCD	
CNC(=O)C[C@H](C)N[C@H](C)c1ccccc1O	322758378	FTQANWNWKHFYRF-VHSXEESVSA-N	236.315	1.567	10	20	BDCD	
COc1cccc(O)c1CNC1CSC1	877635485	SWENENCVHIKCQE-UHFFFAOYSA-N	225.313	1.606	10	20	BDCD	
COc1ccc(CN[C@@H](C)CC(N)=O)cc1C	135729665	YVYUFTCSVKNZGX-JTQLQIEISA-N	236.315	1.357	10	20	BDCD	
C[C@@H](N[C@@H]1CC[C@H]1O)c1cc(F)ccc1O	378722357	GWJJWRNSQHWAPX-NYRNMGCKSA-N	225.263	1.705	10	20	BDCD	
O=C(O)c1cnc(S[C@@H]2CCOC2)s1	703097378	MLXAEGOQMDWFCR-RXMQYKEDSA-N	231.298	1.722	10	20	BDCD	
C[C@@H](O)CN(C)Cc1c(O)cccc1Cl	291119791	UTUQNQQEQUKVDO-MRVPVSSYSA-N	229.707	1.858	10	20	BDCD	
C[C@H](N)C[C@@H](C)NCc1ccc2c(c1)CCO2	817902096	HZLRPDIFJKBNBF-WDEREUQCSA-N	234.343	1.837	10	20	BDCD	
CC[C@H](C)C(=O)NCc1ccc(O)cc1O	910952521	WOOLXIGTVVYWTE-QMMMGPOBSA-N	223.272	1.760	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCO[C@@H]2C)c1	862757867	GXVFXQLDVFRQQG-PWSUYJOCSA-N	249.310	1.742	10	20	BDCD	
CN(C(=O)CC[C@H]1CCNC1)c1ccc(N)cc1	877077941	WVFYBMDLYARNKZ-NSHDSACASA-N	247.342	1.621	10	20	BDCD	
C[C@@H](NC[C@@H](C)N(C)C)c1ccccc1O	38088823	MDKUBGOFDWNOJN-GHMZBOCLSA-N	222.332	1.993	10	20	BDCD	
CCc1cccc(CN[C@@H](C)CC(N)=O)c1O	691493319	JIBJZJSDJGUQKR-VIFPVBQESA-N	236.315	1.308	10	20	BDCD	
CCn1ncnc1CN[C@@H](C)c1ccccc1O	785773580	DYLPEUDWCJIMEV-JTQLQIEISA-N	246.314	1.854	10	20	BDCD	
O=C(O)C1=NO[C@H](CSc2nccs2)C1	1601739869	MLQBGQUQQPJWAH-YFKPBYRVSA-N	244.297	1.465	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N)cc2)[C@H](C)CO1	35782509	VEUCBBYBKGZDDZ-MNOVXSKESA-N	220.316	1.878	10	20	BDCD	
Oc1ccccc1CNC[C@@H]1CCCNC1	162935668	AEQWHIYBHPQMED-LLVKDONJSA-N	220.316	1.481	10	20	BDCD	
COC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1	37187438	AFNIVUYGRCSSMY-JTQLQIEISA-N	236.315	1.576	10	20	BDCD	
CC[C@H](N[C@@H](C)CO)c1ccc(F)cc1O	285960516	GPDUZKMPVIDDQG-KWQFWETISA-N	227.279	1.953	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)C(=O)NC	48644807	GVNKMVNFASOAFQ-UHFFFAOYSA-N	235.331	1.914	10	20	BDCD	
CN(C)c1ccc(CNC(=O)c2cn[nH]c2)cc1	40438235	HWXHFFULNHIULV-UHFFFAOYSA-N	244.298	1.406	10	20	BDCD	
CC[C@@H](C)N(OC)C(=O)c1cccc(O)c1O	279828567	MYCMFVWNMYZUNW-MRVPVSSYSA-N	239.271	1.900	10	20	BDCD	
COC(=O)[C@H]1C[C@H](NCc2cccc(C)c2O)C1	827812914	ZERWDJJXOSCJLH-HAQNSBGRSA-N	249.310	1.742	10	20	BDCD	
CC[C@H](CO)N(C)C(=O)c1cc(O)cs1	833337023	MBHTXRYJTCTLCE-SSDOTTSWSA-N	229.301	1.297	10	20	BDCD	
Nc1ccc(NC(=O)CNCC2CC2)cc1	832244423	RNIOVJOWXXSVSL-UHFFFAOYSA-N	219.288	1.207	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)CCO	840907725	HMYXAQZJIBLIJE-UHFFFAOYSA-N	222.332	1.485	10	20	BDCD	
Cc1cccc(CN2CC[C@H](N)[C@H](C)C2)c1O	843053099	YMDUMSBVQDQNOW-YPMHNXCESA-N	234.343	1.870	10	20	BDCD	
Cn1nnnc1CSc1ncc(Cl)s1	849999107	NYSBCPGNISBCNQ-UHFFFAOYSA-N	247.736	1.612	10	20	BDCD	
CC(=O)C(=O)Cn1c(=O)sc2c(C)cccc21	842588142	RGGCAMNSLULRHG-UHFFFAOYSA-N	249.291	1.530	10	20	BDCD	
C[C@@H](CO)NCc1cc(F)cc(F)c1O	708389559	LTAFLWBOIUDUQJ-LURJTMIESA-N	217.215	1.141	10	20	BDCD	
NC1(CNCc2ccc(N3CCCC3)cc2)CC1	1334754593	PHSKKEKDIBOROC-UHFFFAOYSA-N	245.370	1.868	10	20	BDCD	
CC1(CSc2ncc(C(=O)O)s2)COC1	1594040252	YTXUCMRHRZSBRK-UHFFFAOYSA-N	245.325	1.970	10	20	BDCD	
CNC[C@H](C)C(=O)Nc1ccc(N)cc1	237065351	HGXHNVBVPAWQRC-QMMMGPOBSA-N	207.277	1.063	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CCC[C@H](F)C1	689835994	JQBIMXBBPYDVIQ-QMMMGPOBSA-N	239.246	1.672	10	20	BDCD	
COc1ccc(O)c(CN[C@H]2CCO[C@@H]2C)c1	134236741	MKZPQFMIXJHXTD-SKDRFNHKSA-N	237.299	1.668	10	20	BDCD	
C[C@@H](CCO)CNCc1cc(F)ccc1O	226612573	KNSLVBRWMDSYDU-VIFPVBQESA-N	227.279	1.639	10	20	BDCD	
OC/C=C/CNCc1cc(Cl)cc(F)c1O	826937652	REPYYPGUEMUBTE-OWOJBTEDSA-N	245.681	1.823	10	20	BDCD	
CNCCCNCc1ccc(N(C)C)c(F)c1	841041414	FNWJEKBKUXPDDO-UHFFFAOYSA-N	239.338	1.591	10	20	BDCD	
Cc1ccc(O)c(CNC2(C)CCNCC2)c1	841065043	LLEYUCWYANGYAM-UHFFFAOYSA-N	234.343	1.932	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H](N)C2)cc1F	843047230	OWYCOWJILIBLTD-NSHDSACASA-N	237.322	1.425	10	20	BDCD	
CC[C@@](C)(O)c1cn(-c2ccc(N)cc2)nn1	849134942	XRMFFURZQQFIAQ-GFCCVEGCSA-N	232.287	1.467	10	20	BDCD	
CNC[C@@H](C)NCc1cc(Cl)cc(F)c1O	853248925	LWPLZPMVZQXKGJ-SSDOTTSWSA-N	246.713	1.882	10	20	BDCD	
C[C@H]1COC[C@H]1NCc1cc(F)ccc1O	699745842	UQIKLMXBKNDMST-GZMMTYOYSA-N	225.263	1.656	10	20	BDCD	
Cc1ccc(CN2C[C@@H]3C[C@@]3(CO)C2)c(O)c1	877461715	JLJXSVJWXOLFLU-JSGCOSHPSA-N	233.311	1.515	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1CC(=O)N(C)C1	876994749	MHTRMQQKCJGADV-JTQLQIEISA-N	234.299	1.021	10	20	BDCD	
CCN[C@H](C)C(=O)Nc1ccc(N)cc1	876504809	XNIXBRUUESVWGB-MRVPVSSYSA-N	207.277	1.205	10	20	BDCD	
CCN(CC)c1ccc(CN(C)CCO)cc1	77253399	YNXBWWFVZOLSFW-UHFFFAOYSA-N	236.359	1.957	10	20	BDCD	
COC[C@H](C)NCc1cc(F)cc(F)c1O	708435955	HCLKVYQSAYWRNR-ZETCQYMHSA-N	231.242	1.795	10	20	BDCD	
CCC[C@H](O)CNC(=O)Nc1ccc(N)cc1	841299366	BECPLVGSUYXYNU-NSHDSACASA-N	237.303	1.551	10	20	BDCD	
COc1ccc(N(C)Cc2ncnn2C)cc1	844353428	WRQOQADXBNUXTR-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
CN(C)c1ccc(CNCCCCO)cc1	6319897	OYBNPTKMYNSGMF-UHFFFAOYSA-N	222.332	1.615	10	20	BDCD	
O=C(C[C@H]1CCCO1)NCc1ccccc1O	133755998	KTPCZMLTFACNRW-LLVKDONJSA-N	235.283	1.578	10	20	BDCD	
CC[C@H](CO)N(C)Cc1cc(C)ccc1O	295074396	HSBJFKIFYCWBOK-GFCCVEGCSA-N	223.316	1.903	10	20	BDCD	
CN(C)c1ccc(OCc2cnn(C)n2)cc1	810001310	AVHSFLGABFNHBJ-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
C[C@H]1CCNC[C@H]1NCCc1ccc(N)cc1	817957622	NGHUBLSRBYLLIF-SMDDNHRTSA-N	233.359	1.399	10	20	BDCD	
Cc1ccc([C@@H](C)NC[C@H](C)CN)c(O)c1	817962047	HFEPSGURSZGYAX-GHMZBOCLSA-N	222.332	1.946	10	20	BDCD	
CCOc1cccc(CN[C@H]2[C@@H]3CNC[C@@H]32)c1O	841077123	AEMOYXWWBCJWCY-PJXYFTJBSA-N	248.326	1.098	10	20	BDCD	
OC[C@H](CCF)N[C@@H]1CCc2cccc(O)c21	846210321	XZNCRZMAPNEVPG-WDEREUQCSA-N	239.290	1.690	10	20	BDCD	
Oc1ccc(F)cc1CN[C@H]1CCCNCC1	841058836	VZASWFWOYSACMV-LBPRGKRZSA-N	238.306	1.763	10	20	BDCD	
CCN(CCN)Cc1cccc(Cl)c1O	863644362	SVDQKIPTOGSZJA-UHFFFAOYSA-N	228.723	1.826	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H](O)C1CCC1	877574921	ZMKGKVRGRQRHDM-CQSZACIVSA-N	235.327	1.951	10	20	BDCD	
CC[C@H](OC)C(=O)NCc1ccc(N)cc1	297355880	ZOMIPMCTGYDWBK-NSHDSACASA-N	222.288	1.310	10	20	BDCD	
Oc1ccccc1CN1CCC2(CC1)OCCO2	179556013	JVLOWZXCXMJLSC-UHFFFAOYSA-N	249.310	1.731	10	20	BDCD	
C[C@H]1CCN(Cc2cc3c(cc2O)OCO3)C1	112011583	WFGYCGFUFQWLMT-VIFPVBQESA-N	235.283	1.963	10	20	BDCD	
COc1ccc(O)c(CNCCC[C@H](C)O)c1	228090749	BDHDCAUFMNLPMM-JTQLQIEISA-N	239.315	1.651	10	20	BDCD	
C[C@@H](NCc1ccccc1O)c1cnn(C)c1	135192527	YKXHMFXHNJGHDZ-SNVBAGLBSA-N	231.299	1.977	10	20	BDCD	
C[C@@H](N[C@@H]1CCNC1)c1ccccc1O	817944562	GZWQSMVUSHXFHV-NXEZZACHSA-N	206.289	1.405	10	20	BDCD	
COc1cccc(CNC[C@@H]2CCCN2)c1O	841035151	IGIFXMBYPZWZQH-NSHDSACASA-N	236.315	1.242	10	20	BDCD	
CN1CCN=C1NCc1cc(Cl)ccc1O	849050331	ZRBDSAKMOPQINT-UHFFFAOYSA-N	239.706	1.437	10	20	BDCD	
CN(Cc1cccc(F)c1O)[C@@H]1CCNC1	843048955	BRFZVVXYRGPXDE-SNVBAGLBSA-N	224.279	1.325	10	20	BDCD	
C[C@H](N)[C@@H]1CCCN(Cc2ccccc2O)C1	70171411	GAFVFCMGSBPYQS-NWDGAFQWSA-N	234.343	1.951	10	20	BDCD	
CC[C@H](NCc1ccccc1O)C(=O)NC	697888983	KBAVPDUXTCIQJO-JTQLQIEISA-N	222.288	1.006	10	20	BDCD	
CCC[C@H]1CN(CCN=[N+]=[N-])CC[C@@H]1O	409436167	YLGIUOBHGZQVTH-UWVGGRQHSA-N	212.297	1.780	10	20	BDCD	
CC(=O)CSc1ncc(C(=O)O)s1	1589041155	DHWREPNABLQXKX-UHFFFAOYSA-N	217.271	1.522	10	20	BDCD	
CN[C@H]1CCN(Cc2c(O)cccc2Cl)C1	150075490	PKILYXKCDGUNCD-VIFPVBQESA-N	240.734	1.839	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)C1CCC1	159109094	ZYTOUMVMTYWBGK-UHFFFAOYSA-N	221.256	1.514	10	20	BDCD	
C[C@H]1[C@@H](C)OCCN1C(=O)Cc1ccc(N)cc1	125312344	FYBNZDQISKLHNY-WDEREUQCSA-N	248.326	1.447	10	20	BDCD	
CC(C)[C@@H](CO)CNCc1ccccc1O	309643547	VGMLXKHNYMDCBV-GFCCVEGCSA-N	223.316	1.746	10	20	BDCD	
Oc1ccc(F)cc1CN1CC[C@@H]2CNC[C@@H]21	385390623	SJIDDIDFMPYCIO-SKDRFNHKSA-N	236.290	1.325	10	20	BDCD	
COc1cccc(CNCCn2cccn2)c1O	42538756	FAQMWEZWFMEISF-UHFFFAOYSA-N	247.298	1.387	10	20	BDCD	
CN(C)C(C)(C)CNCc1cc(F)ccc1O	226582296	ITNXTSSWSXVFAL-UHFFFAOYSA-N	240.322	1.961	10	20	BDCD	
CN(C)CCCNCc1cc(F)ccc1O	83354765	XVQFOPHOHPFFMX-UHFFFAOYSA-N	226.295	1.573	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC[C@H](C)N)c1	817972705	NVQDJRBLEZNTMH-UWVGGRQHSA-N	208.305	1.698	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1C[C@]12CCNC2	828015577	JCKLQKFNEFOWKB-RISCZKNCSA-N	246.310	1.008	10	20	BDCD	
CN(C[C@H]1CCC(=O)O1)c1ccc2c(c1)OCO2	821396038	FQFMDOMISKTXIW-SNVBAGLBSA-N	249.266	1.557	10	20	BDCD	
C[C@@H]1C[C@@]1(C(=O)O)C(=O)NCc1ccccc1O	901608855	MBGPDYFAAYDXLJ-OQPBUACISA-N	249.266	1.119	10	20	BDCD	
CN(Cc1cccc(Cl)c1O)[C@@H]1CCNC1	843049327	KLTQLDXBGFFFEQ-SNVBAGLBSA-N	240.734	1.839	10	20	BDCD	
Cn1ccc(CNC(=O)c2cc(O)cs2)c1	747943085	CHKCFZVRXKHURW-UHFFFAOYSA-N	236.296	1.722	10	20	BDCD	
COc1ccc(O)c(CNC[C@@H](C)CN)c1	841048326	HJXSOXWEKGXZCJ-VIFPVBQESA-N	224.304	1.085	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2CCCNCC2)cc1	846662823	YGKDUIITLMRWAM-JTQLQIEISA-N	233.315	1.597	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCc2cnon2)c1	851902826	SYZDKRXSIBSECR-MRVPVSSYSA-N	249.270	1.635	10	20	BDCD	
CC[C@H](NCc1ccc2c(c1)CCO2)C(=O)NC	697847688	BJKMAAUEQVJZQA-LBPRGKRZSA-N	248.326	1.236	10	20	BDCD	
CNC[C@H](C)CNCc1c(O)cccc1OC	1117953177	BVPVGQPXMPHNRD-JTQLQIEISA-N	238.331	1.346	10	20	BDCD	
C[C@H](NC(=O)c1cccc(O)c1O)c1ccc[nH]1	790911934	WAKXKKPMHUNWFM-QMMMGPOBSA-N	246.266	1.917	10	20	BDCD	
CC(C)NC(=O)N(C)Cc1ccccc1O	42839370	SEPODKWATWNVFF-UHFFFAOYSA-N	222.288	1.942	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H](C(F)(F)F)[C@@H](CO)C1	409426706	CUNXOWDRISEPJD-RNFRBKRXSA-N	238.213	1.399	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1C[C@H]2CCC(F)(F)[C@H]2C1	409426072	HLEPWQXJXGSQGM-RQJHMYQMSA-N	230.218	1.800	10	20	BDCD	
C[C@]1(C(=O)NCc2ccccc2O)CCOC1	687410019	MKEPSJFXKZBILM-ZDUSSCGKSA-N	235.283	1.435	10	20	BDCD	
CCc1cccc(CN[C@@H]2CC(=O)N(C)C2)c1O	691453177	MWZJKVLQZAWUPS-GFCCVEGCSA-N	248.326	1.275	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)C[C@@H](C)N1	19366942	LHONBGORYCTZFI-GHMZBOCLSA-N	220.316	1.574	10	20	BDCD	
Cc1c(CNCc2cc(F)ccc2O)cnn1C	226618454	DMBQABMZSJUCKQ-UHFFFAOYSA-N	249.289	1.863	10	20	BDCD	
C[C@H](N[C@@H]1C=C[C@H](CO)C1)c1ccccc1O	183573625	SEAVYQWVJGZPRR-SDDRHHMPSA-N	233.311	1.980	10	20	BDCD	
COc1ccc(CNCCOCCO)cc1C	35052714	NYEUBJXAUOKEGE-UHFFFAOYSA-N	239.315	1.102	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)[C@H](C)OC)c1	290941389	PXTOBBFHUTZBGK-ZJUUUORDSA-N	239.315	1.914	10	20	BDCD	
C[C@@H](CCO)N[C@H]1CCc2cccc(O)c21	297575990	GVUVOWXNRPCUOL-ONGXEEELSA-N	221.300	1.740	10	20	BDCD	
C[C@H](O)[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1	272522034	LLUSNCXLJKZVMF-JSGCOSHPSA-N	248.370	1.955	10	20	BDCD	
CC(C)CNC(=O)c1c(F)ccc(O)c1O	276505005	IKDHWLTUQNKJCE-UHFFFAOYSA-N	227.235	1.623	10	20	BDCD	
CC(C)[C@H](F)C(=O)NCc1ccc(O)cc1O	910947839	OSNOBPRNHWJUHZ-NSHDSACASA-N	241.262	1.708	10	20	BDCD	
CCc1cccc(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1O	848912256	CTWDIWACXGIERZ-WDNDVIMCSA-N	247.338	1.625	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2C[C@H]2N1	843390377	PCRPNGTVZQCFKF-UTUOFQBUSA-N	246.310	1.101	10	20	BDCD	
C[C@@H]1C[C@@H](NCc2cccc(F)c2O)CCN1	841061165	FRFTWNBXPGAIAV-KOLCDFICSA-N	238.306	1.761	10	20	BDCD	
C[C@@H](CCN)NCc1cc(Cl)ccc1O	841052049	UFVLYIXZSNREDL-QMMMGPOBSA-N	228.723	1.873	10	20	BDCD	
Cc1cc(O)c(CNC[C@H](N)C2CC2)cc1C	841049579	LRIZUUYOYLKBDS-ZDUSSCGKSA-N	234.343	1.836	10	20	BDCD	
Nc1ccc(CC(=O)N(C2CC2)C2CC2)cc1	877023617	YGEVAPIZBBLHPS-UHFFFAOYSA-N	230.311	1.965	10	20	BDCD	
Cc1ccc(CN2CC[C@H]([C@H](C)O)C2)c(O)c1	877183262	BECMAKMANVUXGM-RYUDHWBXSA-N	235.327	1.903	10	20	BDCD	
C[C@@H](CO)CNCc1c(O)cccc1Cl	83552155	RFRDYXZNKKLEBY-MRVPVSSYSA-N	229.707	1.764	10	20	BDCD	
CC(C)(C)C(=O)NCCc1ccc(N)cc1	32013775	MYDRWPVDLZNDSI-UHFFFAOYSA-N	220.316	1.974	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)CC[C@H]1N	832736870	FIQGNKIABHFZIO-GXFFZTMASA-N	247.342	1.007	10	20	BDCD	
CC(C)NC(=N)NCc1ccccc1O	309115328	QIYSPKPNUNSZFY-UHFFFAOYSA-N	207.277	1.415	10	20	BDCD	
O=C(NCc1cocn1)c1cccc(O)c1O	397962294	IKPNPWGSTZUPDM-UHFFFAOYSA-N	234.211	1.016	10	20	BDCD	
C[C@@H](NCc1cnn[nH]1)c1ccc(N(C)C)cc1	398339439	MHCPTCLRCJHTCD-SNVBAGLBSA-N	245.330	1.722	10	20	BDCD	
COc1cccc(CNC(=O)c2ccon2)c1O	105651059	PJWGNONCVXTCMN-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
CC[C@@H](CO)NCc1ccc(N(C)C)c(F)c1	113312236	UWXJAACQCFROAE-NSHDSACASA-N	240.322	1.752	10	20	BDCD	
C[C@H]1C[C@@H](CN)CN1Cc1ccc(N(C)C)cc1	216058784	JZIPFPQVEOOPHS-JSGCOSHPSA-N	247.386	1.922	10	20	BDCD	
O=C(NCc1ccccc1O)c1cc[nH]c(=O)c1	225801016	ZOGNPZNAZBWSRP-UHFFFAOYSA-N	244.250	1.011	10	20	BDCD	
CN(C)c1ccc(CN2CCCOCC2)cc1	372434146	WPTQBWNFBHEDBQ-UHFFFAOYSA-N	234.343	1.975	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C[C@H](O)C1CC1	809753149	ZUNXYDPLBQJDSY-ZDUSSCGKSA-N	239.290	1.734	10	20	BDCD	
CC[C@@H](NCc1cccc(OC)c1O)C(=O)O	818316707	FWWZCAIYLYXGEM-SECBINFHSA-N	239.271	1.354	10	20	BDCD	
COC(=O)c1cnc(SCC(C)=O)s1	829692310	JHDFTBWESCKAJI-UHFFFAOYSA-N	231.298	1.611	10	20	BDCD	
CCOCCN(CC)C(=O)c1cc(O)cs1	732289996	OGAXWMVKLLCBOY-UHFFFAOYSA-N	243.328	1.952	10	20	BDCD	
COc1cccc(O)c1CN[C@@H](C)CCCN	841079564	JUNMWPGKIISIRT-JTQLQIEISA-N	238.331	1.618	10	20	BDCD	
Cc1cccc(CNC[C@@H](N)C(C)C)c1O	841031020	QWKKRAHVTBSCSK-GFCCVEGCSA-N	222.332	1.774	10	20	BDCD	
CC(C)(CN)CC(=O)NCc1ccc(N)cc1	1122539442	MFZJWYVNKUSRFS-UHFFFAOYSA-N	235.331	1.260	10	20	BDCD	
COc1cccc(O)c1CNCc1cocn1	730819059	JNXGPPXMZTVKRU-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)[C@H](C)CN1	841849468	WHRDXWPTDQCMCG-GHMZBOCLSA-N	247.342	1.020	10	20	BDCD	
COc1cccc(O)c1CNC[C@H]1CCCO1	725841689	UXZFHNPANNSFDD-SNVBAGLBSA-N	237.299	1.669	10	20	BDCD	
COC[C@@H]1CCN(Cc2ccc(N)cc2)C1	81041436	VQGOEVMSFADMNQ-GFCCVEGCSA-N	220.316	1.737	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c1	817978156	XJKCRGBUGYGNOD-WUWHUORYSA-N	232.327	1.569	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC/C=C/CO	826940270	BCNRSOCYNMVCFS-SNAWJCMRSA-N	234.343	1.699	10	20	BDCD	
CCCC(=O)COC(=O)c1cc(O)cs1	738650149	MBFDFMLPUIEOSU-UHFFFAOYSA-N	228.269	1.980	10	20	BDCD	
CC(C)[C@H](N)CNCc1ccccc1O	841028437	FSFVBNFTKMMQAK-LLVKDONJSA-N	208.305	1.465	10	20	BDCD	
COc1cc(C)cc(CN2CC(OC)C2)c1O	754741643	MGFITZHJKFAOSP-UHFFFAOYSA-N	237.299	1.540	10	20	BDCD	
COC[C@@H](O)CN[C@H](C)c1ccccc1O	70589893	GCLLXKUDJSCVBT-ZJUUUORDSA-N	225.288	1.050	10	20	BDCD	
CCC[C@@](C)(N)C(=O)N(C)c1ccc(N)cc1	877079113	QZVDAPZKJUYKPU-CYBMUJFWSA-N	235.331	1.749	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](C)CCCO	877109243	DDQWYKCVDSTAIA-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1	38055884	JHMFYABGGPNZRG-NEPJUHHUSA-N	207.273	1.951	10	20	BDCD	
Cc1cccc(CN[C@H]2CCCN(C)C2=O)c1O	704379916	FZJAKFNDFBOYSN-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
Oc1ccccc1CNCc1ccon1	86452734	AQGMKYUIFXACBR-UHFFFAOYSA-N	204.229	1.670	10	20	BDCD	
CN(C(=O)C[C@@H]1COC(=O)C1)c1ccc(N)cc1	1332981742	OPJICDZNKUYTFH-VIFPVBQESA-N	248.282	1.185	10	20	BDCD	
CCNCCNCc1ccc2c(c1)CCO2	161317203	YJGCBQXFBAZFGO-UHFFFAOYSA-N	220.316	1.321	10	20	BDCD	
CC1CC(CNC(=O)Cc2ccc(N)cc2)C1	691048152	OHXMLARZRMVUJO-UHFFFAOYSA-N	232.327	1.974	10	20	BDCD	
C[C@@H]1COCCN(C(=O)Cc2ccc(N)cc2)C1	399095384	BWRFOFLOYWEKBT-NSHDSACASA-N	248.326	1.306	10	20	BDCD	
Cc1ccc([C@H](C)NCCCO)c(O)c1	20188565	SLDLGLJMPFMBTC-JTQLQIEISA-N	209.289	1.734	10	20	BDCD	
CCCN(CC(=O)N(C)C)Cc1ccc(N)cc1	35064518	XYOGRYBLYOMOJV-UHFFFAOYSA-N	249.358	1.569	10	20	BDCD	
CCN1CC(=O)N[C@H]1c1ccc2c(c1)CCN2C	189865186	GYCAGFXEMSUDIQ-CQSZACIVSA-N	245.326	1.129	10	20	BDCD	
C[C@@H](CCN)NCc1ccc(N(C)C)cc1	220487160	CWAGDRJHWMUWLU-NSHDSACASA-N	221.348	1.580	10	20	BDCD	
C[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	40716635	AELKDPDQQNFMMC-JTQLQIEISA-N	218.300	1.680	10	20	BDCD	
COC(=O)c1ccc(O)c([C@@H](C)NCCF)c1	280975899	ISVRMRVCRVVYRI-MRVPVSSYSA-N	241.262	1.799	10	20	BDCD	
CC(=O)C(=O)CSc1ccc([N+](=O)[O-])cn1	808026245	VHRVIEQYBNOTFN-UHFFFAOYSA-N	240.240	1.240	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@H]1CCCNC1)CC2	817945624	ICZSWODNQYKZKI-WCQYABFASA-N	246.354	1.969	10	20	BDCD	
NOCCCNCc1c(O)ccc(Cl)c1F	904458364	XMKWABHMJLSYMS-UHFFFAOYSA-N	248.685	1.555	10	20	BDCD	
CC(C)[C@H](OC(=O)c1cc(O)cs1)C(N)=O	732353828	ASLGYWFMNKMKDP-QMMMGPOBSA-N	243.284	1.120	10	20	BDCD	
CCOCCNC(=S)NCc1cccn1C	743061202	FSFMQUWQRATXKV-UHFFFAOYSA-N	241.360	1.026	10	20	BDCD	
NCC(F)(F)CNCc1cc(F)ccc1O	841059412	CEJPALPAYWWWDL-UHFFFAOYSA-N	234.221	1.215	10	20	BDCD	
C[C@H]1CCN(Cc2ccccc2O)C[C@H]1CO	857061318	OIGGLOUYIHGJDY-AAEUAGOBSA-N	235.327	1.843	10	20	BDCD	
CC(C)CC[C@@H](N)C(=O)N(C)c1ccc(N)cc1	877074760	RYSHBTGMJGXSGP-CYBMUJFWSA-N	249.358	1.995	10	20	BDCD	
COC[C@H](C)OC(=O)c1ccc(C)c(O)c1O	783344008	KPTGRXXIHJZMHM-QMMMGPOBSA-N	240.255	1.598	10	20	BDCD	
C[C@@H](NC(=O)C1CCNCC1)c1ccccc1O	870987724	BJXJBQZWNQWHAP-SNVBAGLBSA-N	248.326	1.569	10	20	BDCD	
CCc1cccc(CNCc2cn(C)cn2)c1O	898043520	SANHYFGTIBDHAC-UHFFFAOYSA-N	245.326	1.978	10	20	BDCD	
Nc1ccc(N2C[C@H]3CCC[C@@]3(CO)C2)cc1	409432343	LDJJQSPCVCVCAF-RISCZKNCSA-N	232.327	1.868	10	20	BDCD	
COc1ccc(N(C)CC[C@H](C)O)cc1OC	827491731	PISSYCLBHJSOEC-JTQLQIEISA-N	239.315	1.911	10	20	BDCD	
CC1(C)NCC[C@H]1NC(=O)Cc1ccc(N)cc1	841858081	YKXLSNMNQRSVEK-GFCCVEGCSA-N	247.342	1.068	10	20	BDCD	
OC[C@@H](NCc1c(O)cccc1Cl)C1CC1	309576828	PBPJVHPUGFDNKV-LLVKDONJSA-N	241.718	1.906	10	20	BDCD	
C[C@@H](O)[C@H]1CCCN(Cc2ccc(N)cc2)C1	688874718	GFDFBBNTYGUYBJ-YPMHNXCESA-N	234.343	1.862	10	20	BDCD	
COCCC(=O)N[C@H](C)c1ccccc1O	827930283	FWWRPKFBAKZJJY-SECBINFHSA-N	223.272	1.606	10	20	BDCD	
COC[C@H](O)CNCc1cc(Cl)ccc1O	70589370	CIYLNYJYXPASFP-SNVBAGLBSA-N	245.706	1.143	10	20	BDCD	
Cc1cccc(CN(C)CCC(N)=O)c1O	289839618	UPJDYMVLLGJVOH-UHFFFAOYSA-N	222.288	1.008	10	20	BDCD	
CN(C)c1ccc(CNCC2(O)CCC2)cc1	134516743	OYPAKPYVJRXMRL-UHFFFAOYSA-N	234.343	1.757	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CCO[C@@H]2C)c1	134236707	MKZPQFMIXJHXTD-BXKDBHETSA-N	237.299	1.668	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCN(C)C2)c1O	162861122	WYNCNXVRGLCSOM-GFCCVEGCSA-N	220.316	1.494	10	20	BDCD	
CC(=O)C(=O)COc1ccc(C)cc1[N+](=O)[O-]	808016862	FMALXGYTJSVDIA-UHFFFAOYSA-N	237.211	1.440	10	20	BDCD	
C[C@@H](NCCN(C)C)c1cc(F)cc(F)c1O	806171653	QTTWISVUTBSEMY-MRVPVSSYSA-N	244.285	1.883	10	20	BDCD	
Oc1ccccc1CN1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	824838808	SGDFLIUMFZQNBW-AYRXBEOTSA-N	243.306	1.777	10	20	BDCD	
Cc1ccc(O)c(CNCC(=O)NC(C)C)c1	71407080	DYJMYHMROUVGGK-UHFFFAOYSA-N	236.315	1.315	10	20	BDCD	
CCC[C@H]1CN(C(=O)CN=[N+]=[N-])CC[C@@H]1O	409434360	OUMXGGWRZNIASL-IUCAKERBSA-N	226.280	1.306	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@H](F)C1	689842649	UXRSCGXPSOHXGN-ZETCQYMHSA-N	225.219	1.282	10	20	BDCD	
c1csc(SC[C@@H]2COCCO2)n1	307322981	IPJVIHXCRZKQPX-ZETCQYMHSA-N	217.315	1.651	10	20	BDCD	
CN(Cc1ccccc1O)CC(C)(C)N	309394707	GIWMKTNRQQJAFH-UHFFFAOYSA-N	208.305	1.561	10	20	BDCD	
CN(C)c1ccc(CNCC2(N(C)C)CC2)cc1	397855078	LYOUOSBKMLJLEX-UHFFFAOYSA-N	247.386	1.936	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2cocn2)c1	114540854	VMXBKQSXZJJAFR-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)C(=O)O)c1	70955403	LJWTYFYDXODITE-QMMMGPOBSA-N	209.245	1.263	10	20	BDCD	
COCC[C@H](C)NCc1ccccc1O	82367508	PHQORNODTINBNX-JTQLQIEISA-N	209.289	1.907	10	20	BDCD	
c1cc(CNCc2ccc3c(c2)CCO3)no1	93305761	OKTNOXMFXHQVRN-UHFFFAOYSA-N	230.267	1.899	10	20	BDCD	
CC(=O)C(=O)COc1ccc([N+](=O)[O-])cc1F	808023697	UGDJSPYWHGYSGA-UHFFFAOYSA-N	241.174	1.271	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C[C@@H](O)C1CC1	809753148	ZUNXYDPLBQJDSY-CYBMUJFWSA-N	239.290	1.734	10	20	BDCD	
Cc1ccc([C@@H](C)NC2CNC2)c(O)c1C	817955920	LIEDBFBYMCRMOY-SNVBAGLBSA-N	220.316	1.631	10	20	BDCD	
C[C@@H](NCCNC1CC1)c1ccc(F)cc1O	817954135	VGBWOEQFDQRIMN-SECBINFHSA-N	238.306	1.934	10	20	BDCD	
Cc1ccc([C@@H](C)NCCCON)c(O)c1C	902426405	SJZAYNAIIGYXMQ-LLVKDONJSA-N	238.331	1.940	10	20	BDCD	
CCC1(C(=O)NCc2ccc(O)cc2O)CC1	910951551	SQQZAOGAFMIIQB-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
C[C@H](N)CN(C)Cc1cc(Cl)cc(F)c1O	863652950	ZXWVZMVVQYWXCI-ZETCQYMHSA-N	246.713	1.964	10	20	BDCD	
NC(=O)[C@@H]1CC[C@H](C(=O)Nc2ccc(N)cc2)C1	884008771	BBPLBMMKQTZRFB-BDAKNGLRSA-N	247.298	1.109	10	20	BDCD	
Cc1cccc(CN[C@@H]2COC[C@H]2C)c1O	710997385	HLRWBJGEOAMDLB-ZYHUDNBSSA-N	221.300	1.825	10	20	BDCD	
CN1CC[C@@H]1CNCc1ccc2c(c1)CCO2	712583049	SQAHKYJJVNQPTB-CYBMUJFWSA-N	232.327	1.415	10	20	BDCD	
CCc1cccc(CNCc2nncn2C)c1O	691453240	NRHFMHHUBLJPQO-UHFFFAOYSA-N	246.314	1.373	10	20	BDCD	
C[C@@H](CO)CNCc1cccc(Cl)c1O	162830148	ACCIFPRLKQTICL-MRVPVSSYSA-N	229.707	1.764	10	20	BDCD	
CCCN(CC)C(=O)c1cccc(O)c1O	163269868	CPPCHPBGGUYTBB-UHFFFAOYSA-N	223.272	1.970	10	20	BDCD	
C[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)CO1	402024787	GLZAACGWZVRGPM-GWCFXTLKSA-N	233.311	1.889	10	20	BDCD	
CC1(C(=O)NCc2ccccc2O)CC1	308788864	GPBMKVVEXBFJGT-UHFFFAOYSA-N	205.257	1.809	10	20	BDCD	
CNCCN(C)Cc1cccc(F)c1O	381797637	CDVFTGJJZZGGKS-UHFFFAOYSA-N	212.268	1.183	10	20	BDCD	
COC[C@@H]1CCCN1C(=O)Nc1ccc(N)cc1	696512746	QDZIGDQTXVPSFK-LBPRGKRZSA-N	249.314	1.912	10	20	BDCD	
CC[C@@H](NCc1cccc(C)c1O)C(=O)O	820419315	WPHYQZDNPUQLLA-SNVBAGLBSA-N	223.272	1.653	10	20	BDCD	
CC[C@@H](C(N)=O)N1CCCc2cc(CN)ccc21	62801599	VBANGFUKLLZXJX-LBPRGKRZSA-N	247.342	1.162	10	20	BDCD	
COc1cccc(CNc2cnccn2)c1O	301995367	SKWAWZJPULCYLC-UHFFFAOYSA-N	231.255	1.803	10	20	BDCD	
C[C@H]1CO[C@H](C)CN1C(=O)Cc1ccc(N)cc1	35782350	RXBTWGKUODNCHA-WDEREUQCSA-N	248.326	1.447	10	20	BDCD	
C[C@@H](N[C@@H]1C=C[C@H](CO)C1)c1ccccc1O	183573647	SEAVYQWVJGZPRR-GRYCIOLGSA-N	233.311	1.980	10	20	BDCD	
C[C@@H](NC[C@H]1COCCO1)c1ccccc1O	38060525	RGYADTQDGYJZCU-MNOVXSKESA-N	237.299	1.458	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@H](N)C1	91545524	AKGMIZGFTKWHHO-PWSUYJOCSA-N	248.326	1.478	10	20	BDCD	
Cc1nccnc1CCNCc1ccccc1O	815153390	PCGOBHXWVWAFCJ-UHFFFAOYSA-N	243.310	1.823	10	20	BDCD	
C[C@@H](NC(=O)c1cc(O)cs1)[C@H]1CCOC1	743670884	VXHILZCFHYMAMO-SFYZADRCSA-N	241.312	1.609	10	20	BDCD	
CNCCNCc1cc(Cl)cc(OC)c1O	841036029	NFOPLBMNOBOTCO-UHFFFAOYSA-N	244.722	1.363	10	20	BDCD	
CNC[C@H](C)N[C@@H]1CCc2cccc(O)c21	854232469	QUBXYVCTTFBWAG-GXSJLCMTSA-N	220.316	1.577	10	20	BDCD	
COc1ccc2c(c1)CCCN2C[C@H](C)N	1118260673	FBWNITSPIBYHEQ-JTQLQIEISA-N	220.316	1.795	10	20	BDCD	
CC[C@@H](C)[C@@H](O)CNC(=O)c1cc(O)cs1	771063146	DWGIYFSCZSKYSC-APPZFPTMSA-N	243.328	1.591	10	20	BDCD	
C[C@@H]1C[C@@H](O)CN1Cc1ccc(N(C)C)cc1	788266964	DLEGAVLLHHKIBJ-BXUZGUMPSA-N	234.343	1.708	10	20	BDCD	
COc1ccc(CNC(=O)[C@H]2C[C@H]2C)c(O)c1	794382803	INVIKXCFSMYPJJ-KCJUWKMLSA-N	235.283	1.673	10	20	BDCD	
Cc1cccc(CNCCC(C)(C)O)c1O	274949492	SAIURTZTSUUEIB-UHFFFAOYSA-N	223.316	1.951	10	20	BDCD	
CC[C@@H](C(N)=O)N(C)Cc1ccccc1O	109770434	OLBXDVSSQBLNJF-JTQLQIEISA-N	222.288	1.088	10	20	BDCD	
C[C@@H](O)CNCc1c(O)ccc(Cl)c1F	190666090	GETJKYSMNQIVLZ-ZCFIWIBFSA-N	233.670	1.655	10	20	BDCD	
C[C@@H]1[C@@H](CO)CCCN1Cc1ccc(N)cc1	1335288429	FVEKJEDXLVGCRC-DGCLKSJQSA-N	234.343	1.862	10	20	BDCD	
CC[C@H](NCc1cccc(F)c1O)C(=O)O	1332339739	PIEAEZZZZJGRSA-VIFPVBQESA-N	227.235	1.484	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2CCCCCN2)cc1	1343474700	XRIQTHWCCKXYOG-ZDUSSCGKSA-N	247.342	1.417	10	20	BDCD	
Cc1cccc(CN[C@H](C)C[C@@H](C)O)c1O	164591390	AQYRANUDWXQLOD-GHMZBOCLSA-N	223.316	1.950	10	20	BDCD	
Oc1c(F)cc(F)cc1CNCC1(O)CCC1	708440896	FLVKHLSUIANGNR-UHFFFAOYSA-N	243.253	1.675	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCCN1	817902854	ZNNRTBVTYNACIH-FZMZJTMJSA-N	246.354	1.852	10	20	BDCD	
COc1cccc(O)c1CN1C[C@@H](N)[C@H](C)C1	843120634	RYMHZHZEZOPVEV-MWLCHTKSSA-N	236.315	1.180	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)COC	66096629	JJJIXHUXBCYBOR-UHFFFAOYSA-N	237.299	1.777	10	20	BDCD	
COC[C@H](CNCc1cc(C)ccc1O)OC	227704623	HKYSVKLKNSHMFR-LBPRGKRZSA-N	239.315	1.452	10	20	BDCD	
CCN(CC(=O)N(C)C)Cc1ccccc1O	133204685	DXVANBXXKNILLF-UHFFFAOYSA-N	236.315	1.302	10	20	BDCD	
O=C(COC1CCCC1)NCc1ccccc1O	299569997	PFOYCSOXHLMOMV-UHFFFAOYSA-N	249.310	1.968	10	20	BDCD	
Cc1cc(CN2CC[C@H](CO)C2)ccc1N(C)C	292711675	BFOPJAYGVQXBON-AWEZNQCLSA-N	248.370	1.875	10	20	BDCD	
COc1cccc(O)c1CNC/C=C/CO	850358033	ZRFDDFAJGGPTQD-NSCUHMNNSA-N	223.272	1.039	10	20	BDCD	
CCc1cccc(CN2CCC[C@H](O)C2)c1O	848877098	PUKSHDAYTSSLCN-ZDUSSCGKSA-N	235.327	1.911	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C[C@H](C)N)c1O	843129554	PPFDTAJXUVKKSN-QWRGUYRKSA-N	222.332	1.916	10	20	BDCD	
CN[C@@H]1CCCN(Cc2cccc(C)c2O)C1	843048557	HIASOABELCXPLI-CYBMUJFWSA-N	234.343	1.884	10	20	BDCD	
COc1cc(CN2CC(OC)C2)c(O)cc1C	768447691	RRNNGOXIWYZJKR-UHFFFAOYSA-N	237.299	1.540	10	20	BDCD	
Cc1ccc(CN(C)C2CC(O)C2)c(O)c1	877344689	LZAQAAPCWZUMOO-UHFFFAOYSA-N	221.300	1.656	10	20	BDCD	
Nc1ccc(CN[C@@H]2CCCNC(=O)C2)cc1	1580445514	HLSBGMYJUGHOEG-GFCCVEGCSA-N	233.315	1.027	10	20	BDCD	
CN(C)c1ccc(OCc2noc(CN)n2)cc1	843316542	UTRSEFALYBTVTJ-UHFFFAOYSA-N	248.286	1.173	10	20	BDCD	
Cc1cccc(CN[C@@H](C)C(C)(C)O)c1O	309779555	MPDLTCPQGDYCTR-JTQLQIEISA-N	223.316	1.950	10	20	BDCD	
CCC[C@@H](O)CNCc1ccc2c(c1)CCO2	112377515	VACOVZHJTMNAQL-CYBMUJFWSA-N	235.327	1.872	10	20	BDCD	
COC(=O)[C@@]1(C)CCN(Cc2ccccc2O)C1	179582928	WCFBBGSXOXONKM-AWEZNQCLSA-N	249.310	1.777	10	20	BDCD	
C[C@H]1C[C@@H](CN)CN1Cc1ccccc1O	126770311	DGUZVOCCOSGBTH-QWRGUYRKSA-N	220.316	1.561	10	20	BDCD	
COc1ccccc1NC[C@H](O)Cn1cccn1	37874597	BGBIVOROSIMLKS-NSHDSACASA-N	247.298	1.365	10	20	BDCD	
C[C@@H]1C[C@H]1CNC(=O)Cc1ccc(N)cc1	136316468	APRVFHMROWSQMG-KOLCDFICSA-N	218.300	1.584	10	20	BDCD	
CNC(=O)N(C)Cc1ccc(N(C)C)cc1	48644783	FIPADAHVCZBNOV-UHFFFAOYSA-N	221.304	1.524	10	20	BDCD	
CCN1CCN(Cc2cccc(C)c2O)CC1=O	273512831	REHHMYOZYJEVPN-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC[C@@H](C)N)c1	817972704	NVQDJRBLEZNTMH-NXEZZACHSA-N	208.305	1.698	10	20	BDCD	
Oc1ccc(Cl)c(F)c1CN[C@H]1C[C@@H](O)C1	825256560	ARHIJMHXEDOGNJ-KNVOCYPGSA-N	245.681	1.798	10	20	BDCD	
Cc1nonc1C(=O)NCc1ccccc1O	735857459	RZPHCUHUJDGZAX-UHFFFAOYSA-N	233.227	1.014	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@H](CO)C1	876660527	UVSHJKDLXDFSOZ-NSHDSACASA-N	221.300	1.515	10	20	BDCD	
CN[C@@H](C)CCN[C@@H]1CCc2cccc(O)c21	1118057216	BVRFYQBVIYTMPC-CMPLNLGQSA-N	234.343	1.967	10	20	BDCD	
C[C@H]1CCN(C(=O)c2cccc(O)c2O)[C@H]1C	193127135	XUBKEMNLZXOFHM-IUCAKERBSA-N	235.283	1.968	10	20	BDCD	
CN(Cc1ccc(N)cc1)C1CCNCC1	1336117492	NWEFYVQUISYJNU-UHFFFAOYSA-N	219.332	1.453	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC[C@H]2C[C@@H]2C1	699172565	JUTQLVFGCSXLKO-DTWKUNHWSA-N	233.267	1.580	10	20	BDCD	
CNC(=O)CSc1ncc(Cl)s1	306758518	OLSULYYHKNTDNA-UHFFFAOYSA-N	222.722	1.635	10	20	BDCD	
C[C@@H](NCc1nc[nH]n1)c1ccc(N(C)C)cc1	37919757	BVBLTBLNOJTINE-SNVBAGLBSA-N	245.330	1.722	10	20	BDCD	
CNCCCN(C)c1ccc(OC)cc1	49971128	JDYSYBCAEUFTHC-UHFFFAOYSA-N	208.305	1.741	10	20	BDCD	
OC/C=C\CNCc1cc(F)cc(F)c1O	708420545	JMFXVHOZFUSJQT-UPHRSURJSA-N	229.226	1.309	10	20	BDCD	
C[C@]1(CO)CCCN1C(=O)c1cc(O)cs1	832170305	BFQHINVJPXSTTR-LLVKDONJSA-N	241.312	1.441	10	20	BDCD	
COCC(C)(C)N(C)C(=O)c1cc(O)cs1	854604477	CINGHZUYDXWMAC-UHFFFAOYSA-N	243.328	1.951	10	20	BDCD	
CO[C@H](C)CNC(=O)c1cc(O)cs1	785427381	MVWYYVPXKNSHMY-ZCFIWIBFSA-N	215.274	1.218	10	20	BDCD	
COC(=O)CCN(C)Cc1ccccc1O	111236469	WVKPUFGAKURXDI-UHFFFAOYSA-N	223.272	1.387	10	20	BDCD	
CCN1CC[C@H](Sc2nccs2)C1=O	1327206371	MMIXVKPBLAOMQP-ZETCQYMHSA-N	228.342	1.856	10	20	BDCD	
CNC1(C(=O)NCc2ccc(N)cc2)CCC1	1346208922	CSIYCLXNRHWIKX-UHFFFAOYSA-N	233.315	1.027	10	20	BDCD	
Cn1cncc1CNCc1ccc2c(c1)CCO2	263858256	TXOMAZPNOGGOFS-UHFFFAOYSA-N	243.310	1.645	10	20	BDCD	
CN(Cc1cccc(Cl)c1O)C1CNC1	309662591	YOGLELWPMLHIRF-UHFFFAOYSA-N	226.707	1.449	10	20	BDCD	
CNC[C@@H](C)NCc1ccc(OC)c(C)c1	853250715	YAJXOLHTHSUJRU-LLVKDONJSA-N	222.332	1.701	10	20	BDCD	
CO[C@H](C)[C@H](C)NCc1ccccc1O	133139543	UDNXNDAMHZTKIO-VHSXEESVSA-N	209.289	1.905	10	20	BDCD	
COCCN(CCO)Cc1cccc(C)c1O	271751097	VKBZDMXKZCDFKR-UHFFFAOYSA-N	239.315	1.141	10	20	BDCD	
COC(=O)c1cnc(SCC(C)(C)O)s1	294923204	CMXZVLJRVFAISR-UHFFFAOYSA-N	247.341	1.793	10	20	BDCD	
CCN1CC(=O)N[C@@H]1c1ccc(N(C)C)cc1C	840819008	TWRMUERNPUWJCV-AWEZNQCLSA-N	247.342	1.511	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)c2nc(C)no2)c1	862755717	KERYXQWWTNIERU-UHFFFAOYSA-N	247.254	1.322	10	20	BDCD	
COC[C@@H](O)CCNCc1ccc(C)cc1O	877125508	OBNASCVAGPFPHK-LBPRGKRZSA-N	239.315	1.188	10	20	BDCD	
Cc1ccc(CN(C)CC[C@@H](C)O)c(O)c1	876744762	AQSVVNQBQSCULK-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
C/C=C\C[C@H](CO)NC(=O)c1cc(O)cs1	771742220	BJQNXRDKYYSTNT-YAJNLLPGSA-N	241.312	1.511	10	20	BDCD	
CC1(C)CNC(=O)[C@@H]1NCc1ccccc1O	895317468	OWOXWLMULGCIJQ-NSHDSACASA-N	234.299	1.006	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1cc(F)cc(F)c1O	894870104	JCRPUDSHTKUBJY-JTQLQIEISA-N	245.269	1.873	10	20	BDCD	
CCN(CC)c1ccc(CNC(=O)[C@H](C)N)cc1	83381515	SKIKPTIAJPBJAW-NSHDSACASA-N	249.358	1.496	10	20	BDCD	
Nc1ccc(CNC(=O)C2(N)CCCC2)cc1	1356239965	UUNZQQODIKIEEM-UHFFFAOYSA-N	233.315	1.157	10	20	BDCD	
CCn1ncc(CN[C@H](C)c2ccccc2O)n1	845989528	JATQKVNTKVMQQR-SNVBAGLBSA-N	246.314	1.854	10	20	BDCD	
C[C@H](NCc1cnnn1C)c1ccccc1O	287465635	WBXCVXXDJHWYIQ-VIFPVBQESA-N	232.287	1.372	10	20	BDCD	
C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1N	300047733	FJIKTTBFKNAXJO-LDYMZIIASA-N	240.734	1.825	10	20	BDCD	
C[C@@]1(NCc2ccc3c(c2)CCO3)CCOC1	120226314	XYHOMXZXRWNVOJ-CQSZACIVSA-N	233.311	1.890	10	20	BDCD	
CC(C)(C)C(=O)C(=O)NCc1ccccc1O	265404447	JTGSYNSXLSLXMC-UHFFFAOYSA-N	235.283	1.624	10	20	BDCD	
O=C(NC1CCC1)c1c(F)ccc(O)c1O	295278221	PAHNUICNIBHNMV-UHFFFAOYSA-N	225.219	1.519	10	20	BDCD	
C[C@@H](NC[C@H]1CCCN1)c1ccc(F)cc1O	817951226	BXLWVNNXVCZYHA-MWLCHTKSSA-N	238.306	1.934	10	20	BDCD	
COc1cccc(O)c1CNC[C@H]1CCCN1	841036605	SLRVWECWYWRRON-SNVBAGLBSA-N	236.315	1.242	10	20	BDCD	
C[C@H]1OCC[C@@H]1NCCc1ccc(N)cc1	841033806	BJOZTJLHIXCFEN-MFKMUULPSA-N	220.316	1.578	10	20	BDCD	
CC[C@@H]1COCCN1C(=O)c1cc(O)cs1	754904928	BQYAAGNGFSJZBD-MRVPVSSYSA-N	241.312	1.705	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1CCCNC1=O	877586357	BNJGKXWOYARNTA-LLVKDONJSA-N	248.326	1.316	10	20	BDCD	
COc1cc(O)c(CN2C[C@H]3C[C@H]3C2)cc1OC	862444167	YYHRCGDGOHDQCE-AOOOYVTPSA-N	249.310	1.861	10	20	BDCD	
COC[C@](C)(O)CNCc1c(C)cccc1O	877026280	BMEQLRQNCMLZFI-CYBMUJFWSA-N	239.315	1.188	10	20	BDCD	
Cc1cccc(O)c1CN1CC(O)(C(C)C)C1	877580616	VCTAZOUEZUCNRI-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
COc1cc(C)cc(CNCC(C)(C)O)c1O	894259928	IXHORPBWDNMXMT-UHFFFAOYSA-N	239.315	1.570	10	20	BDCD	
CC(=O)OC[C@H](C)NCc1cc(C)ccc1O	895583163	WIYUZLYPYJFRNZ-JTQLQIEISA-N	237.299	1.742	10	20	BDCD	
CCn1nccc1NC(=O)c1cccc(O)c1O	790513858	RKWDINKQCCMCAP-UHFFFAOYSA-N	247.254	1.567	10	20	BDCD	
C[C@H](C(=O)N(C)c1ccc(N)cc1)n1cncn1	702097460	NCAJSVVAIXKRGN-SECBINFHSA-N	245.286	1.084	10	20	BDCD	
CC1(CF)CCN(C(=O)CN=[N+]=[N-])CC1	409425367	AKCYERGVMIAICA-UHFFFAOYSA-N	214.244	1.895	10	20	BDCD	
CN(Cc1ccc(N)cc1)C1CCC(N)CC1	1335285803	RAOYMBVKHNOCOM-UHFFFAOYSA-N	233.359	1.971	10	20	BDCD	
Nc1ccc(CN[C@H]2CCCOCC2)cc1	1336117947	RJWUWPNDIHWMTQ-ZDUSSCGKSA-N	220.316	1.928	10	20	BDCD	
CC(C)CNCC(=O)N(C)c1ccc(N)cc1	1262009172	NBQGDHYOGRKOQI-UHFFFAOYSA-N	235.331	1.477	10	20	BDCD	
CCOC(=O)C1=NN(c2ccccc2)C(=O)[C@H]1C	105360373	VYWCMILBLGMHDX-VIFPVBQESA-N	246.266	1.588	10	20	BDCD	
CCOC[C@H](O)CN(C)c1ccc(OC)cc1	8697956	OJKOIRSDZJIVPF-GFCCVEGCSA-N	239.315	1.529	10	20	BDCD	
COc1cccc(CN2CCNC[C@H]2C)c1O	722385047	DYRMFLDNWGGSJM-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)CC[C@@H]1N	86884215	PNNFQMRBBZTXKA-PWSUYJOCSA-N	220.316	1.561	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)CN	236731960	YKOOWDUKPTYGMF-UHFFFAOYSA-N	222.288	1.090	10	20	BDCD	
COc1cccc(CN(C)CC[C@@H](C)O)c1O	93481658	XHGITXSJZWSIMW-SNVBAGLBSA-N	239.315	1.604	10	20	BDCD	
COc1cccc(O)c1CNCCC(C)(C)N	903939416	ZUUNJDWNJNAUCJ-UHFFFAOYSA-N	238.331	1.618	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)Cn2cncn2)c1	733326307	VVPMJNUULLLUNW-NSHDSACASA-N	246.314	1.470	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCN(C)C2)c1	862756307	VOIMTTYOYIFHHE-LLVKDONJSA-N	248.326	1.269	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H]2CN(C)C[C@@H]2C1	877483071	JHXZVOGKTXBESV-BETUJISGSA-N	246.354	1.694	10	20	BDCD	
COCCOC(=O)/C=C\c1ccc(O)c(O)c1	772768546	KOLGJWVWYHLLAB-HYXAFXHYSA-N	238.239	1.301	10	20	BDCD	
CO[C@@H](C)COC(=O)c1ccc(C)c(O)c1O	782327033	SNIOXQMSMZMKNL-QMMMGPOBSA-N	240.255	1.598	10	20	BDCD	
CC(C)(O)CNCc1ccc2c(c1)CCCO2	82548110	PMZJIXNGTNCABV-UHFFFAOYSA-N	235.327	1.872	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2CCC[C@H]2CN)cc1	89147863	QUVALSMNYAEKQX-ZFWWWQNUSA-N	247.386	1.970	10	20	BDCD	
C[C@@H](NCc1cc(F)c(F)cc1O)C(=O)O	1594206712	RSIZOWJUIWHQTK-RXMQYKEDSA-N	231.198	1.233	10	20	BDCD	
C[C@H]1C[C@H]1C(=O)NCc1ccc(O)c(O)c1	158898512	FRQQLKZUSDGAPU-IONNQARKSA-N	221.256	1.370	10	20	BDCD	
C[C@@]1(NCc2cc(F)cc(F)c2O)CCOC1	708442478	MLYWHPROSKCSSC-GFCCVEGCSA-N	243.253	1.939	10	20	BDCD	
COc1cc(C)cc(CN(C)CCO)c1O	213009161	GIHUGWXCROVNOF-UHFFFAOYSA-N	225.288	1.133	10	20	BDCD	
CNCCCN(C)c1ccc(OC)c(F)c1	87472867	WKDWYUXEHJSRLM-UHFFFAOYSA-N	226.295	1.880	10	20	BDCD	
CCNC(=O)CNCc1c(O)cccc1Cl	83551485	HQWMOBQEFWNMDR-UHFFFAOYSA-N	242.706	1.271	10	20	BDCD	
C[C@@H]1NCC[C@H]1C(=O)N(C)Cc1ccccc1O	92954828	GJFCPOIWBQPTAI-CMPLNLGQSA-N	248.326	1.349	10	20	BDCD	
COc1ccc(O)c(CN2CC3(CC3)C2)c1	824533113	AWLKHYCYQDKTLW-UHFFFAOYSA-N	219.284	1.997	10	20	BDCD	
CCOc1cccc(CN[C@H]2C[C@H](N)C2)c1O	906508339	NMTRHOPBYVWACR-XYPYZODXSA-N	236.315	1.370	10	20	BDCD	
CC[C@H](N)CNCc1cc(Cl)ccc1O	841070208	MQNDACOYDJVLMZ-JTQLQIEISA-N	228.723	1.873	10	20	BDCD	
Oc1c(Cl)cccc1CN[C@H]1CCCNC1	841043842	XIJVCPFKTOKFHU-JTQLQIEISA-N	240.734	1.887	10	20	BDCD	
C[C@H]1C[C@H](CN)CN1Cc1cccc(F)c1O	843058047	NZRRFYRTVYDVOW-VHSXEESVSA-N	238.306	1.700	10	20	BDCD	
CCC[C@@H](O)CC(=O)NCc1ccccc1O	750422811	ARVJJNZVKCTPEX-LLVKDONJSA-N	237.299	1.560	10	20	BDCD	
COCC(=O)N[C@H](C)c1ccc(N(C)C)cc1	773010597	CJECYXSIFWJFEL-SNVBAGLBSA-N	236.315	1.576	10	20	BDCD	
Cc1ccc(C(=O)NCc2cnc[nH]2)c(O)c1O	780947529	MGZVKGKOGIYSJW-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
CC[C@H]1CN(Cc2ccc(N)cc2)CCO1	36768911	VZONBBVSMGMCRC-ZDUSSCGKSA-N	220.316	1.880	10	20	BDCD	
CN(C)CCNC(=O)c1ccc(CN=[N+]=[N-])o1	1537963059	RVJWAMLULNIDBV-UHFFFAOYSA-N	237.263	1.381	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1Cc2ccccc2C1	409425635	AXMRVOWOPJOUJD-UHFFFAOYSA-N	202.217	1.839	10	20	BDCD	
CN(Cc1ccc(N)cc1)C[C@@H]1CCC[C@@H]1O	689861244	JJKUXYAEPRIDKJ-JSGCOSHPSA-N	234.343	1.862	10	20	BDCD	
CN(C)c1ccc(CN[C@@H](CF)C(=O)O)cc1	1598320838	VLBGZKODNYIWKK-NSHDSACASA-N	240.278	1.265	10	20	BDCD	
CN(Cc1ccccc1O)CC1CCNCC1	94010781	LYPONGNJSGBFFG-UHFFFAOYSA-N	234.343	1.824	10	20	BDCD	
Oc1ccc(F)cc1CN[C@H]1C[C@@H](O)C1	294941261	VIVNSDBVGHKUMF-AOOOYVTPSA-N	211.236	1.144	10	20	BDCD	
CC(F)(F)C(=O)NCc1ccc(N)cc1	328334132	IQGQINJPSRWPMZ-UHFFFAOYSA-N	214.215	1.540	10	20	BDCD	
COCCN[C@H](C)c1cc(F)cc(F)c1O	134906283	LBKBDFFXJBTQTI-SSDOTTSWSA-N	231.242	1.967	10	20	BDCD	
CCCOCC(=O)NCc1ccc(N)cc1	233225816	XXFDHOZFRTUUKB-UHFFFAOYSA-N	222.288	1.312	10	20	BDCD	
C[C@H](N[C@H](C)CN)c1ccc(F)cc1O	817965899	FADKZQPUNAYFNI-SFYZADRCSA-N	212.268	1.529	10	20	BDCD	
CCO[C@H](C)C(=O)N[C@H](C)c1ccccc1O	827930120	BVRGUAVFGUXPBK-NXEZZACHSA-N	237.299	1.994	10	20	BDCD	
COCC1(NCc2cc(C)ccc2O)CC1	390454614	BTJAOBIJWNOJMJ-UHFFFAOYSA-N	221.300	1.969	10	20	BDCD	
COc1cc(Cl)cc(CN[C@@H](C)CN)c1O	841064209	VQHPHRTXVBTDJF-ZETCQYMHSA-N	244.722	1.491	10	20	BDCD	
CNC[C@H](C)NCc1cccc(C)c1O	853249637	SGZVSLYJUCVUIV-JTQLQIEISA-N	208.305	1.398	10	20	BDCD	
Cc1ccc(O)c(CNC2CCN(C=O)CC2)c1	895582416	TWUODFOECIZXJD-UHFFFAOYSA-N	248.326	1.411	10	20	BDCD	
Cc1ccc(CNCc2cn(C)cn2)c(O)c1	898042618	UMAXKFYIDGTUBK-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
OC[C@H]1C[C@@H](N[C@H]2CCc3cccc(O)c32)C1	707622208	XBPKFBOQYPTHQL-WCQGTBRESA-N	233.311	1.740	10	20	BDCD	
C[C@H](CCCO)NCc1ccccc1O	87358345	XDEPVGPDLNLPRS-SNVBAGLBSA-N	209.289	1.643	10	20	BDCD	
Cc1cccc(CNC[C@@H](C)N(C)C)c1O	163729323	PHTIJEIQRXKHCP-LLVKDONJSA-N	222.332	1.740	10	20	BDCD	
CC[C@H](C)C(=O)NCc1ccc(O)c(O)c1	158929903	ZRQNYMYHLHMDJR-QMMMGPOBSA-N	223.272	1.760	10	20	BDCD	
CC[C@@H](NCCN(C)OC)c1ccccc1O	850479158	MPCOOTDJIPKODI-GFCCVEGCSA-N	238.331	1.926	10	20	BDCD	
CCn1cnnc1CN[C@H](C)c1ccccc1O	228791327	YBTYOYYAPVLCOZ-SNVBAGLBSA-N	246.314	1.854	10	20	BDCD	
CC[C@H](C)C(=O)NCCc1ccc(O)c(O)c1	156609200	OZSHGWNUHUNMFA-VIFPVBQESA-N	237.299	1.803	10	20	BDCD	
CCN(CC(=O)O)Cc1c(O)cccc1Cl	133835306	WEOAFRUDAQKWAK-UHFFFAOYSA-N	243.690	1.952	10	20	BDCD	
C[C@@H](N[C@H]1C[C@@H](O)C1)c1ccc(N(C)C)cc1	296094808	YJZIETOCHFVXQO-QKCSRTOESA-N	234.343	1.927	10	20	BDCD	
Oc1ccccc1CN1CCC[C@H]2CNC[C@H]21	299922079	RJRHIQPTQNDXME-WCQYABFASA-N	232.327	1.576	10	20	BDCD	
C[C@H](O)CCOC(=O)c1cc(O)cs1	849728654	WNAXZDRNCXGHQD-LURJTMIESA-N	216.258	1.381	10	20	BDCD	
CC[C@@H](NC)C(=O)Nc1ccc(N)cc1	852790858	UZHZZLGOIDEYLH-SNVBAGLBSA-N	207.277	1.205	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1COCCO1	876951208	HBDGDLLRAMSWAD-NSHDSACASA-N	237.299	1.206	10	20	BDCD	
CC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1	878455046	NTIDAPQUPRREGM-NSHDSACASA-N	220.316	1.992	10	20	BDCD	
OC[C@H](CCF)NCc1cc(F)cc(F)c1O	883158560	KRHDVRKFHIVIAH-VIFPVBQESA-N	249.232	1.481	10	20	BDCD	
CC(C)C[C@@H](CO)NC(=O)c1cc(O)cs1	782122589	ARUIYYFUJNULOY-QMMMGPOBSA-N	243.328	1.591	10	20	BDCD	
COC(=O)c1cnc(SCC[N+](=O)[O-])s1	899887589	VEJHLHWTHPSRLR-UHFFFAOYSA-N	248.285	1.299	10	20	BDCD	
CN(C)CCCOC(=O)c1cc(O)cs1	791887355	YXVQTCYNDXDSGY-UHFFFAOYSA-N	229.301	1.562	10	20	BDCD	
CC(C)(C)C(=O)NCc1cccc(O)c1O	1347235853	YMAQUAZKNOTSEF-UHFFFAOYSA-N	223.272	1.760	10	20	BDCD	
C[C@H](N)[C@H]1CCCCN1Cc1ccc(N)cc1	1356082911	HMAWKOXSCSYRIL-SMDDNHRTSA-N	233.359	1.971	10	20	BDCD	
C[C@H](N[C@H](C)CN)c1cc(C(=O)O)ccc1O	1593354404	PBMRYNMFKOHYHY-SFYZADRCSA-N	238.287	1.088	10	20	BDCD	
CN1CC[C@H](C(=O)Nc2ccc(N)cc2)CC1=O	160413760	KIJNXDZDWABEKY-VIFPVBQESA-N	247.298	1.076	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CC23CCC3)cc1	721180097	OCXIMXSLUHZQIU-GFCCVEGCSA-N	230.311	1.870	10	20	BDCD	
COc1cccc(CNC(=O)[C@H](C)OC)c1O	105649386	LFXHXPQXOUDMNO-QMMMGPOBSA-N	239.271	1.052	10	20	BDCD	
C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)C1CC1	122662627	DIGYVCZUACWGFZ-SECBINFHSA-N	249.310	1.803	10	20	BDCD	
NC[C@H]1CCCC[C@H]1NCc1ccccc1O	228406654	RPWJMAPCRFJOJS-DGCLKSJQSA-N	234.343	1.999	10	20	BDCD	
COc1ccc(O)c(CN(C)CC[C@H](C)O)c1	271796992	KCVWRWONCQNXSD-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
Cc1ccc(C(=O)NOC(C)C)c(O)c1O	297277402	SMVPAXXOZKDSOR-UHFFFAOYSA-N	225.244	1.476	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H](N)C2CCC2)cc1	832250164	LKTKEVPOBDDNLF-NSHDSACASA-N	219.288	1.335	10	20	BDCD	
CCCN1CC(=O)N[C@@H]1c1cc(F)ccc1O	840824797	ORNORHBOEAIPFY-LBPRGKRZSA-N	238.262	1.372	10	20	BDCD	
CCON(C)C(=O)NCCc1ccc(N)cc1	841957887	FGAUIJZDPCMGIT-UHFFFAOYSA-N	237.303	1.404	10	20	BDCD	
Cc1ccc(CN[C@@H](CO)CC2CC2)c(O)c1	877117535	GRRUUMDXVJZOOT-CYBMUJFWSA-N	235.327	1.951	10	20	BDCD	
OCC[C@@H]1CCCN1Cc1cc(F)ccc1O	779201202	BQTYFDZAXVHLGZ-LBPRGKRZSA-N	239.290	1.878	10	20	BDCD	
Nc1ccc(CN2CC[C@@H]3NCC[C@@H]3C2)cc1	1336286517	QZZQPUFJFLKQLD-OCCSQVGLSA-N	231.343	1.453	10	20	BDCD	
CCOCCCNC(=O)Cc1ccc(N)cc1	22218813	UFKSTQCGQYLEFM-UHFFFAOYSA-N	236.315	1.354	10	20	BDCD	
C[C@@H]1CCN[C@@H]([C@@H]2CCCC(=O)C2=O)C1	130378373	MKIWVDMMNRFFHU-KXUCPTDWSA-N	209.289	1.313	10	20	BDCD	
COc1cccc(CNCCOC(C)C)c1O	168959771	LFICNYRDJUCUOF-UHFFFAOYSA-N	239.315	1.915	10	20	BDCD	
Cc1cccc(CNCC2(CO)CCC2)c1O	183232756	BZBFLJGEHLOTKX-UHFFFAOYSA-N	235.327	1.953	10	20	BDCD	
COCC(COC)NCc1cc(C)ccc1O	388455787	ZYUVYYCPXONWTB-UHFFFAOYSA-N	239.315	1.452	10	20	BDCD	
O=C(c1cccc(O)c1O)N1CC(F)(F)C1	790920724	CORLKXFCRKVMFO-UHFFFAOYSA-N	229.182	1.189	10	20	BDCD	
C[C@H](NCCOCCO)c1ccc(F)cc1O	62745384	YGUSXYIWBWSOJB-VIFPVBQESA-N	243.278	1.191	10	20	BDCD	
C[C@@H](N[C@H](C)c1ccccc1O)C(=O)N(C)C	36794366	CQIVYBDWPLYURD-NXEZZACHSA-N	236.315	1.520	10	20	BDCD	
COCC1(C(=O)NCc2ccccc2O)CCC1	285392307	VEMLGFFABSYYJG-UHFFFAOYSA-N	249.310	1.825	10	20	BDCD	
CCCNC(=O)c1c(F)ccc(O)c1O	276730758	TUHUOZUBUCEVIK-UHFFFAOYSA-N	213.208	1.377	10	20	BDCD	
CC(=O)C(=O)COC(=O)CC(C)(C)C	808487543	BQAGHZKSVKLXSD-UHFFFAOYSA-N	200.234	1.124	10	20	BDCD	
C[C@H](NC(=O)c1cc(O)cs1)C(C)(C)O	829444744	BEJBKFJVQGJEDA-LURJTMIESA-N	229.301	1.343	10	20	BDCD	
C[C@@H]1CCCCN1NC(=O)c1cc(O)cs1	912142878	WLNLUPQVSPSMHW-MRVPVSSYSA-N	240.328	1.973	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCC[C@H](N)C1	843047331	LVDJSYJFNHSKBG-AWEZNQCLSA-N	247.386	1.984	10	20	BDCD	
O=C(NCc1ccoc1)NCc1ccccc1O	748460215	LMXUEVPUFDWEMP-UHFFFAOYSA-N	246.266	1.985	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)NCC2CC2)c1	858116771	XEPZNIUGOPJSEK-UHFFFAOYSA-N	234.299	1.910	10	20	BDCD	
COC1(C)CN(C(=O)c2cc(O)cs2)C1	758431782	JXBMNFVGWKHUDD-UHFFFAOYSA-N	227.285	1.315	10	20	BDCD	
CC(C)Nc1ccccc1NCc1nnnn1C	871847366	QBHXSVDGNDXFMJ-UHFFFAOYSA-N	246.318	1.643	10	20	BDCD	
CCN(C)S(=O)(=O)Nc1ccc(O)c(C)c1	271942681	MMHFBRPESPJORL-UHFFFAOYSA-N	244.316	1.309	10	20	BDCD	
C[C@@H]1c2nncn2CCN1Cc1ccc(N)cc1	1120268200	BVFGFZWEHLJLOE-SNVBAGLBSA-N	243.314	1.437	10	20	BDCD	
O=C(NC[C@H]1CC[C@H](O)C1)c1cc(O)cs1	789918810	VZCAUPSGDSYKIV-YUMQZZPRSA-N	241.312	1.345	10	20	BDCD	
COC[C@@H]1CN(c2ccc(N)cc2)C[C@@H]1C	409433593	YOKRXZNNSLJWBG-QWRGUYRKSA-N	220.316	1.988	10	20	BDCD	
C=CC(=O)NCCCSc1nccs1	1335316298	ANXHOQNCYYKZNU-UHFFFAOYSA-N	228.342	1.928	10	20	BDCD	
C[C@H](N[C@H](C)C[S@@](C)=O)c1ccccc1O	164490576	LAYSUMWEBRFCOO-LSYCYVAJSA-N	241.356	1.810	10	20	BDCD	
C[C@@H](N)[C@@H]1CCN(Cc2ccccc2O)C1	168514947	KXMIPCKVRURRCB-GHMZBOCLSA-N	220.316	1.561	10	20	BDCD	
C[C@H](CNCc1ccc(N(C)C)cc1)C(=O)O	848638146	PJRVOLJRKNMRLR-SNVBAGLBSA-N	236.315	1.563	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCCNCC1	846676873	JWQULDXWRSFHNC-NSHDSACASA-N	248.326	1.398	10	20	BDCD	
CN(C)C(=O)CCN[C@H]1CCc2cccc(O)c21	297542542	FELINGIBGLXNNQ-NSHDSACASA-N	248.326	1.447	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@H](CO)C2)cc1	923008614	ROPONDRHRBJZHK-JOCQHMNTSA-N	234.343	1.613	10	20	BDCD	
CCC[C@H](O)CNCc1ccc2c(c1)CCO2	112377513	VACOVZHJTMNAQL-ZDUSSCGKSA-N	235.327	1.872	10	20	BDCD	
CNCC1CCN(Cc2ccccc2O)CC1	63158970	WVCDJHIQVDBMEW-UHFFFAOYSA-N	234.343	1.824	10	20	BDCD	
O=C(NCc1ccccc1O)[C@H]1CCCS1	127991258	RKCYXTHSFLOTOC-LLVKDONJSA-N	237.324	1.904	10	20	BDCD	
Cc1ccc(O)c(CN[C@@]2(C)CCOC2=O)c1	289840670	OXQACPOZKJRCRW-ZDUSSCGKSA-N	235.283	1.496	10	20	BDCD	
C[C@H](N[C@H]1CCCNC1)c1cc(F)ccc1O	817940482	ICLBGZVTQSBFHF-ONGXEEELSA-N	238.306	1.934	10	20	BDCD	
Cc1cccc(CN[C@@H]2CCNC2)c1O	841045632	ZWYXNAGDOWFGML-LLVKDONJSA-N	206.289	1.152	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)CN)cc1C	841060189	SJSIAVBQSAWRRJ-SNVBAGLBSA-N	208.305	1.446	10	20	BDCD	
NC[C@H]1CCCN(Cc2cccc(F)c2O)C1	843046926	FMUKHBMASMQTNV-SNVBAGLBSA-N	238.306	1.702	10	20	BDCD	
Cc1cccc(CN2C[C@H]3CNC[C@@H]3C2)c1O	775747939	PAXXTTJBRJZWOI-CHWSQXEVSA-N	232.327	1.352	10	20	BDCD	
Nc1ccc(CN[C@H]2CCCNCC2)cc1	1120269704	ZJIZDJFDUXNREN-ZDUSSCGKSA-N	219.332	1.501	10	20	BDCD	
COCCN(C)Cc1ccc(N(C)C)cc1	53401441	RBNUCZUYQMPDJG-UHFFFAOYSA-N	222.332	1.831	10	20	BDCD	
CC(C)(CC(=O)O)NCc1ccc2c(c1)CCO2	736317231	NAVMPITULVQCEU-UHFFFAOYSA-N	249.310	1.964	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCOC[C@H]2CCCC[C@H]21	409435102	SIQVMTCUWUSCED-NXEZZACHSA-N	238.291	1.714	10	20	BDCD	
CCCN(Cc1ccccc1O)C[C@@H](C)O	194949261	DGHLEDRPVCJGIE-LLVKDONJSA-N	223.316	1.985	10	20	BDCD	
CC(C)c1ccc(O)c(CN[C@@H]2[C@@H]3C[C@@H]2CN3)c1	1575858196	BLLIJANOTQQHGA-IPYPFGDCSA-N	246.354	1.966	10	20	BDCD	
OCCCCCNCc1cc(F)cc(F)c1O	708484326	GQCGORDLUUBPFB-UHFFFAOYSA-N	245.269	1.923	10	20	BDCD	
CN(C(=O)[C@@H]1[C@H]2CCCO[C@H]21)c1ccc(N)cc1	1122095005	VZNYPQRURGJJLH-JHJVBQTASA-N	246.310	1.657	10	20	BDCD	
OC[C@@H]1CCN(Cc2cccc(Cl)c2O)C1	132499683	AAZUEZRNNUAJGC-SECBINFHSA-N	241.718	1.860	10	20	BDCD	
C[C@@H](CN)N(C)Cc1c(O)cccc1Cl	383024997	XWUDLWNPJJUFAI-QMMMGPOBSA-N	228.723	1.825	10	20	BDCD	
CC[C@H](C)OCC(=O)NCc1ccc(N)cc1	297239899	PTBYXMHJEVTNHG-JTQLQIEISA-N	236.315	1.700	10	20	BDCD	
CO[C@H](C)[C@@H](C)NC(=O)c1cc(O)cs1	812349773	SNAYXMMVAOVXOZ-RNFRBKRXSA-N	229.301	1.607	10	20	BDCD	
CCC(=O)N[C@H](C)C(=O)Nc1ccc(N)cc1	818556357	OBDZTTNHYKRAMP-MRVPVSSYSA-N	235.287	1.122	10	20	BDCD	
N[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1	843044730	GKTKVXAQNONLFJ-SECBINFHSA-N	244.697	1.718	10	20	BDCD	
CN(CCCO)Cc1cc(F)cc(F)c1O	894662109	FLMWLQUDGWLKQT-UHFFFAOYSA-N	231.242	1.485	10	20	BDCD	
C[C@H]1C[C@@H]1C(=O)NCc1ccc(N)cc1	37666213	FVFXTUYJYHSRIN-KWQFWETISA-N	204.273	1.541	10	20	BDCD	
C[C@@H](N)CN(C)Cc1ccc(N(C)C)cc1	393804186	VFYXZCDJSKRHJN-LLVKDONJSA-N	221.348	1.532	10	20	BDCD	
Nc1ccc(NC(=O)C[C@H]2COC(=O)C2)cc1	1345597542	PCHSZDVUYRXKRF-MRVPVSSYSA-N	234.255	1.161	10	20	BDCD	
C[C@H]1C[C@H]1CNC(=O)NCc1ccc(N)cc1	1346191591	OESOVZTXCSDJNQ-ONGXEEELSA-N	233.315	1.724	10	20	BDCD	
CNCCCN(C)Cc1c(O)cccc1OC	841103444	IALBHPXPGCVHCF-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
COC[C@@H](C)C(=O)Nc1ccc(N)cc1	237159549	FIHGSZRKSGRFED-MRVPVSSYSA-N	208.261	1.490	10	20	BDCD	
CO[C@@H](C)CN(C)c1ccc2c(c1)OCO2	182365633	GZYPFMMDXMXICU-VIFPVBQESA-N	223.272	1.886	10	20	BDCD	
COc1ccc(N(C)CCOCCO)cc1	49971028	BKDUCBBPYSKXGL-UHFFFAOYSA-N	225.288	1.140	10	20	BDCD	
Nc1ccc(CNC[C@@H]2CCCCO2)cc1	42825297	JLZUPUMLLOIWIK-ZDUSSCGKSA-N	220.316	1.928	10	20	BDCD	
C[C@H](N[C@H](C(=O)O)C1CC1)c1ccccc1O	86758336	ZCRNNBVYGBTDSN-UFBFGSQYSA-N	235.283	1.906	10	20	BDCD	
C[C@@H]1CC[C@H](CNC(=O)c2cc(O)cs2)O1	839791599	DEHAPOMTVKVZJX-VXNVDRBHSA-N	241.312	1.751	10	20	BDCD	
O=C(O)[C@@H](C(=O)NCc1ccccc1O)C1CC1	852942563	KBOHDPXKFASPDM-LLVKDONJSA-N	249.266	1.119	10	20	BDCD	
CC[C@H](NCc1c(C)cccc1O)[C@@H](C)O	877569078	ZJOJPWFWQPXVHP-PWSUYJOCSA-N	223.316	1.950	10	20	BDCD	
O=C(NCc1ccc(O)c(O)c1)[C@H]1CC12CCC2	778918280	KDLPGMRLIBLLJD-SNVBAGLBSA-N	247.294	1.904	10	20	BDCD	
CCO[C@@H]1CN(CCN=[N+]=[N-])C[C@H]1OC	409435870	XAJJCDFTJKYKIA-RKDXNWHRSA-N	214.269	1.032	10	20	BDCD	
CN(Cc1ccon1)C(=O)c1cccc(O)c1O	706403515	SSRSPGSMPZFNKF-UHFFFAOYSA-N	248.238	1.358	10	20	BDCD	
O=C(NC[C@@H]1CCOC1)c1cc(O)cs1	1333805718	OIZDFIIIJVERCQ-ZETCQYMHSA-N	227.285	1.220	10	20	BDCD	
CC(C)[C@H](C(=O)NCc1ccc(N)cc1)[C@@H](C)N	1515331485	FFDFRQPUJDECCT-MFKMUULPSA-N	249.358	1.504	10	20	BDCD	
CN(C)c1ccc(CNC(=O)NC2CC2)cc1	31726652	CLLKRZFNHCJGGX-UHFFFAOYSA-N	233.315	1.714	10	20	BDCD	
CN(Cc1nnc[nH]1)Cc1cc(F)ccc1O	180174563	MNRCOZKUINDFPX-UHFFFAOYSA-N	236.250	1.281	10	20	BDCD	
CC[C@@](C)(O)CNCc1ccccc1O	82506004	MXLXQOKLFZVNPN-GFCCVEGCSA-N	209.289	1.643	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)C[C@@H](C)N1	220137310	LEZPBNOSARMKRZ-AOOOYVTPSA-N	238.306	1.714	10	20	BDCD	
CCOc1ccc(N(CC)CCO)cc1	267170580	UQPTZGUTLQQREB-UHFFFAOYSA-N	209.289	1.904	10	20	BDCD	
C[C@@H](NCc1cccc(F)c1O)C(=O)O	165158196	IGMKWQABMKOBKO-ZCFIWIBFSA-N	213.208	1.094	10	20	BDCD	
CC[C@@H](O)CNCCCSc1nccs1	819062428	DJMBZSAUDNNXEH-SECBINFHSA-N	246.401	1.986	10	20	BDCD	
O=C(N[C@H](C(=O)O)C1CC1)c1cc(O)cs1	833123181	IXWYMDIMBYUWOD-QMMMGPOBSA-N	241.268	1.047	10	20	BDCD	
Cc1ccc(C(=O)NCc2ncc[nH]2)c(O)c1O	770489885	CSYPYYCMRBKHHU-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
CNCc1cn(Cc2ccc(N(C)C)cc2)nn1	881272520	YOHUMAARRSYMBS-UHFFFAOYSA-N	245.330	1.112	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CCO[C@H]3C[C@H]32)c1	793620588	WZYJIWTYZQWTJF-OLZOCXBDSA-N	233.311	1.982	10	20	BDCD	
C[C@@H](NC(=O)[C@H](N)C1CCC1)c1ccccc1O	870988561	SNMSONWTUKBZNJ-NOZJJQNGSA-N	248.326	1.697	10	20	BDCD	
CC[C@@H](CO)NCc1cccc(C)c1O	83345885	UYJRLGQFXMVXBF-NSHDSACASA-N	209.289	1.561	10	20	BDCD	
CN(Cc1ncc[nH]1)Cc1ccccc1O	111235372	XXVKREPDJSFXIG-UHFFFAOYSA-N	217.272	1.747	10	20	BDCD	
O=C(c1cccc(O)c1O)N1[C@H]2CC[C@H]1COC2	695052963	AILYGZBVYKZSBJ-IUCAKERBSA-N	249.266	1.101	10	20	BDCD	
CC(C)(N)CC(=O)NCc1ccccc1O	162966618	NOWPCBNPIKJGSV-UHFFFAOYSA-N	222.288	1.136	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)c1nccs1	237062879	IEGJFHFNKYDHGQ-UHFFFAOYSA-N	247.323	1.931	10	20	BDCD	
NC[C@@H]1CCCN(Cc2cc(F)ccc2O)C1	219733602	VAYMPJVOXRVFIO-JTQLQIEISA-N	238.306	1.702	10	20	BDCD	
O=C1NCCCC[C@H]1Sc1nccs1	48875569	MABZBMPEARVQQI-SSDOTTSWSA-N	228.342	1.904	10	20	BDCD	
C[C@@H](NC[C@H]1COCCN1)c1ccccc1O	530218583	CVRWBYJEPWMBMJ-MNOVXSKESA-N	236.315	1.031	10	20	BDCD	
C[C@@H](CN)N(C)Cc1ccc(N(C)C)cc1	382973149	HBDCMDUNTCSMBS-NSHDSACASA-N	221.348	1.532	10	20	BDCD	
CC[C@@H](C(=O)NCc1ccccc1O)N(C)C	269138053	KYBBCXDIAQQXLN-NSHDSACASA-N	236.315	1.349	10	20	BDCD	
CN(C)C/C=C/C(=O)NCc1ccccc1O	269149866	PKVIMSTUTXFXME-VMPITWQZSA-N	234.299	1.126	10	20	BDCD	
O=S1(=O)CC[C@H](CSc2nccs2)C1	278576236	CXYFPASELFHXAT-SSDOTTSWSA-N	249.382	1.670	10	20	BDCD	
CCC[C@H](OC)C(=O)NCc1ccccc1O	294792850	DJUDTVSXPSEQPL-LBPRGKRZSA-N	237.299	1.824	10	20	BDCD	
CC(=O)C(=O)COC(=O)CCc1cccc(C)c1	808493061	QCICDKJUTLHKRB-UHFFFAOYSA-N	248.278	1.629	10	20	BDCD	
C[C@H]1C[C@@H](CO)CN(Cc2ccccc2O)C1	817412729	ONBBIHFUUTWYID-NWDGAFQWSA-N	235.327	1.843	10	20	BDCD	
CC[C@H](NCCNC)c1ccccc1O	817952231	OOWYECGDXMHXCP-NSHDSACASA-N	208.305	1.652	10	20	BDCD	
CCN[C@H](C)CN[C@H]1CCc2cccc(O)c21	817974066	XSCMLULMJMVESA-PWSUYJOCSA-N	234.343	1.967	10	20	BDCD	
CCOc1ccc(O)c(CN(C)CCNC)c1	843057689	RGFPGIGNCDOHJX-UHFFFAOYSA-N	238.331	1.442	10	20	BDCD	
Cc1ccc(CN2CCN(C)C(=O)[C@H]2C)c(O)c1	877433083	ITQODYASIFJGQI-LLVKDONJSA-N	248.326	1.363	10	20	BDCD	
OCCN(Cc1cc(F)ccc1O)CC1CC1	778999783	QVWAOQIHDZDPII-UHFFFAOYSA-N	239.290	1.736	10	20	BDCD	
COCCOC(=O)NCc1cc(C)ccc1O	885319686	SYCIJQDDHUGKQL-UHFFFAOYSA-N	239.271	1.573	10	20	BDCD	
CCOC(=O)[C@H](C)N[C@H](C)c1ccccc1O	49368738	HRXSUWAXZYXWAL-ZJUUUORDSA-N	237.299	1.994	10	20	BDCD	
NC(=O)C1CCN(Cc2ccccc2O)CC1	84847087	WXMGARHXHXPUGE-UHFFFAOYSA-N	234.299	1.090	10	20	BDCD	
COC[C@@H]1CN(C(=O)CN=[N+]=[N-])CC12CCC2	409427923	FUKATKRMOLFLCS-VIFPVBQESA-N	238.291	1.572	10	20	BDCD	
COc1cccc(CN[C@@H](C)[C@@H](C)OC)c1O	189106814	HKNJXTOKHNKFBH-VHSXEESVSA-N	239.315	1.914	10	20	BDCD	
Cc1cc(Cl)cc([C@@H](C)NCCO)c1O	309115180	LGSHPHFRIOKRFP-MRVPVSSYSA-N	229.707	1.997	10	20	BDCD	
Oc1ccccc1CN1CC[C@H]2NCC[C@@H]2C1	383862452	ODYOVAZMJFDTFD-DGCLKSJQSA-N	232.327	1.576	10	20	BDCD	
Nc1ccc(CN2CCCC[C@@H]2C(=O)O)cc1	1601216397	ZIHWTGCTRFANIY-GFCCVEGCSA-N	234.299	1.708	10	20	BDCD	
COc1cc(NCc2ccccc2O)ncn1	228428393	SWDMOCXFXNGAQE-UHFFFAOYSA-N	231.255	1.803	10	20	BDCD	
CCNC(=O)CCN[C@H](C)c1ccccc1O	135719798	YDHYUKLZLLBUBD-SNVBAGLBSA-N	236.315	1.569	10	20	BDCD	
CNC(=O)CN(C)c1ccc(OC(C)C)cc1	191582103	CXQSCROFRLFHOX-UHFFFAOYSA-N	236.315	1.656	10	20	BDCD	
Nc1ccc(OCc2cn(CCF)nn2)cc1	864628852	QOSGOLJOQRKQQK-UHFFFAOYSA-N	236.250	1.409	10	20	BDCD	
CO[C@@](C)(C(=O)NCc1ccccc1O)C1CC1	292238354	GEIRLDFQQSMZAO-CQSZACIVSA-N	249.310	1.824	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@@H](C)CN)c1	817970512	YBJFFPQBBAMXQT-VHSXEESVSA-N	208.305	1.698	10	20	BDCD	
O=C(NCC1CCOCC1)c1cc(O)cs1	732281535	OBMYJWUUVVKNSE-UHFFFAOYSA-N	241.312	1.610	10	20	BDCD	
CCC[C@@](C)(CO)NC(=O)c1cc(O)cs1	831816935	LYWHQEHQPFDVTA-NSHDSACASA-N	243.328	1.735	10	20	BDCD	
N[C@H]1CCC[C@@H](NCc2cc(F)ccc2O)C1	841058200	QKQSOEKQXVBMKY-NWDGAFQWSA-N	238.306	1.891	10	20	BDCD	
O=C(Nc1cnns1)c1cc(O)cs1	789910749	KVKFRCZGSFHSQI-UHFFFAOYSA-N	227.270	1.558	10	20	BDCD	
CC[C@H](F)C(=O)N(C)c1ccc(N)cc1	1122174121	NOQUASYVXDOZTE-JTQLQIEISA-N	210.252	1.980	10	20	BDCD	
CO[C@H]1CN(Cc2cc(F)ccc2O)CCO1	895969044	VUBNUMIJOISOKD-GFCCVEGCSA-N	241.262	1.336	10	20	BDCD	
O=C(Nc1cc[nH]n1)c1c(F)ccc(O)c1O	790069726	PRGGFSMMZMKFMN-UHFFFAOYSA-N	237.190	1.212	10	20	BDCD	
C[C@@H](O)COC(=O)/C=C\c1ccc(O)c(O)c1	792039749	GEIBBGKKKXKFEQ-QIUOEGRZSA-N	238.239	1.035	10	20	BDCD	
COc1ccc(CNC(=O)c2cc[nH]n2)c(O)c1	794378177	YEIUMSNYJIGVSA-UHFFFAOYSA-N	247.254	1.054	10	20	BDCD	
O=C(O)CCCNCc1ccccc1O	37417562	JUFLWPXDUFFPCJ-UHFFFAOYSA-N	209.245	1.347	10	20	BDCD	
COCCN(CCN=[N+]=[N-])C1CCOCC1	409433339	MPIXMGLFCZBPQA-UHFFFAOYSA-N	228.296	1.424	10	20	BDCD	
CCO[C@H]1C[C@H]1C(=O)NCc1ccc(N)cc1	689957553	QVANATAMSBNORS-NEPJUHHUSA-N	234.299	1.310	10	20	BDCD	
Cc1ccc(O)c(CNCC2(C(=O)O)CC2)c1	1600464421	BPXMYCMCFVEHNZ-UHFFFAOYSA-N	235.283	1.655	10	20	BDCD	
CCn1ccnc1/C=C\c1cnc(C(=O)O)cn1	1777011986	FGDMXARXLHZNCB-ARJAWSKDSA-N	244.254	1.562	10	20	BDCD	
CCN(C(=O)c1cccc(O)c1O)C(C)C	163269742	PVPBADOWFAHDEP-UHFFFAOYSA-N	223.272	1.968	10	20	BDCD	
CCN1C[C@H](NCc2ccccc2O)CC1=O	391480876	OHPKUMSAWBDMHJ-LLVKDONJSA-N	234.299	1.103	10	20	BDCD	
Oc1c(F)cc(F)cc1CN[C@@H]1CC[C@H]1O	883150643	OVLYBUCVSMMTKP-NXEZZACHSA-N	229.226	1.283	10	20	BDCD	
C[C@@H](NCCOCC(=O)O)c1ccccc1O	1589128189	BTOYNRZQVHJEPA-SECBINFHSA-N	239.271	1.144	10	20	BDCD	
CCc1nn(C)cc1CNCc1ccccc1O	124020564	BFHUWDUGXPKNBE-UHFFFAOYSA-N	245.326	1.978	10	20	BDCD	
C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(N)=O	37261359	BWNVFQBCNIUVPK-ZJUUUORDSA-N	235.331	1.277	10	20	BDCD	
CN(Cc1cnnn1C)c1ccc2c(c1)OCO2	272528961	MQAVKDWHBIRRBZ-UHFFFAOYSA-N	246.270	1.180	10	20	BDCD	
Cc1cc(C)c([C@@H](C)NCCO)c(O)c1	293916139	XDVKWMQMQOXIMD-SNVBAGLBSA-N	209.289	1.652	10	20	BDCD	
CO[C@@H](C)[C@H](C)NCCc1ccc(N)cc1	817956322	WJAPVKXGDPGUNU-QWRGUYRKSA-N	222.332	1.824	10	20	BDCD	
CC[C@@H](N)CN[C@@H](C)c1ccccc1O	817979266	JFSCAKVVELTULP-VHSXEESVSA-N	208.305	1.780	10	20	BDCD	
C[C@@H](N[C@@H](CO)CCF)c1ccc(F)cc1O	846209237	PSFJOTYKKADFFM-PSASIEDQSA-N	245.269	1.902	10	20	BDCD	
Oc1c(F)cc(Cl)cc1CN[C@@H]1CCNC1	841045288	RTGQZJGWHHTFKJ-SECBINFHSA-N	244.697	1.636	10	20	BDCD	
C[C@H]1NCCC[C@@H]1NCCc1ccc(N)cc1	925689554	BXKNOEXKDGFNJK-RISCZKNCSA-N	233.359	1.541	10	20	BDCD	
O=C(NCc1ccccc1O)Nc1ccon1	757850887	GAUKITOYEMTXHJ-UHFFFAOYSA-N	233.227	1.702	10	20	BDCD	
CCOC[C@@H](O)CN(C)c1ccc(N)cc1	702126398	NZJRMUVGGXLVIM-LBPRGKRZSA-N	224.304	1.102	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@H]1C[C@@H](O)C1)CC2	720991739	IMZKOUDRTPHHKO-WCQGTBRESA-N	233.311	1.740	10	20	BDCD	
CC(=O)NCCCN[C@H]1CCc2cccc(O)c21	296144000	WJNXUPUFHKIXHL-LBPRGKRZSA-N	248.326	1.495	10	20	BDCD	
CC[C@@H](NCc1ccc2c(c1)CCO2)[C@@H](C)O	386857610	JBHXACFPALARIC-ZWNOBZJWSA-N	235.327	1.871	10	20	BDCD	
CC(C)NC(=O)CNCc1ccccc1O	36781509	PBJBOPWAXYCMOE-UHFFFAOYSA-N	222.288	1.006	10	20	BDCD	
Cc1cccc(CN2CC[C@H](O)C2)c1O	132492013	DHQPWWPBARCWJI-NSHDSACASA-N	207.273	1.267	10	20	BDCD	
CN(C)c1ccc(OCC(=O)NCC2CC2)cc1	277886082	QBLOWHGQJBEUFP-UHFFFAOYSA-N	248.326	1.658	10	20	BDCD	
CC(=O)C(=O)CSc1nncn1C(C)(C)C	808021406	LVERSXGBAAUBPY-UHFFFAOYSA-N	241.316	1.283	10	20	BDCD	
CC[C@H](CNCc1cccc(C)c1O)C(=O)O	903705351	KUNGDGHVBFDCCT-SNVBAGLBSA-N	237.299	1.901	10	20	BDCD	
COc1ccc(O)c(CN2CC(C)(OC)C2)c1	839101232	LBOWGEFKAUECDO-UHFFFAOYSA-N	237.299	1.622	10	20	BDCD	
COc1ccc(CNC2(C(=O)O)CC2)cc1C	841794515	HZERNWJKTXEKFX-UHFFFAOYSA-N	235.283	1.710	10	20	BDCD	
CN(C)c1cc(F)c(CNCCO)cc1F	858088647	MYMHQCRLNFHJIN-UHFFFAOYSA-N	230.258	1.113	10	20	BDCD	
Oc1cc2c(cc1CN1C[C@H]3C[C@H]3C1)OCO2	862440000	DCRHELDULOQMAF-DTORHVGOSA-N	233.267	1.573	10	20	BDCD	
C[C@@H](CNCc1ccccc1O)N(C)C	38088756	IMETWNOLLUKPIG-JTQLQIEISA-N	208.305	1.432	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@H](C(F)(F)F)C1	409425438	FVQKHYKXLRBXMJ-YFKPBYRVSA-N	222.170	1.708	10	20	BDCD	
Cc1cccc(CN[C@@H]2COC[C@@H]2C)c1O	710997362	HLRWBJGEOAMDLB-CMPLNLGQSA-N	221.300	1.825	10	20	BDCD	
CCOc1ccc(O)c(CN2CCOCC2)c1	154511145	VPGDGVXTVYVHAN-UHFFFAOYSA-N	237.299	1.623	10	20	BDCD	
N[C@@H]1CCC[C@H]1NCc1ccc2c(c1)CCO2	259024258	OGXBHZJNOYARLE-CHWSQXEVSA-N	232.327	1.591	10	20	BDCD	
NCc1ccc2c(c1)CCCN2C[C@@H]1CCOC1	400561279	LXBLWIQNHXUXIY-ZDUSSCGKSA-N	246.354	1.934	10	20	BDCD	
Cc1cccc(CNCC[C@H](O)C2CC2)c1O	898202146	DTNITSVJNZSPFA-ZDUSSCGKSA-N	235.327	1.951	10	20	BDCD	
CCN(CC)Cc1cc2c(cc1O)OCO2	13982	CYSCVKUICDKDAJ-UHFFFAOYSA-N	223.272	1.963	10	20	BDCD	
CC[C@@](C)(O)CNCc1cc(F)ccc1O	180425022	STJAIKVZDFSFTA-GFCCVEGCSA-N	227.279	1.782	10	20	BDCD	
C[C@H]1CNCCN1Cc1cc(Cl)ccc1O	83368873	AESBLMFNBKDVMY-VIFPVBQESA-N	240.734	1.839	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)CN(C)C)c1	130318820	HOXVYAVUQHOXJN-NSHDSACASA-N	222.332	1.740	10	20	BDCD	
CC[C@@H](O)CN[C@H](C)c1cc(F)ccc1O	229970519	ATUQDPYVNRMQIP-PSASIEDQSA-N	227.279	1.953	10	20	BDCD	
Cc1cccc(CN2CCOC[C@@H]2C)c1O	162813506	HLSLAWRMBLJUNJ-NSHDSACASA-N	221.300	1.921	10	20	BDCD	
CC(=O)C(=O)CSc1nc(C)c(C)c(O)n1	808031978	RBIPHTSITIBEQO-UHFFFAOYSA-N	240.284	1.049	10	20	BDCD	
CC(=O)C(=O)COc1ccccc1Cl	808012549	NRPMRAYAGFOCBK-UHFFFAOYSA-N	212.632	1.877	10	20	BDCD	
CC[C@H](CO)N(C)Cc1cc(F)ccc1O	824533275	COGCNRULADXUIM-LLVKDONJSA-N	227.279	1.734	10	20	BDCD	
CN(C)C1(C(=O)Nc2ccc(N)cc2)CC1	911659541	BRJZTATXPHZJDA-UHFFFAOYSA-N	219.288	1.302	10	20	BDCD	
CC[C@H](N)CNCc1cc(F)ccc1O	841072587	QOVDBSMWMFGKLU-JTQLQIEISA-N	212.268	1.358	10	20	BDCD	
COCCN[C@@H](C)c1cccc(OC)c1O	846135647	FIRJHWQHXVWSNS-VIFPVBQESA-N	225.288	1.698	10	20	BDCD	
Cc1ccc(C(=O)N(C)CCCF)c(O)c1O	925544251	YWNOBEOABMZRIZ-UHFFFAOYSA-N	241.262	1.838	10	20	BDCD	
COc1ccc(N(C)Cc2cnon2)cc1OC	851734707	LAWBROLSMOHNQS-UHFFFAOYSA-N	249.270	1.723	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)N[C@@H]2COC[C@@H]2O)c1	866421048	VGJXPMAPCXAGSA-XWIASGKRSA-N	237.299	1.111	10	20	BDCD	
CNC(=O)[C@H]1CCC[C@@H]1NCc1ccccc1O	765794967	GOLGTKMDZJJSCX-RYUDHWBXSA-N	248.326	1.397	10	20	BDCD	
Cc1ccc(CN(C)[C@@H]2CCN(C)C2=O)c(O)c1	876754596	UDEYTJKBFASBEZ-GFCCVEGCSA-N	248.326	1.363	10	20	BDCD	
Cc1ccc(CN[C@@H]2C[C@H](O)C2(C)C)c(O)c1	877430719	POQAZVNFQOALQQ-OLZOCXBDSA-N	235.327	1.950	10	20	BDCD	
CO[C@H]1CCC[C@H]1C(=O)NCc1ccc(N)cc1	1263303745	HCEFYZBCNKIVQU-OLZOCXBDSA-N	248.326	1.700	10	20	BDCD	
O=C(CCC1CC1)NCc1cccc(O)c1O	1348049188	ZSNMCWKXOWPGIT-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
Nc1ccc(NC(=O)Nc2cnn[nH]2)cc1	1580449365	JLEVEBYIPCCZLZ-UHFFFAOYSA-N	218.220	1.031	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@H](C)c1ccccc1O	163988512	JRLIEGIHMNPHAY-DTWKUNHWSA-N	222.288	1.307	10	20	BDCD	
COC[C@H](CO)N[C@@H](C)c1ccc(F)cc1O	234825142	BTGOLSAUKLMKSA-WPRPVWTQSA-N	243.278	1.189	10	20	BDCD	
Nc1ccc(CCNC(=O)C[C@@H]2CCOC2)cc1	401519634	NKBAQMLBRRGFBP-LBPRGKRZSA-N	248.326	1.354	10	20	BDCD	
COc1cccc(CN[C@H]2CCO[C@H]2C)c1O	134247293	AAENLCDLRXBGHD-ONGXEEELSA-N	237.299	1.668	10	20	BDCD	
O=S(=O)(Nc1ccc(O)cc1Cl)C1CC1	82879855	WRLCFTOXDWQMEF-UHFFFAOYSA-N	247.703	1.950	10	20	BDCD	
CN1CC[C@@H](NCc2cc(Cl)ccc2O)C1	42544498	QIGSEKBNJUVJMG-LLVKDONJSA-N	240.734	1.839	10	20	BDCD	
C[C@@H](NCCc1ccc(N)cc1)[C@H]1CCCCN1	817957441	MENXUNLKZZBCLJ-IUODEOHRSA-N	247.386	1.932	10	20	BDCD	
CC[C@](C)(CNC(=O)c1cc(O)cs1)OC	833798447	AHYFDKBNYOBAGP-LLVKDONJSA-N	243.328	1.999	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H](N)CC(F)F)cc1	832244013	FDZCZZCBFUYEEF-QMMMGPOBSA-N	229.230	1.190	10	20	BDCD	
CCOc1ccc(O)c(CN(C)C2CNC2)c1	843124729	LSTSXRYHSQZAQZ-UHFFFAOYSA-N	236.315	1.195	10	20	BDCD	
CCOc1ccc(O)c(CNC/C=C/CO)c1	850357527	MNURYDNZCLSPTH-ONEGZZNKSA-N	237.299	1.429	10	20	BDCD	
CCOc1ccc(CN(C)C[C@@H](C)N)c(O)c1	863650780	AAJINOMYKIDOOM-SNVBAGLBSA-N	238.331	1.570	10	20	BDCD	
Cc1ccc(CN[C@H](C)C[S@](C)=O)c(O)c1	877311334	VUJHZZQRXFOGIF-HWPZZCPQSA-N	241.356	1.557	10	20	BDCD	
Cc1ccc(CN(C)Cc2cn(C)nn2)c(O)c1	877630657	IGVMTGVPSSZOCB-UHFFFAOYSA-N	246.314	1.461	10	20	BDCD	
CC1(O)CN(Cc2cc(Cl)cc(F)c2O)C1	877581058	MDLRUVSQFSJDMP-UHFFFAOYSA-N	245.681	1.751	10	20	BDCD	
C/C=C/[C@H](O)C(=O)NCc1ccc(N(C)C)cc1	899982882	LGZIVXLNJXGSMY-IHVVCDCBSA-N	248.326	1.306	10	20	BDCD	
O=C(NOCC(F)F)c1cccc(O)c1O	790932895	JUULNEGTGIUIKT-UHFFFAOYSA-N	233.170	1.024	10	20	BDCD	
C[C@H](CN)N(C)Cc1cccc(F)c1O	309500762	UXAZAHKWMFDJRP-MRVPVSSYSA-N	212.268	1.310	10	20	BDCD	
CCN1C[C@H](N[C@H](C)c2ccccc2O)CC1=O	391595226	HINVPNHIUZEKSQ-GHMZBOCLSA-N	248.326	1.664	10	20	BDCD	
COC[C@H](O)CCNCc1cc(C)ccc1O	231607484	FTAHMQVLLOQYMZ-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
COCCN(C)Cc1ccc(N(C)C)c(F)c1	127126960	FUDVSNQPCDPROJ-UHFFFAOYSA-N	240.322	1.970	10	20	BDCD	
CNC(=O)NCc1ccc(N2CCCC2)cc1	42309492	PCODXDHQLRKEKY-UHFFFAOYSA-N	233.315	1.716	10	20	BDCD	
C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)O	49357084	PSWUROCAAJEDNB-ZJUUUORDSA-N	236.315	1.876	10	20	BDCD	
COc1cccc(CN2C[C@@H]3CNC[C@@H]3C2)c1O	90320512	FDVLGNMKQYNOFM-TXEJJXNPSA-N	248.326	1.052	10	20	BDCD	
CC(C)CN(C)C(=O)c1c(F)ccc(O)c1O	277325504	CNXMHQOTGVOCNX-UHFFFAOYSA-N	241.262	1.965	10	20	BDCD	
COc1ccc(N(C)C[C@H](O)CSC)cc1	844352678	BZLVMAYGEAKZBI-NSHDSACASA-N	241.356	1.855	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCN[C@@H]1C)c1ccccc1O	870988328	MTASIQKVRWDBFL-CKYFFXLPSA-N	248.326	1.567	10	20	BDCD	
CCN(CC)CCOC(=O)c1cc(O)cs1	772113088	HGXCZVHNYKLEEM-UHFFFAOYSA-N	243.328	1.952	10	20	BDCD	
CC1=NO[C@H](CNCc2ccc(C)cc2O)C1	895302965	XZFXGRXGLJFPSI-LBPRGKRZSA-N	234.299	1.955	10	20	BDCD	
CC(C)C(=O)NCCc1ccc(N)cc1	32011625	GOPQUJAHMICRJT-UHFFFAOYSA-N	206.289	1.584	10	20	BDCD	
Oc1cccc2c1[C@@H](NCCOCCF)CC2	705649285	HDXGQGXUNJQWHV-NSHDSACASA-N	239.290	1.955	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H]3NCC[C@@H]3C2)c1	381309974	CSJMYALGJNEVFZ-TZMCWYRMSA-N	246.354	1.884	10	20	BDCD	
C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1N	300049416	ROEUHOPQVGYQPW-LDYMZIIASA-N	240.734	1.825	10	20	BDCD	
CC[C@H](CO)NCc1c(O)cccc1Cl	83551244	YXIPEHFLIILDIW-MRVPVSSYSA-N	229.707	1.906	10	20	BDCD	
C[C@H](NCC(=O)NCC1CC1)c1ccccc1O	179889266	NPESWIYDZAPIFJ-JTQLQIEISA-N	248.326	1.569	10	20	BDCD	
O=C(NCc1ccc(O)cc1O)[C@@]12CCC[C@@H]1C2	822972479	UWOLFKYQHPMOFJ-QMTHXVAHSA-N	247.294	1.904	10	20	BDCD	
Cc1cccc(CN[C@H]2CCNC2)c1O	841045633	ZWYXNAGDOWFGML-NSHDSACASA-N	206.289	1.152	10	20	BDCD	
Oc1c(F)cccc1CN[C@H]1CCCNC1	841042616	LTHOSMCSECAYGJ-JTQLQIEISA-N	224.279	1.373	10	20	BDCD	
CNC(=O)[C@H]1CCC[C@H]1NCc1ccccc1O	765794966	GOLGTKMDZJJSCX-NWDGAFQWSA-N	248.326	1.397	10	20	BDCD	
CCn1ncnc1CNCc1c(C)cccc1O	877492359	WTZHRYZFKYGKKF-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
Cc1ccc(CN2CCC[C@@H](CO)C2)c(O)c1	876509728	HBHPYACLTUKSBM-GFCCVEGCSA-N	235.327	1.905	10	20	BDCD	
O[C@H](CCNCc1ccc2c(c1)CCO2)C1CC1	898206082	LJUCQNQXKSAGMS-CQSZACIVSA-N	247.338	1.872	10	20	BDCD	
O=C1[C@@H](Sc2nccs2)CCN1C1CC1	1319381748	XYHKDBNATMTFDL-QMMMGPOBSA-N	240.353	1.999	10	20	BDCD	
Nc1ccc(CN2[C@H]3CC[C@H]2CC(O)C3)cc1	104324640	JYCKQSUKMPIHHH-STQMWFEESA-N	232.327	1.757	10	20	BDCD	
CCCS(=O)(=O)NCc1cc(C)ccc1O	1329238643	LKDRLBQFFYVUFP-UHFFFAOYSA-N	243.328	1.530	10	20	BDCD	
CCn1ncnc1CNCc1cc(C)ccc1O	793345537	DHMUFLJQVJGVOV-UHFFFAOYSA-N	246.314	1.602	10	20	BDCD	
C[C@@H](N)[C@@H]1CCCCN1Cc1ccc(N)cc1	1356082910	HMAWKOXSCSYRIL-RISCZKNCSA-N	233.359	1.971	10	20	BDCD	
O=C(O)[C@@H](CF)NCc1ccc2c(c1)CCO2	1608534151	QVZPNPGNFGKLHU-SNVBAGLBSA-N	239.246	1.134	10	20	BDCD	
CC(F)(F)C(=O)NCCc1ccc(O)c(O)c1	289135418	GPAUJWVLQLUBES-UHFFFAOYSA-N	245.225	1.412	10	20	BDCD	
COC[C@H](O)CNCc1ccc(OC)c(C)c1	71269057	ALNJAYYZGGWEBA-GFCCVEGCSA-N	239.315	1.101	10	20	BDCD	
C[C@H]1CCN(C(=O)c2cc(O)cs2)C1	732283346	HOHUJMYTOWAUCT-ZETCQYMHSA-N	211.286	1.936	10	20	BDCD	
CC(C)[C@@H](O)COC(=O)c1cc(O)cs1	849728463	SMQLDQONRKGAAR-QMMMGPOBSA-N	230.285	1.627	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@@H](N)CC2CC2)cc1	884028909	VZHIMHPVLSEQRF-ZDUSSCGKSA-N	247.342	1.055	10	20	BDCD	
Oc1cc2c(cc1CNC/C=C\Cl)OCO2	898436967	XFJSEQWRPYJBHL-UPHRSURJSA-N	241.674	1.963	10	20	BDCD	
CC1(C(=O)NCc2ccc(N)cc2)CCOCC1	1356228456	ROBSLYUSAXKDDC-UHFFFAOYSA-N	248.326	1.702	10	20	BDCD	
[N-]=[N+]=NCCN1CCN(c2ccncc2)CC1	409425250	ACCMNMLWJMXCLR-UHFFFAOYSA-N	232.291	1.514	10	20	BDCD	
COC[C@@H](C)NCc1cc(F)cc(F)c1O	708435954	HCLKVYQSAYWRNR-SSDOTTSWSA-N	231.242	1.795	10	20	BDCD	
CC1(C)[C@@H](N)C[C@H]1NCc1cccc(F)c1O	1576380059	GHZHYDPRQFBPFX-WDEREUQCSA-N	238.306	1.747	10	20	BDCD	
CN1CCC(=O)[C@@H](Cc2ccc(N)cc2)C1	261508373	RUBXFMSRLAIOOE-NSHDSACASA-N	218.300	1.332	10	20	BDCD	
N[C@H]1CCC[C@H](NCc2ccccc2O)C1	162936547	YDQXZJVSTSZHGZ-RYUDHWBXSA-N	220.316	1.752	10	20	BDCD	
CN1CC[C@H]1CNCc1ccc2c(c1)CCCO2	922574359	KSEKXCLMBKUICT-AWEZNQCLSA-N	246.354	1.805	10	20	BDCD	
NCCCCNCc1cc(F)ccc1O	236210789	VUNGLZZEZLEWFM-UHFFFAOYSA-N	212.268	1.360	10	20	BDCD	
Nc1ccc(CCNC(=O)[C@H]2CCCOC2)cc1	62192957	BOFNXRJWDKIWHN-LBPRGKRZSA-N	248.326	1.354	10	20	BDCD	
NC(=O)NC(=O)CCCSc1nccs1	66256599	NKGHCSRQAZPPRF-UHFFFAOYSA-N	245.329	1.210	10	20	BDCD	
Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCN	37712540	UNBOJUXYLHSOOU-UWVGGRQHSA-N	220.316	1.797	10	20	BDCD	
Nc1ccc(CNC(=O)N2CCCC2)cc1	85960386	PHMRJLSJUQHURE-UHFFFAOYSA-N	219.288	1.574	10	20	BDCD	
Cc1cccc(CN2CC[C@](C)(C(N)=O)C2)c1O	235915524	TWCNCBVSUOYZBE-AWEZNQCLSA-N	248.326	1.398	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(C)cc1C	808487572	CKDABBKZUWKBKA-UHFFFAOYSA-N	234.251	1.618	10	20	BDCD	
C[C@H](N)CCN[C@H]1CCc2cccc(O)c21	817952342	JWCOFQFGKHQQRH-ONGXEEELSA-N	220.316	1.706	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H](C(=O)O)C2)cc1C	818849336	VYCYASDKZAHDOB-LLVKDONJSA-N	249.310	1.916	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCO[C@@H]2C[C@H]21	832634314	NHVJPIWNNXPASS-HTQZYQBOSA-N	225.269	1.067	10	20	BDCD	
C[C@H](N[C@H](CO)CCF)c1ccc(F)cc1O	846209243	PSFJOTYKKADFFM-WPRPVWTQSA-N	245.269	1.902	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CCNC2(C)C)c1	841085451	CQHUCOPUYZPXJP-CYBMUJFWSA-N	234.343	1.931	10	20	BDCD	
CCCN(C)c1ccc(OCC(=O)O)cc1	846279847	NWVBJCGZPKSXCM-UHFFFAOYSA-N	223.272	1.996	10	20	BDCD	
CNC[C@@H](C)N[C@H](C)c1ccc(C)cc1O	854232554	SKNSDZOCPDTFDI-GHMZBOCLSA-N	222.332	1.959	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCC(=O)O)c1	36723051	NUNCLHQRLMFIMK-ZETCQYMHSA-N	225.244	1.136	10	20	BDCD	
CC[C@H](F)C(=O)NCc1ccccc1O	1353616818	CWEHQKMSVFCUBS-VIFPVBQESA-N	211.236	1.757	10	20	BDCD	
C[C@H](O)CCNCc1cccc(Cl)c1O	162865032	QSWCCWFAYVVAJC-QMMMGPOBSA-N	229.707	1.906	10	20	BDCD	
Cc1cccc(O)c1CNC[C@H]1CCCN1C	876985692	MSIRUNSCHBAPHN-GFCCVEGCSA-N	234.343	1.884	10	20	BDCD	
Cc1ccc(O)c(CNC[C@](C)(O)C2CC2)c1	310132940	LBINZXHTPIDVSH-AWEZNQCLSA-N	235.327	1.951	10	20	BDCD	
C[C@H](N[C@H](C)c1ccccc1O)C(=O)NC1CC1	135718873	WGDJEZFLUWTWHE-ZJUUUORDSA-N	248.326	1.710	10	20	BDCD	
CC[C@@H](C)NC(=O)c1ccc(C)c(O)c1O	177658299	NBYBFWNUHXSCGR-MRVPVSSYSA-N	223.272	1.935	10	20	BDCD	
C[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@H]1O	230210000	ZISBYCKXKBSNHG-ZWNOBZJWSA-N	248.326	1.041	10	20	BDCD	
COc1ccnc(NCc2ccccc2O)n1	133739745	HKUHFVYWZGAZEL-UHFFFAOYSA-N	231.255	1.803	10	20	BDCD	
C[C@H]1C[C@@H](NCCO)c2c(O)ccc(F)c21	381259264	RNMDJPJGVGWXFE-IONNQARKSA-N	225.263	1.662	10	20	BDCD	
O=C(NCCn1cccc1)c1cccc(O)c1O	231296501	RQFXVABPFASGNO-UHFFFAOYSA-N	246.266	1.329	10	20	BDCD	
Oc1ccccc1CN1CCOCC(F)(F)C1	289996456	CRPHWBJKNHSGIX-UHFFFAOYSA-N	243.253	1.860	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CCC[C@H](N)C2)cc1	294779900	NSHMIMSSHGMWOI-KOLCDFICSA-N	233.315	1.725	10	20	BDCD	
CCNCCN[C@@H](C)c1ccc(C)cc1O	817951987	MMTDSDPECMJLBH-NSHDSACASA-N	222.332	1.961	10	20	BDCD	
NC(=O)CCNCCCSc1nccs1	819064212	UJESKTWPHCLMFF-UHFFFAOYSA-N	245.373	1.090	10	20	BDCD	
Cc1cc(C)c(O)c(CN(C)[C@@H](C)C(=O)O)c1	820967998	CJJXBSMSQBGEDA-JTQLQIEISA-N	237.299	1.914	10	20	BDCD	
CC[C@](C)(O)CNCc1c(O)cccc1OC	732229332	RGGGFYMBIOHCPL-ZDUSSCGKSA-N	239.315	1.651	10	20	BDCD	
Oc1c(F)cccc1CNC[C@@H]1CCCNC1	841032545	GOAIQEOKYUERPJ-SNVBAGLBSA-N	238.306	1.621	10	20	BDCD	
CC[C@@H]1OCC[C@H]1NC(=O)Nc1ccc(N)cc1	841299213	WUJSGVITGDNQJD-NEPJUHHUSA-N	249.314	1.958	10	20	BDCD	
Cc1cccc(CN2CC[C@@H]3NCC[C@H]3C2)c1O	843127259	PCQWBTMSVVHONB-JSGCOSHPSA-N	246.354	1.884	10	20	BDCD	
Cc1occc1C=C1C(=O)N(C)C(=O)N(C)C1=O	840729170	MITIIQXVNGZPMO-UHFFFAOYSA-N	248.238	1.022	10	20	BDCD	
CC[C@H](NCc1ccc(N(C)C)cc1)C(=O)NC	697851062	HCMAIPIEKPBCDK-ZDUSSCGKSA-N	249.358	1.367	10	20	BDCD	
CC[C@@H](C(=O)N(C)c1ccc(N)cc1)N(C)C	877074791	SGZGGMVSSCYVGI-LBPRGKRZSA-N	235.331	1.572	10	20	BDCD	
COc1cccc(O)c1CN1C[C@H](C)[C@@H](O)C1	897684683	VDMZRTZDZTXBSP-CABZTGNLSA-N	237.299	1.213	10	20	BDCD	
COC[C@H]1CCCN1C(=O)Cc1ccc(N)cc1	83904119	ALCCXGOUQCWKFH-CYBMUJFWSA-N	248.326	1.449	10	20	BDCD	
CC[C@H](CNCc1c(C)cccc1O)C(=O)O	1595167409	NQMLBDSHSSXGBY-SNVBAGLBSA-N	237.299	1.901	10	20	BDCD	
Oc1cccc2c1[C@@H](NCC1(O)CCC1)CC2	383723281	YTVJJMFAIBYCKJ-NSHDSACASA-N	233.311	1.884	10	20	BDCD	
C[C@@]1(CNCc2ccc(N)cc2)CCCO1	87255714	RIOAHTUTTUMUNK-ZDUSSCGKSA-N	220.316	1.928	10	20	BDCD	
C[C@H](CCN)NCc1ccc(N(C)C)cc1	220487223	CWAGDRJHWMUWLU-LLVKDONJSA-N	221.348	1.580	10	20	BDCD	
C[C@H]1CCN(Cc2cc(F)ccc2O)[C@@H]1CO	191182633	CYVDFJJFHIDGLN-JOYOIKCWSA-N	239.290	1.734	10	20	BDCD	
c1csc(SCCC2OCCO2)n1	163660466	RELIOFIFKXVWRS-UHFFFAOYSA-N	217.315	1.998	10	20	BDCD	
CN(Cc1cc(F)ccc1O)C(C)(C)C(=O)O	234281524	AQHDHDSIJCWPIV-UHFFFAOYSA-N	241.262	1.826	10	20	BDCD	
COC(=O)c1cnc(S[C@H](C)[C@H](C)O)s1	296375506	VYKGZKMLLNOUOV-NTSWFWBYSA-N	247.341	1.791	10	20	BDCD	
CNC[C@@H](C)NCc1ccc(N(C)C)cc1C	853250012	YBBCVULVJLRZLH-GFCCVEGCSA-N	235.375	1.759	10	20	BDCD	
Cc1cccc(O)c1CN[C@@H]1CO[C@@H](C)C1	877607927	OBFIIFDQGUOLJU-QWRGUYRKSA-N	221.300	1.968	10	20	BDCD	
CCC(=O)N[C@H](C)C(=O)N(C)c1ccc(N)cc1	877080651	LRDVCYBVDQSMSS-SECBINFHSA-N	249.314	1.146	10	20	BDCD	
CN(C(=O)C[C@@H]1CCNC1)c1ccc(N)cc1	877077930	WQPPNCOPHDMRAE-JTQLQIEISA-N	233.315	1.231	10	20	BDCD	
CN1CCCc2cc(CNC(=O)CCN)ccc21	169809198	VRZDEAVJXLVXKI-UHFFFAOYSA-N	247.342	1.034	10	20	BDCD	
[N-]=[N+]=NCCn1nc(-c2ccncc2)cc1N	409437440	GOLYMNKHLZBHMI-UHFFFAOYSA-N	229.247	1.838	10	20	BDCD	
COCCOCCC(=O)Nc1ccc(N)cc1	19394787	QQXWKJKGAVFSKE-UHFFFAOYSA-N	238.287	1.260	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2C[C@@H]3CC[C@@H]2O3)cc1	160422070	SIMNAKHLOLOVMA-TUAOUCFPSA-N	232.283	1.775	10	20	BDCD	
CC(C)[C@@H]1C[C@H]1NC(=O)c1cccc(O)c1O	838080178	NERRKQVWLJKIKQ-VHSXEESVSA-N	235.283	1.872	10	20	BDCD	
Oc1cc2c(cc1CN1CCO[C@@H]3C[C@H]31)OCO2	368313090	SOVQWRZILGRGEJ-MWLCHTKSSA-N	249.266	1.094	10	20	BDCD	
CCCc1nnc(SCC(=O)C(C)=O)o1	808024455	KHPBKBIVMORLHR-UHFFFAOYSA-N	228.273	1.272	10	20	BDCD	
CN(C)C(=O)CSc1ncc([N+](=O)[O-])s1	829531765	RPWNQRAEUBGZJW-UHFFFAOYSA-N	247.301	1.232	10	20	BDCD	
Cc1cc(O)c(CNCCCO)cc1Cl	825050212	PGOLUYHENLPMAB-UHFFFAOYSA-N	229.707	1.826	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CC[C@@H](CN)C2)c1	841085171	WBTPIRFYPQIGLQ-DGCLKSJQSA-N	234.343	1.918	10	20	BDCD	
C[C@@H](NNc1ccc(N)cc1)c1ncnn1C	1118506382	OJCIUGYGKUOWMI-MRVPVSSYSA-N	232.291	1.075	10	20	BDCD	
CN(C(=O)CC1(CN)CC1)c1ccc(N)cc1	877076578	RKBNYCUGTQGZFE-UHFFFAOYSA-N	233.315	1.361	10	20	BDCD	
CN(C)c1ccc(CNc2cc(N)ncn2)cc1	1326514336	MECNQNAAVABVQZ-UHFFFAOYSA-N	243.314	1.737	10	20	BDCD	
CCN=c1ccnc(Nc2ccc(N)cc2)[nH]1	409425782	BKMGBWFBAGJUFT-UHFFFAOYSA-N	229.287	1.656	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCCC(F)(F)C1	409424671	XJLAUQVCAHOAJW-UHFFFAOYSA-N	204.180	1.554	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@H]1CCCO1	708446128	ZMWUBLSIHCFXPV-SNVBAGLBSA-N	243.253	1.939	10	20	BDCD	
Nc1ccc(CC(=O)N2CCC[C@H](O)CC2)cc1	386271650	XKBAWEJPEQMRRN-ZDUSSCGKSA-N	248.326	1.185	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](O)C(F)(F)F)c1	226646635	OTOAGTMUTJZYCL-SNVBAGLBSA-N	249.232	1.713	10	20	BDCD	
NC1CCN(Cc2cc(Cl)ccc2O)CC1	20521450	BLUADVYMBGQCLW-UHFFFAOYSA-N	240.734	1.969	10	20	BDCD	
C[C@@H]1C[C@@H](CN)CN1Cc1ccccc1O	126770143	DGUZVOCCOSGBTH-MNOVXSKESA-N	220.316	1.561	10	20	BDCD	
CC(C)C[C@@H](CO)NCc1ccccc1O	40773561	UEAXEJFRXDNORT-LBPRGKRZSA-N	223.316	1.889	10	20	BDCD	
COc1cccc(CN(C)CCCN)c1O	227742032	FULWICNZUBDQNZ-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)CCCO)c1	94942655	BSDFBTAKMCZZMQ-SNVBAGLBSA-N	239.315	1.651	10	20	BDCD	
O=C1NC(=S)S/C1=C\c1cncs1	255733953	SRGZDGRNAGHVDP-KTAJNNJTSA-N	228.323	1.632	10	20	BDCD	
COc1ccc(O)c([C@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c1	817978192	XYIVZXFHGNSNBC-HDRXNWCYSA-N	248.326	1.269	10	20	BDCD	
NC[C@H]1CCN(Cc2cccc(Cl)c2O)C1	843048428	TVQXNXRGIKNDEF-SECBINFHSA-N	240.734	1.826	10	20	BDCD	
C[C@@H](CN)CNCc1cc(Cl)ccc1O	841048317	HHCBCSBDZOQTTR-QMMMGPOBSA-N	228.723	1.730	10	20	BDCD	
CS[C@@H](C)C(=O)NCc1ccc(O)cc1O	910952766	XWLVQUJTUHKUNB-ZETCQYMHSA-N	241.312	1.466	10	20	BDCD	
Cc1cccc(O)c1CNCCc1cnccn1	877131303	YMQOZKNTNOFOCB-UHFFFAOYSA-N	243.310	1.823	10	20	BDCD	
Cc1cccc(O)c1CNCc1cnnn1C	877535268	XENWIQUZSLDQME-UHFFFAOYSA-N	232.287	1.119	10	20	BDCD	
CC[C@@H](OC(=O)c1cccc(O)c1O)C(C)=O	873380504	QQHIWXKHSROZBG-SNVBAGLBSA-N	238.239	1.622	10	20	BDCD	
CCN(Cc1ccc(N(C)C)cc1)C(=O)CN	37807398	HHHFDYUCVYEQRD-UHFFFAOYSA-N	235.331	1.060	10	20	BDCD	
N[C@@H](CC(=O)O)c1ccc(Cl)cc1O	75069547	ROPXXEPTKZPVRV-ZETCQYMHSA-N	215.636	1.520	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@@H]1CC12CCC2	1263894572	MLPMMUFTZBIUJH-JTQLQIEISA-N	247.294	1.904	10	20	BDCD	
CN(Cc1ccccc1O)C[C@H]1CCC[C@H]1O	305745878	OXXVDSISGAZFLD-TZMCWYRMSA-N	235.327	1.985	10	20	BDCD	
NCc1ccc2c(c1)CCCN2[C@H]1CCOC1=O	700926518	QOKZOCBRTKHTMY-ZDUSSCGKSA-N	246.310	1.213	10	20	BDCD	
CC(=O)C(=O)COc1ccc(Cl)cc1	808011956	AHNYMKOSUKTUEA-UHFFFAOYSA-N	212.632	1.877	10	20	BDCD	
COC1(C(=O)NCc2ccccc2O)CCCC1	691986324	OSVRJHOWQXRFPA-UHFFFAOYSA-N	249.310	1.968	10	20	BDCD	
O=C(NCc1ccccc1O)[C@@H]1C[C@@H]2CC[C@H]1N2	1357499382	MVANYLPHUUEKEL-QJPTWQEYSA-N	246.310	1.149	10	20	BDCD	
C[C@H](NCC1(CO)CC1)c1cc(F)ccc1O	122329268	PUUDZRQBVGGENC-VIFPVBQESA-N	239.290	1.954	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1(O)CCC1	184869958	JLFLREBAWLRNJK-UHFFFAOYSA-N	235.283	1.266	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](CN)C[C@@H]2C)c1	215984995	XTAJWQDQEKRHGU-RYUDHWBXSA-N	234.343	1.870	10	20	BDCD	
OCC1(CNCc2cc(F)ccc2O)CC1	226613873	VHTXBOMUCKKYBG-UHFFFAOYSA-N	225.263	1.393	10	20	BDCD	
CC[C@@]1(C(=O)Nc2ccc(N)cc2)CCCN1	134365369	VMDRBVLKADIKCX-ZDUSSCGKSA-N	233.315	1.740	10	20	BDCD	
C[C@H](O)CCN[C@H](C)c1cc(F)ccc1O	87111421	IMBXBDCOBBKTQQ-DTWKUNHWSA-N	227.279	1.953	10	20	BDCD	
Nc1ccc(CCNC(=O)C2CC=CC2)cc1	85160201	QUCQLZZDGYBQAZ-UHFFFAOYSA-N	230.311	1.894	10	20	BDCD	
CC(=O)C(=O)CSc1ccncc1C	292880462	VNKPIHUPIDCXCV-UHFFFAOYSA-N	209.270	1.640	10	20	BDCD	
Cc1ccc(C(=O)NCC(C)(F)F)c(O)c1O	818261118	FASGYHWHGXMUCN-UHFFFAOYSA-N	245.225	1.791	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](O)[C@H]2C)c1O	825103981	JOMPPJSJJFXIJL-ZYHUDNBSSA-N	221.300	1.656	10	20	BDCD	
NC[C@H]1CC[C@H](NCc2ccccc2O)C1	724090543	SAZYQIYSHTUEAV-JQWIXIFHSA-N	220.316	1.609	10	20	BDCD	
Cc1cccc(CN2C[C@@H]3CCNC[C@@H]3C2)c1O	904420393	NDBKGGROKPLOQT-GXTWGEPZSA-N	246.354	1.742	10	20	BDCD	
Cc1cccc(CN2CCN[C@H](C)[C@@H]2C)c1O	843058276	QSMRZGWLHWAIGT-NEPJUHHUSA-N	234.343	1.883	10	20	BDCD	
Cc1cccc(CNC[C@H](C)CN)c1O	841048030	FVYPSPZBXVSEET-SECBINFHSA-N	208.305	1.385	10	20	BDCD	
NC[C@@H](NCc1cc(Cl)ccc1O)C1CC1	841029670	YDFLDGCFJFOXRH-LLVKDONJSA-N	240.734	1.873	10	20	BDCD	
CN(Cc1cnon1)c1ccc2c(c1)OCO2	851867563	IVXNXVYDNCKCDB-UHFFFAOYSA-N	233.227	1.435	10	20	BDCD	
Cc1ccc(CN(C)[C@H](C)CO)c(O)c1	877525823	COZVQYJSKMLKPW-SNVBAGLBSA-N	209.289	1.513	10	20	BDCD	
Cc1ccc(CN2CCC(C(N)=O)CC2)c(O)c1	876526946	LPVZXQWDIKKGQS-UHFFFAOYSA-N	248.326	1.398	10	20	BDCD	
C[C@H](NC[C@H](C)N(C)C)c1ccccc1O	38088820	MDKUBGOFDWNOJN-QWRGUYRKSA-N	222.332	1.993	10	20	BDCD	
CO[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	83916804	PYFKRBXDVISIAI-GFCCVEGCSA-N	234.299	1.059	10	20	BDCD	
Nc1ccc(N2CC[C@H](O)[C@@H](CCF)C2)cc1	409425350	AJLIYYXIJJINKF-GWCFXTLKSA-N	238.306	1.816	10	20	BDCD	
CNC[C@@H](C)CNCc1ccccc1O	1327415621	KQQXUIAWCGPCBL-SNVBAGLBSA-N	208.305	1.337	10	20	BDCD	
CO[C@H](C)CNCc1cc(F)cc(F)c1O	708393266	AUEKEUBXOFPTKQ-SSDOTTSWSA-N	231.242	1.795	10	20	BDCD	
C[C@H]1CN(C)[C@H](C)CN1Cc1ccc(N)cc1	1120371044	NSKVUXFKFFFPJV-NEPJUHHUSA-N	233.359	1.793	10	20	BDCD	
CN(CCN1CCOC1=O)c1ccc(N)cc1	702055959	PFAMMSTXRWHQRN-UHFFFAOYSA-N	235.287	1.157	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2[C@H]3CCC(=O)[C@@H]32)cc1	911661457	VBMYYTJFOSGCGQ-MVWJERBFSA-N	230.267	1.432	10	20	BDCD	
CCO[C@H](C(=O)NCc1ccccc1O)C1CC1	860233936	PYSNFOJZAXXAMQ-ZDUSSCGKSA-N	249.310	1.824	10	20	BDCD	
CN(C[C@@H]1CCNC1)c1ccc(N)cc1	863556567	UJEIYBCKGXROGI-SNVBAGLBSA-N	205.305	1.315	10	20	BDCD	
CN(C(=O)C[C@@H](N)C1CC1)c1ccc(N)cc1	877077537	MBMLEFOQXLSDIH-GFCCVEGCSA-N	233.315	1.359	10	20	BDCD	
Cc1ccc(CN[C@H](C)CCCO)c(O)c1	877109892	TWGKRTUKRKNLIV-LLVKDONJSA-N	223.316	1.951	10	20	BDCD	
CC[C@@]1(C(=O)NCc2ccc(N)cc2)CCNC1	1263303699	FEOPTCIEFPXNDD-CQSZACIVSA-N	247.342	1.275	10	20	BDCD	
Cc1cccc(CNC[C@@H]2CCCN2)c1O	841036104	NZGAVCHMKUVJAW-LBPRGKRZSA-N	220.316	1.542	10	20	BDCD	
Nc1ccc(NC(=O)c2cc(CO)on2)cc1	1580449805	VXFLDMPXMCNDKS-UHFFFAOYSA-N	233.227	1.001	10	20	BDCD	
CCc1nc(CN(C)Cc2ccccc2O)n[nH]1	159134630	UWRJILXBJCAHOH-UHFFFAOYSA-N	246.314	1.705	10	20	BDCD	
Nc1cccc(C(=O)NCc2ccccc2O)n1	394110185	IVVWEFXAMPIHKX-UHFFFAOYSA-N	243.266	1.299	10	20	BDCD	
CCN(CCC(=O)OC)Cc1ccc(N)cc1	69318134	ILEKBNMTGQHUSN-UHFFFAOYSA-N	236.315	1.654	10	20	BDCD	
CN[C@H]1CCCN(Cc2cc(C)ccc2O)C1	71409480	LTHUUAPYABAPAB-ZDUSSCGKSA-N	234.343	1.884	10	20	BDCD	
Oc1ccccc1CNCC12CC(CO1)C2	527788861	LJVLIMLSTAFXBZ-UHFFFAOYSA-N	219.284	1.661	10	20	BDCD	
CCCN(C)CC(=O)N(C)c1ccc(N)cc1	37273339	IVJKVGQQFSXROI-UHFFFAOYSA-N	235.331	1.573	10	20	BDCD	
COc1cccc(CN[C@H](C)[C@@H](C)OC)c1O	289739763	HKNJXTOKHNKFBH-NXEZZACHSA-N	239.315	1.914	10	20	BDCD	
CNCCCNCc1cccc(C)c1O	83345527	FAWBICVBWDHDFW-UHFFFAOYSA-N	208.305	1.400	10	20	BDCD	
Oc1ccccc1CN1CCC[C@H](O)CC1	294231195	ZHWQKDQCQYOXFT-LBPRGKRZSA-N	221.300	1.739	10	20	BDCD	
CCC(=O)NC[C@H](N)c1ccc(N(C)C)cc1	832283916	CZWISKCQRGXHEJ-LBPRGKRZSA-N	235.331	1.279	10	20	BDCD	
CCc1cccc(CN2C[C@@H](O)C[C@@H]2C)c1O	848905977	OTRSUNDXEVTQFS-GWCFXTLKSA-N	235.327	1.910	10	20	BDCD	
N[C@H]1CCC[C@H](NCc2cc(F)ccc2O)C1	841058202	QKQSOEKQXVBMKY-RYUDHWBXSA-N	238.306	1.891	10	20	BDCD	
COc1cccc(CN2C[C@@H]3CC[C@H](C2)N3)c1O	873217967	WIYFCPFHFSDZMT-TXEJJXNPSA-N	248.326	1.337	10	20	BDCD	
CN(CC(=O)NCc1ccccc1O)C1CCC1	863863634	YUMIIDOOWSLAHH-UHFFFAOYSA-N	248.326	1.493	10	20	BDCD	
C[C@H](NCCCO)c1c(O)cccc1F	886489884	UEBCKCWMPMJWJC-QMMMGPOBSA-N	213.252	1.564	10	20	BDCD	
COc1cccc(CNCc2c[nH]nc2C)c1O	38011164	PGDJJCCHTIOMDY-UHFFFAOYSA-N	247.298	1.722	10	20	BDCD	
Nc1ccc(CN[C@H]2CCCC[C@@H]2O)cc1	716282742	GIJDWISKWLNDMX-STQMWFEESA-N	220.316	1.662	10	20	BDCD	
O=C(O)[C@H]1CCC[C@@H]1NCc1ccccc1O	1601810909	XDMAMEUYUMKPRR-QWRGUYRKSA-N	235.283	1.735	10	20	BDCD	
C[C@H]1NCCC[C@H]1C(=O)NCc1ccccc1O	289848546	KMZMTKXJDKKYEH-ZYHUDNBSSA-N	248.326	1.397	10	20	BDCD	
CNC(=O)C(C)(C)CNCc1ccccc1O	120282004	SCEHPFFEYSMWHY-UHFFFAOYSA-N	236.315	1.254	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2C[C@H](O)C2(C)C)c1	128112513	FVGLOUWQJLPNTB-OLZOCXBDSA-N	235.327	1.950	10	20	BDCD	
CC(C)[C@H](O)CNCc1ccc2c(c1)CCO2	134696765	HNGBQJZUXFBWFI-CYBMUJFWSA-N	235.327	1.728	10	20	BDCD	
CC(C)CN(CC(N)=O)Cc1ccccc1O	132895433	SHTZGYOHFGFAED-UHFFFAOYSA-N	236.315	1.336	10	20	BDCD	
CC(=O)CCCC(=O)NCc1ccccc1O	274939240	MZURWQALYMSAQT-UHFFFAOYSA-N	235.283	1.768	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(C)cc1	808487185	CYDOFULRIPFHHQ-UHFFFAOYSA-N	220.224	1.310	10	20	BDCD	
CNC(=O)CCCCC(=O)Nc1ccc(N)cc1	832250061	KAZYJYWWESDEOD-UHFFFAOYSA-N	249.314	1.514	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)C1CNC1	843125810	AGVFPGLNEFCZOE-UHFFFAOYSA-N	233.359	1.465	10	20	BDCD	
COc1ccc(CNCC2(N)CCC2)cc1C	841050874	JIIZOSQUCZJNPU-UHFFFAOYSA-N	234.343	1.975	10	20	BDCD	
COCC1CN(C(=O)c2cc(O)cs2)C1	880596410	NLARXNQJRABEOK-UHFFFAOYSA-N	227.285	1.172	10	20	BDCD	
O=C(c1c(F)ccc(O)c1O)N1CC[C@@H](F)C1	1325282029	RATXISXVACZBES-ZCFIWIBFSA-N	243.209	1.421	10	20	BDCD	
CCCNC(=O)CSc1nccs1	60740615	BXYMLNGTEBNKRZ-UHFFFAOYSA-N	216.331	1.761	10	20	BDCD	
COC(=O)C[C@@H]1CCCN1Cc1ccc(N)cc1	1337838225	KUVDGSGKNIKBCB-ZDUSSCGKSA-N	248.326	1.796	10	20	BDCD	
CCCN(CC(N)=O)Cc1cccc(C)c1O	383641629	ZYJQZGJOBJYBGT-UHFFFAOYSA-N	236.315	1.398	10	20	BDCD	
CN(C)c1ccc(CN2CCC(CO)CC2)cc1	66057174	OSFXNZDHYYXAHK-UHFFFAOYSA-N	248.370	1.957	10	20	BDCD	
CN(C(=O)COCC1CC1)c1ccc(N)cc1	37275294	LPBJUOKFBPVVMF-UHFFFAOYSA-N	234.299	1.658	10	20	BDCD	
Oc1ccc(Cl)cc1CN1CC[C@H](O)C1	128158791	WVHGSLIFJYTGIM-JTQLQIEISA-N	227.691	1.612	10	20	BDCD	
Cc1ocnc1C(=O)Nc1ccc(N)cc1	237691067	UJSPSMPJMNRVGT-UHFFFAOYSA-N	217.228	1.818	10	20	BDCD	
Cc1ccc(C(=O)NCC(F)F)c(O)c1O	182536510	DURNCJNDISSBCQ-UHFFFAOYSA-N	231.198	1.401	10	20	BDCD	
Cn1ncc(CSc2nccs2)n1	289420056	WDMBDSGBLSMUFM-UHFFFAOYSA-N	212.303	1.564	10	20	BDCD	
C[C@H](CO)N[C@H]1CCc2cccc(O)c21	296196314	YTMGUYXZDVLFDU-SCZZXKLOSA-N	207.273	1.350	10	20	BDCD	
CSCC[C@H](N)C(=O)Nc1ccc(N)cc1	832244122	LEXTYFRPGPSHKZ-JTQLQIEISA-N	239.344	1.288	10	20	BDCD	
Cc1ccc(CN2CC(O)(C(C)C)C2)c(O)c1	877580237	NPUVDQARHMSFHJ-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
CN(Cc1ccc(N)cc1)Cc1ccon1	1120371386	XHVCWPSATJSEOE-UHFFFAOYSA-N	217.272	1.889	10	20	BDCD	
O=C(C=C1CCC1)NCc1cccc(O)c1O	1347234762	PUEFNJACEBSMFE-UHFFFAOYSA-N	233.267	1.824	10	20	BDCD	
O=[N+]([O-])c1cnc(SCCCO)s1	226777908	NOTDGMIEFAECTE-UHFFFAOYSA-N	220.275	1.526	10	20	BDCD	
COc1ccc(O)c(CNCC[C@@H](C)OC)c1	271901782	VUEZREMUCJKYEG-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
C[C@H](NCC1(C(=O)O)CC1)c1ccccc1O	1599902074	IXCKVZMNIVKDCT-VIFPVBQESA-N	235.283	1.908	10	20	BDCD	
C/C=C/C[C@H](CO)NCc1cc(F)ccc1O	186534919	ADFDMLPOGHAZDT-QAVQXKDTSA-N	239.290	1.948	10	20	BDCD	
C[C@H](CO)CN[C@H]1CCc2cccc(O)c21	295782700	AZVWVETYNIOKNZ-ONGXEEELSA-N	221.300	1.598	10	20	BDCD	
Oc1cccc2c1[C@@H](NC[C@@H]1CCCNC1)CC2	817945625	ICZSWODNQYKZKI-YPMHNXCESA-N	246.354	1.969	10	20	BDCD	
Cc1cc(C)c([C@H](C)NCCN)c(O)c1	817937657	ZAFJEHXLMFBCQX-JTQLQIEISA-N	208.305	1.618	10	20	BDCD	
CCO/C=C/C(=O)N(C)Cc1ccccc1O	816889002	IJYHQDNPONLSMG-CMDGGOBGSA-N	235.283	1.901	10	20	BDCD	
C[C@@H](CN)N[C@@H](C)c1ccc(F)cc1O	817969608	FADKZQPUNAYFNI-YUMQZZPRSA-N	212.268	1.529	10	20	BDCD	
COc1cc(CN2CC[C@H]2CO)c(O)cc1C	902630673	BYNHZAIBDUNAJL-NSHDSACASA-N	237.299	1.276	10	20	BDCD	
COC1(C(=O)NCc2ccc(N)cc2)CCCC1	691990373	JRKIPCDSSBVUIV-UHFFFAOYSA-N	248.326	1.844	10	20	BDCD	
C[C@H](CN)CNCc1cccc(F)c1O	841047942	FEHLEGZDIDGLPT-MRVPVSSYSA-N	212.268	1.216	10	20	BDCD	
CC[C@@H]1C[C@H]1NC(=O)NCCc1ccc(N)cc1	841898861	PSMUXPVAOHKCIL-DGCLKSJQSA-N	247.342	1.909	10	20	BDCD	
CNC[C@H](C)N[C@@H](C)c1cc(C)ccc1O	854233096	XMEXQAOZVZJPAM-QWRGUYRKSA-N	222.332	1.959	10	20	BDCD	
COc1cccc([C@@H](C)NC/C=C\CO)c1O	850510219	VZCLDENULHUBDD-UMBAGQNISA-N	237.299	1.600	10	20	BDCD	
Cc1ccc(CN2C[C@@H]3CN(C)C[C@@H]3C2)c(O)c1	877482853	IRXKIQGSYRGHAK-OKILXGFUSA-N	246.354	1.694	10	20	BDCD	
COC(CSc1nccs1)OC	85351720	KZASBWPKVUCZEZ-UHFFFAOYSA-N	205.304	1.854	10	20	BDCD	
CN(C/C=C/C(=O)O)c1ccc2c(c1)OCO2	258795517	ACKJKGYZMUYVAL-NSCUHMNNSA-N	235.239	1.492	10	20	BDCD	
COC[C@@H]1CCN(Cc2cc(F)ccc2O)C1	226565056	JUQBDERIMXIGSV-SNVBAGLBSA-N	239.290	2.000	10	20	BDCD	
C[C@H]1NCCC[C@@H]1NCc1ccc(N(C)C)cc1	396726131	YSWDGASQCPBEAK-DOMZBBRYSA-N	247.386	1.983	10	20	BDCD	
C[C@H]1C[C@@H](C)N(C(=O)c2cccc(O)c2O)C1	126568548	FSAXBSXBFGIVAZ-DTWKUNHWSA-N	235.283	1.968	10	20	BDCD	
CN(C)C[C@H]1CCN(Cc2ccccc2O)C1	179574661	RCKDLEDGWWOTDM-GFCCVEGCSA-N	234.343	1.776	10	20	BDCD	
C[C@@H](NCC(=O)NCC1CC1)c1ccccc1O	179889283	NPESWIYDZAPIFJ-SNVBAGLBSA-N	248.326	1.569	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H]2CO)c1	92455960	KQFIHBQRNFMOGI-LBPRGKRZSA-N	221.300	1.657	10	20	BDCD	
O=C(NCCc1cn[nH]c1)c1cc(O)cs1	811612037	GFRRIVURYYQLHH-UHFFFAOYSA-N	237.284	1.149	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@@H]2CC[C@H]2O)c1	818358336	WARWOVIHXGDSIW-XTWCZFFVSA-N	237.299	1.575	10	20	BDCD	
CCOC1CN(Cc2ccc(N(C)C)cc2)C1	839133064	VEDYANJFRKIBAP-UHFFFAOYSA-N	234.343	1.973	10	20	BDCD	
CCCC[C@H](CN)NCc1ccccc1O	841029811	SMTGYQLBBWKKKP-GFCCVEGCSA-N	222.332	1.999	10	20	BDCD	
CCNCCNCc1cccc(F)c1O	841037184	PURVAHRGLRTZAK-UHFFFAOYSA-N	212.268	1.230	10	20	BDCD	
Cc1ccc(CNCCc2ccnn2C)c(O)c1	877363759	SFXPLSISTPDUSR-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
Cc1cccc(CNC[C@@H](O)C(F)(F)F)c1O	224553796	FWNKIWOAEVKNJQ-SECBINFHSA-N	249.232	1.713	10	20	BDCD	
COc1ccc(CNCC(=O)N(C)C)cc1C	35052682	ITXJVGRXNFLKRH-UHFFFAOYSA-N	236.315	1.181	10	20	BDCD	
C[C@@H](CCO)N[C@@H]1CCc2cccc(O)c21	297575976	GVUVOWXNRPCUOL-GXSJLCMTSA-N	221.300	1.740	10	20	BDCD	
CC(=O)C(=O)CSc1ccc(Cl)cn1	808023656	SDOJESPYMSBIIM-UHFFFAOYSA-N	229.688	1.985	10	20	BDCD	
C[C@H](O)CNCc1cc(Cl)c(F)cc1O	816558571	DNLJYNVOVFUWOH-LURJTMIESA-N	233.670	1.655	10	20	BDCD	
COC(=O)[C@H]1C[C@H](NCc2cc(C)ccc2O)C1	827812390	LKGXNIVJHNYBAR-UMSPYCQHSA-N	249.310	1.742	10	20	BDCD	
C[C@@H]1C[C@H]1C(=O)NCc1ccc(O)cc1O	910947810	NPMDRDDCTZBCSB-GMSGAONNSA-N	221.256	1.370	10	20	BDCD	
CN(C)c1ccc(CNC(=O)OCCF)cc1	858883227	LEHISTRLUFRBLR-UHFFFAOYSA-N	240.278	1.948	10	20	BDCD	
Cc1cccc(O)c1CN(C)C1(CO)CC1	877641927	LPBUBUDGLLARPB-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
CCN(C(=O)Cc1ccc(N)cc1)[C@H]1CCNC1	1332095519	MTLAFVCFLZLYEY-ZDUSSCGKSA-N	247.342	1.022	10	20	BDCD	
CO[C@@H]1CN(CCN=[N+]=[N-])C[C@@H]1n1ccnc1	409435572	VLLSPEQZZXTPKS-VHSXEESVSA-N	236.279	1.065	10	20	BDCD	
C[C@H](Cc1cnn(C)c1)NCc1ccccc1O	768400929	BODBABPFVDYDNJ-LLVKDONJSA-N	245.326	1.847	10	20	BDCD	
CN(C(=O)NCCc1ccc(N)cc1)C1CC1	841954753	PCUVHJCLBWXJJP-UHFFFAOYSA-N	233.315	1.615	10	20	BDCD	
Cc1cc(C(=O)NCc2ccc(O)c(O)c2)[nH]n1	159075319	ZEIIAPIWLAILCV-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
OC[C@H](NCc1ccccc1O)C1CC1	308903672	KMOLYIRVBCRSQN-NSHDSACASA-N	207.273	1.253	10	20	BDCD	
C[C@@]1(O)CCCN(Cc2ccccc2O)C1	179578399	JGJLSSFIQJVNQB-CYBMUJFWSA-N	221.300	1.739	10	20	BDCD	
Oc1ccccc1CN1CCCC2(C1)OCCO2	184721213	WYXKBMVIMHSPES-UHFFFAOYSA-N	249.310	1.731	10	20	BDCD	
CC[C@@H](N[C@@H](C)CO)c1ccc(F)cc1O	285960506	GPDUZKMPVIDDQG-GZMMTYOYSA-N	227.279	1.953	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1CCCNC1	226436615	KYIFDPHWLQVXLE-GFCCVEGCSA-N	234.343	1.824	10	20	BDCD	
CC(C)(CCO)NC(=O)c1cc(O)cs1	831395376	UNQSDCIJYMBADT-UHFFFAOYSA-N	229.301	1.345	10	20	BDCD	
O=C(c1cc(O)cs1)N1[C@H]2CC[C@H]1COC2	839796473	BWVONYMUNNUOKM-YUMQZZPRSA-N	239.296	1.457	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H](O)C1CC1	830141803	YQWGUOWODSZZHV-LBPRGKRZSA-N	235.283	1.122	10	20	BDCD	
C[C@H](NC(=O)c1cc(O)cs1)c1nc[nH]n1	748379585	PUNMZMZGGZSKDE-YFKPBYRVSA-N	238.272	1.063	10	20	BDCD	
CCN[C@H](C)CNCc1cc(F)ccc1O	841065757	MQYZKUVCKMSDBE-SECBINFHSA-N	226.295	1.619	10	20	BDCD	
O=C(O)[C@H](CC(F)F)NCc1ccccc1O	1119536584	MYENRFDUUVUWHD-QMMMGPOBSA-N	245.225	1.590	10	20	BDCD	
CCOc1ccc(CN(C)C[C@H](C)O)c(O)c1	776520802	GTSQWPRRNIFAPI-JTQLQIEISA-N	239.315	1.604	10	20	BDCD	
Cc1ccc(CN(C)C[C@@H](O)C2CC2)c(O)c1	877527712	OCJLZTMYDVZNEK-CQSZACIVSA-N	235.327	1.903	10	20	BDCD	
O=C(O)C1(NCc2ccc3c(c2)CCCO3)CC1	900022916	QTDPQYBEPAAXNU-UHFFFAOYSA-N	247.294	1.718	10	20	BDCD	
CC(C)n1nnnc1N(C)Cc1ccccc1O	1354292085	IDCROHNIFQEOAA-UHFFFAOYSA-N	247.302	1.596	10	20	BDCD	
CO[C@@H]1COC[C@@H]1NCc1cc(C)ccc1O	839193600	UBRLGSMQOKPAMB-WCQYABFASA-N	237.299	1.204	10	20	BDCD	
CCn1ncnc1Cc1ccc(N)cc1	54498948	YCEFKEFPAUBPRV-UHFFFAOYSA-N	202.261	1.471	10	20	BDCD	
NC(=O)[C@@H]1CCCCN1Cc1ccccc1O	179553374	NCDJOEODXNQVSW-NSHDSACASA-N	234.299	1.232	10	20	BDCD	
CC[C@H](O)CCNCc1cccc(OC)c1O	127403617	HLNNAVCGFGNSNB-NSHDSACASA-N	239.315	1.651	10	20	BDCD	
Cc1ccc(O)c(CNC[C@@H](O)C2CC2)c1	70955761	LRJGPPAHFIMQHK-CYBMUJFWSA-N	221.300	1.561	10	20	BDCD	
C[C@@]1(O)CCN(Cc2ccccc2O)C1	180244825	IBJYIDPEGRFJFU-GFCCVEGCSA-N	207.273	1.349	10	20	BDCD	
CO[C@H](C)CCNCc1ccccc1O	263818869	PJGXNKHUMSFKBR-SNVBAGLBSA-N	209.289	1.907	10	20	BDCD	
O=C(C[C@@H]1CCCO1)NCc1ccccc1O	133755762	KTPCZMLTFACNRW-NSHDSACASA-N	235.283	1.578	10	20	BDCD	
C[C@@H]1CNC[C@H]1CNCc1ccc2c(c1)CCO2	903964593	MFEABWUITSJWEL-RISCZKNCSA-N	246.354	1.567	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NCC2(N)CC2)c1	902408161	XHPHONPOFUZVBG-SNVBAGLBSA-N	220.316	1.843	10	20	BDCD	
CCc1cccc(CN2CCCNC(=O)C2)c1O	848883303	LWAIEMWNTKEGTQ-UHFFFAOYSA-N	248.326	1.277	10	20	BDCD	
C[C@@H]1C[C@@H]1CNC[C@@H](N)c1ccc(N(C)C)cc1	841040918	COBYQWHBZIHSHT-UXIGCNINSA-N	247.386	1.998	10	20	BDCD	
CN(C)c1cc(F)c(CNCCCO)cc1F	858086366	GXBPUGNALRRIFD-UHFFFAOYSA-N	244.285	1.503	10	20	BDCD	
Cc1cccc(O)c1CN1C[C@@H]2C[C@]2(CO)C1	877463040	YYMQTQMLMWKSTD-SMDDNHRTSA-N	233.311	1.515	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H]3C[C@@]3(CO)C2)c1	783734557	MQUWQRGQFOJVPM-FZMZJTMJSA-N	249.310	1.215	10	20	BDCD	
COc1ccc(CNC(=O)c2ccc[nH]2)c(O)c1	794369195	DNTIVKBLEFELPN-UHFFFAOYSA-N	246.266	1.659	10	20	BDCD	
COC1CC(C(=O)NCCc2ccc(N)cc2)C1	703470858	WITQIOJPOGFPEE-UHFFFAOYSA-N	248.326	1.353	10	20	BDCD	
CCN(C)C(=O)[C@H](C)NCc1ccccc1O	188472294	SYAAXHBLULUTTP-JTQLQIEISA-N	236.315	1.349	10	20	BDCD	
COc1cccc(CN[C@@H](C)CC(=O)O)c1O	1611066623	FBYYPMKNMHTONW-QMMMGPOBSA-N	239.271	1.354	10	20	BDCD	
CCOC(C)(C)C(=O)NCc1ccccc1O	384161526	VZWOQPXHFGKIQZ-UHFFFAOYSA-N	237.299	1.824	10	20	BDCD	
COC(=O)C(C)(C)CNCc1ccc(N)cc1	1345160277	TUFDYVWJHIRKGX-UHFFFAOYSA-N	236.315	1.558	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C(F)(F)F	112021839	YDTJMEFAWQYXQE-UHFFFAOYSA-N	233.189	1.913	10	20	BDCD	
CN[C@H]1CCN(Cc2cc(F)ccc2O)C1	219383570	DJVYJILVSFCEDN-NSHDSACASA-N	224.279	1.325	10	20	BDCD	
CC[C@H](CO)N[C@H]1CCc2cccc(O)c21	296224271	ZXIAQPFFUPNMQR-MNOVXSKESA-N	221.300	1.740	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@H]1CCCN1)CC2	817953603	OXXXQNLHKJOAEM-VXGBXAGGSA-N	232.327	1.721	10	20	BDCD	
C[C@H](N[C@@H]1CCNC1)c1ccc(N(C)C)cc1	817944413	BHAQGXOCSNXNLP-WCQYABFASA-N	233.359	1.765	10	20	BDCD	
O=C(OC[C@H]1CCCO1)c1cc(O)cs1	732352608	AGDISQSJGIPZPD-MRVPVSSYSA-N	228.269	1.790	10	20	BDCD	
COc1ccc(O)c(CN[C@H](C)CCN)c1	841049787	HQSUQQUDCXWMIS-SECBINFHSA-N	224.304	1.228	10	20	BDCD	
O=C(NCc1ccccc1O)Nc1cccnn1	764213318	YLFCNRYFABASBN-UHFFFAOYSA-N	244.254	1.504	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2=CCOCC2)c1	862757143	IXOPNNZGQAXQBN-UHFFFAOYSA-N	247.294	1.664	10	20	BDCD	
CCN(CCCO)Cc1c(O)cccc1OC	769484757	YPXBDDZBZTUIIM-UHFFFAOYSA-N	239.315	1.605	10	20	BDCD	
COc1ccc(CNC[C@H](F)C(=O)O)cc1C	1262164208	ZJZMJDDXYWJJMM-JTQLQIEISA-N	241.262	1.516	10	20	BDCD	
COc1ccc(N2CCC[C@H]2CN)cc1	20439492	WBHBKXBFFQVCFD-NSHDSACASA-N	206.289	1.623	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1CCCO1)c1ccccc1O	827923621	WDXQBMZDLDRECN-SKDRFNHKSA-N	235.283	1.748	10	20	BDCD	
COc1cccc(CN[C@H]2CCO[C@@H]2C)c1O	134247271	AAENLCDLRXBGHD-KOLCDFICSA-N	237.299	1.668	10	20	BDCD	
Oc1ccc(F)cc1CNC[C@H]1COCCO1	226585519	JUUDPLWHSZPMTR-NSHDSACASA-N	241.262	1.036	10	20	BDCD	
CNCC(=O)NCc1c(O)ccc2c1CCCC2	193131282	GTTXVXLZEVPMAL-UHFFFAOYSA-N	248.326	1.107	10	20	BDCD	
CCOCCNCc1cc2c(cc1O)OCO2	42879815	SMOJNFRNAKNCBF-UHFFFAOYSA-N	239.271	1.247	10	20	BDCD	
CC1(C)CN(Cc2cc(F)ccc2O)C[C@@H]1O	280572538	VZJZGNHNGSFBGZ-LBPRGKRZSA-N	239.290	1.734	10	20	BDCD	
CC(C)ONC(=O)/C=C/c1ccc(O)c(O)c1	836798042	GUJDVWWAPPZXGL-GQCTYLIASA-N	237.255	1.567	10	20	BDCD	
OC[C@@H](CNCc1ccccc1O)CC1CC1	850386583	MHDJLWJVYYIXOO-GFCCVEGCSA-N	235.327	1.890	10	20	BDCD	
CC(=O)N[C@@H]1CCN(Cc2ccc(C)cc2O)C1	877594945	NHORIXABKCUYAG-CYBMUJFWSA-N	248.326	1.411	10	20	BDCD	
Cc1ccc(CNC[C@H](C)N(C)C)c(O)c1	877150630	XTPZXBVRLRRIPO-NSHDSACASA-N	222.332	1.740	10	20	BDCD	
CN(C(=O)[C@@H]1CCC[C@@H](N)C1)c1ccc(N)cc1	877076712	PPGFDFQWBRCMGM-ZYHUDNBSSA-N	247.342	1.749	10	20	BDCD	
CC[C@H]1CN(Cc2c(C)cccc2O)C[C@H]1O	876815176	NMDXWJLVJMEFJM-SMDDNHRTSA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(O)c(CN2CCn3ncnc3C2)c1	770664001	HYLBGYKNSBMYCM-UHFFFAOYSA-N	244.298	1.308	10	20	BDCD	
Cc1cccc(O)c1CN1CC2(CCOC2)C1	877554843	OXRXPACFFSZREG-UHFFFAOYSA-N	233.311	1.923	10	20	BDCD	
C[C@@H](NS(C)(=O)=O)c1ccc(N(C)C)cc1	773085650	ZWYZDIUZFVYYJO-SECBINFHSA-N	242.344	1.363	10	20	BDCD	
COC(=O)[C@@H](C)Sc1nccs1	47852608	OHXHLRZEVSUXEI-RXMQYKEDSA-N	203.288	1.797	10	20	BDCD	
C[C@H](O)C(=O)N(C)Cc1ccc(N(C)C)cc1	276087801	JRDFJJAQJZRYJR-JTQLQIEISA-N	236.315	1.092	10	20	BDCD	
CC[C@H](NCc1ccc2c(c1)CCO2)C(=O)O	1326048608	NVCOOJLFTAXDNK-NSHDSACASA-N	235.283	1.574	10	20	BDCD	
[N-]=[N+]=NCCN1CCC2(CC1)C[C@H](O)CCO2	409427237	KBVSDTVTCJHEPY-SNVBAGLBSA-N	240.307	1.303	10	20	BDCD	
COc1cccc(O)c1CNCC(C)(C)OC	742381125	XRJRZGNENMIIEZ-UHFFFAOYSA-N	239.315	1.915	10	20	BDCD	
Cc1cccc(CN(C)C(C)(C)C(=O)O)c1O	1607851055	DMTNYXRSLKFAEB-UHFFFAOYSA-N	237.299	1.996	10	20	BDCD	
N[C@@H](CO)c1ccc(Br)cc1O	72198717	OCMZLIPLJLNCOA-ZETCQYMHSA-N	232.077	1.147	10	20	BDCD	
C[C@H](NC(=O)Cc1ccc(N)cc1)c1ncon1	397919578	JUKYXRKXQMTGMZ-QMMMGPOBSA-N	246.270	1.072	10	20	BDCD	
COCc1noc(Cc2ccc(N)cc2)n1	49672092	XJUPOENPWZPFRO-UHFFFAOYSA-N	219.244	1.389	10	20	BDCD	
COC[C@@H](CN[C@H](C)c1ccccc1O)OC	228808812	ZYXUZJVKMBQSIH-GHMZBOCLSA-N	239.315	1.704	10	20	BDCD	
C[C@@](O)(CNCc1ccccc1O)c1ccco1	266141054	HECCGBIFXHXCAW-CQSZACIVSA-N	247.294	1.983	10	20	BDCD	
Oc1cccc2c1[C@H](N[C@@H]1CCNC1)CC2	817944607	IAOHRXDULMPLMM-GHMZBOCLSA-N	218.300	1.331	10	20	BDCD	
CC1(C)NCC[C@@H]1NCCc1ccc(N)cc1	925691784	JTSGSAVAYOCCAL-ZDUSSCGKSA-N	233.359	1.541	10	20	BDCD	
CNC[C@@H](C)N[C@@H](C)c1cc(F)ccc1O	854231698	JYUAWASRADADPQ-BDAKNGLRSA-N	226.295	1.790	10	20	BDCD	
Cc1cccc(O)c1CNCC(F)(F)CO	877391349	CDJQFDJPRHSSTM-UHFFFAOYSA-N	231.242	1.418	10	20	BDCD	
CC[C@@H]1CN(Cc2ccc(C)cc2O)C[C@H]1O	876814350	DZQCRRINBWYFHW-BXUZGUMPSA-N	235.327	1.903	10	20	BDCD	
Cc1ccc(O)c(CN[C@H]2C(=O)NCC2(C)C)c1	895316546	PIQYRIQWRUXPJT-LBPRGKRZSA-N	248.326	1.315	10	20	BDCD	
CO[C@H](C)COC(=O)c1ccc(C)c(O)c1O	782327031	SNIOXQMSMZMKNL-MRVPVSSYSA-N	240.255	1.598	10	20	BDCD	
COC[C@H](C)NCc1ccc(N(C)C)cc1	19904330	UKOMEWOGZKCURW-NSHDSACASA-N	222.332	1.877	10	20	BDCD	
C[C@H](CCO)NCc1cc(F)cc(F)c1O	708394180	RCNQAADKFGWHGR-SSDOTTSWSA-N	231.242	1.531	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@H](CCN)C2)cc1	723678483	UFGFUXURHAYYQI-AWEZNQCLSA-N	247.386	1.923	10	20	BDCD	
CN(C)c1ccc(CNC2CSC2)cc1	75151138	MVTNPYWWHUDVDK-UHFFFAOYSA-N	222.357	1.958	10	20	BDCD	
Nc1ccc(CNC(=O)N2CC(F)C2)cc1	1337070556	RSZVKBHAGPIYRE-UHFFFAOYSA-N	223.251	1.132	10	20	BDCD	
C[C@H](CCCO)CNC(=O)c1cc(O)cs1	1347775485	LHGQNYVTQPVLMM-MRVPVSSYSA-N	243.328	1.592	10	20	BDCD	
CN(Cc1ccccc1O)S(=O)(=O)C1CC1	159624025	UQJOMRDVWLIUMP-UHFFFAOYSA-N	241.312	1.316	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H](C)CC(N)=O)c(O)c1	168830226	UWARYVFRIYZWSG-ZJUUUORDSA-N	236.315	1.615	10	20	BDCD	
C[C@@H](CO)CNCc1cc(F)ccc1O	226586247	YZJFCRSJFNISOD-MRVPVSSYSA-N	213.252	1.249	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@](C)(CN)C2)c1	310372970	OMRUSHXUWQPLOD-CQSZACIVSA-N	234.343	1.871	10	20	BDCD	
O=[N+]([O-])c1cnc(Sc2nccs2)nc1	302135272	ZSNOITANSMMDIG-UHFFFAOYSA-N	240.269	1.993	10	20	BDCD	
COc1cccc(CNCCCC(=O)O)c1O	37418301	XIQLEGOEUQDVMA-UHFFFAOYSA-N	239.271	1.355	10	20	BDCD	
O=C(NCc1ccccc1O)c1cnc(S)[nH]1	800690188	HEXAMRFLYHEWTD-UHFFFAOYSA-N	249.295	1.334	10	20	BDCD	
COc1cccc(CNC/C=C\CO)c1O	717550745	ZGAVKKRUNQMFAV-IHWYPQMZSA-N	223.272	1.039	10	20	BDCD	
CCNCCN[C@@H](C)c1ccc(F)cc1O	817952137	NYVGPCGZHLAZMX-VIFPVBQESA-N	226.295	1.791	10	20	BDCD	
O=C(CCc1ccon1)NCc1ccccc1O	816912408	WLXKBFCWNOTEBV-UHFFFAOYSA-N	246.266	1.629	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NC[C@H](C)CN)c1	817961606	ANJGINWLVUVUOV-NXEZZACHSA-N	238.331	1.646	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)C(=O)O)cc1C	818849290	OJINRUWLWKMLGB-SECBINFHSA-N	223.272	1.572	10	20	BDCD	
CN(C(=O)/C=C\c1cnn(C)c1)c1ccccn1	736465083	HXBIAMSBHUTBSS-SREVYHEPSA-N	242.282	1.491	10	20	BDCD	
CC[C@H](NCCCON)c1ccc(F)cc1O	902415224	LMTFZTZISYJCGM-NSHDSACASA-N	242.294	1.852	10	20	BDCD	
C[C@H]1CNC[C@@H](C)N1Cc1cccc(F)c1O	843065526	MSHJILUOILFOKK-AOOOYVTPSA-N	238.306	1.714	10	20	BDCD	
CCO[C@@H](C)C(=O)NCc1cc(C)ccc1O	862760791	WDFSALCWANFFAU-JTQLQIEISA-N	237.299	1.742	10	20	BDCD	
Nc1ccc(CN[C@H]2CC23CCNCC3)cc1	1120269393	RWLZVPVEYMEALP-ZDUSSCGKSA-N	231.343	1.501	10	20	BDCD	
CCOC(=O)[C@@H](C)N[C@H](C)c1ccccc1O	49368735	HRXSUWAXZYXWAL-NXEZZACHSA-N	237.299	1.994	10	20	BDCD	
COc1ccc(CNc2ncccn2)c(O)c1	83357878	FBCFUEDYTGFFAY-UHFFFAOYSA-N	231.255	1.803	10	20	BDCD	
Cc1ncc(CNCc2ccccc2O)n1C	689765656	DVLSOLNJIJVVEX-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
CCOC(=O)[C@H](NCc1ccc(N)cc1)C1CC1	1336285201	JAZFJRIPXOBGRC-CYBMUJFWSA-N	248.326	1.700	10	20	BDCD	
CC[C@@H](C(=O)NCc1ccc(N)cc1)N(C)C	1343474856	ZQZLUPXDFXEWCB-LBPRGKRZSA-N	235.331	1.225	10	20	BDCD	
C[C@H](CN[C@H]1CCc2cccc(O)c21)N(C)C	297659980	KNFDAHVBAAOXCB-PWSUYJOCSA-N	234.343	1.919	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC[C@@H](C)O)c1	35629070	WFPWAOXCHZCBEI-ZJUUUORDSA-N	209.289	1.732	10	20	BDCD	
O=C(CC1CCC1)NCc1ccc(O)c(O)c1	182529344	UXKCUTASDAHGAV-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
Oc1ccccc1CNC[C@H]1CCCCN1	236564578	IXSDPYCEWSQMMZ-GFCCVEGCSA-N	220.316	1.624	10	20	BDCD	
CC[C@@H](CO)N[C@H]1CCc2cccc(O)c21	296224275	ZXIAQPFFUPNMQR-QWRGUYRKSA-N	221.300	1.740	10	20	BDCD	
COC(=O)c1cnc(S[C@H](C)[C@@H](C)O)s1	296375511	VYKGZKMLLNOUOV-PHDIDXHHSA-N	247.341	1.791	10	20	BDCD	
Cc1ccc([C@H](C)NC2CNC2)c(O)c1	817956025	NXMPIXVXOFYDTE-VIFPVBQESA-N	206.289	1.323	10	20	BDCD	
O=C(NOC/C=C/Cl)c1cccc(O)c1O	812407838	OMQJOHQBYDLLKY-GORDUTHDSA-N	243.646	1.512	10	20	BDCD	
Oc1cc2c(cc1CNC(CF)CF)OCO2	824556095	ZXXCTTQIJYYLDW-UHFFFAOYSA-N	245.225	1.518	10	20	BDCD	
O=C(CCC1(O)CCC1)NCc1ccccc1O	866755094	GRDVGIYMRCYCHJ-UHFFFAOYSA-N	249.310	1.704	10	20	BDCD	
CCN(CCCO)Cc1c(C)cccc1O	876766992	XYNHIZCIAVJDSG-UHFFFAOYSA-N	223.316	1.905	10	20	BDCD	
CO[C@H]1CCN(C(=O)NCc2ccc(N)cc2)C1	1120591909	MBSRSQXCDAPVLG-LBPRGKRZSA-N	249.314	1.199	10	20	BDCD	
Cc1ccc([C@@H](C)N[C@@H]2CC(=O)N(C)C2)c(O)c1	273612484	WLQPPFWFXAPTTN-GHMZBOCLSA-N	248.326	1.582	10	20	BDCD	
COc1cccc(CN2C[C@H]3COC[C@H]3C2)c1O	718144372	DMBKVYPLGWICMD-TXEJJXNPSA-N	249.310	1.479	10	20	BDCD	
CN(C)c1ccc2c(c1)OCCN2CCF	774752796	MAWKPKJGPSUOTC-UHFFFAOYSA-N	224.279	1.921	10	20	BDCD	
COc1cc(C(=O)Nc2ccc(N)cc2)ncn1	1579141937	BNKHJMHCMREKGJ-UHFFFAOYSA-N	244.254	1.320	10	20	BDCD	
CC(C)[C@@H](NCc1cccc(F)c1O)C(=O)O	158742456	AXWHSROFONMDGT-SNVBAGLBSA-N	241.262	1.730	10	20	BDCD	
C[C@H](O)CCNCc1ccc(N(C)C)c(F)c1	114771300	BBFYYZHZMZVTIQ-JTQLQIEISA-N	240.322	1.752	10	20	BDCD	
COc1cccc(CNC2(CO)CCC2)c1O	133165525	HTSYNKSSXSHCQG-UHFFFAOYSA-N	237.299	1.405	10	20	BDCD	
COc1cccc(CNCCCCO)c1O	193281638	XSKUNXSOONNWEF-UHFFFAOYSA-N	225.288	1.263	10	20	BDCD	
C[C@@H](NC/C=C/CO)c1ccc(N(C)C)cc1	717533754	YJTDVHJFSQIZPD-ZYOFXKKJSA-N	234.343	1.952	10	20	BDCD	
O=C(N=S1(=O)CCCC1)c1cc(O)cs1	925909697	KGJYJRRMHYVYNU-UHFFFAOYSA-N	245.325	1.856	10	20	BDCD	
Cc1ccc(CN[C@@H]2CC(=O)N(C)C2)c(O)c1	876994116	DFNVDOWTGBIHBE-LLVKDONJSA-N	234.299	1.021	10	20	BDCD	
Cc1ccc(CNC[C@@]2(C)CCC(=O)N2)c(O)c1	877578107	UZEUDJGCTVFPCX-CQSZACIVSA-N	248.326	1.459	10	20	BDCD	
C[C@H](NC(=O)[C@@H](C)O)c1ccc(N(C)C)cc1	775407796	WMPJOGAOFVULFD-VHSXEESVSA-N	236.315	1.311	10	20	BDCD	
OC[C@@]12C[C@@H]1CN(Cc1ccccc1O)C2	783745336	VTEDGKPWYDRFPN-YPMHNXCESA-N	219.284	1.206	10	20	BDCD	
COc1ccc(CNC(=O)c2cnco2)c(O)c1	794376476	HZTOIELIZPNRCN-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
C[C@@H]1CCOCCN1C(=O)Cc1ccc(N)cc1	1343102512	ADWNXTKUIGWGNG-LLVKDONJSA-N	248.326	1.449	10	20	BDCD	
C[C@H](NC1CC1)C(=O)NCc1ccc(N)cc1	1341923095	IUDJKHBCCGCDNX-VIFPVBQESA-N	233.315	1.026	10	20	BDCD	
CCC[C@@H](NC(=O)c1cc(O)cs1)C(=O)O	1605354858	RMKNYPVOEGGJBJ-SSDOTTSWSA-N	243.284	1.437	10	20	BDCD	
NCc1nccnc1NCc1ccc(N)cc1	1580358801	XRGANJNTALBREM-UHFFFAOYSA-N	229.287	1.130	10	20	BDCD	
COc1ccc(N(C)CC(=O)NCC2CC2)cc1	844353360	UDAHCRJUDXVSIA-UHFFFAOYSA-N	248.326	1.658	10	20	BDCD	
CN(Cc1cncn1C)c1ccc(N)cc1	401712630	WQIKTXIDQCKWSK-UHFFFAOYSA-N	216.288	1.639	10	20	BDCD	
Nc1ccc(CN2CCN3C(=O)CC[C@@H]3C2)cc1	126331829	OFPHHAZCPLGBGF-CYBMUJFWSA-N	245.326	1.075	10	20	BDCD	
Oc1ccccc1CNC1CCOCC1	36319253	FDLHYRQLUWTWKI-UHFFFAOYSA-N	207.273	1.661	10	20	BDCD	
C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CC1	183462612	NBHYLEJIBLOSST-MRVPVSSYSA-N	235.283	1.555	10	20	BDCD	
COc1ccc(O)c(CN(C)[C@H]2CCNC2)c1	71309762	BZESCHRREFKYOX-NSHDSACASA-N	236.315	1.195	10	20	BDCD	
C[C@H](NC[C@@H](C)O)c1cc(F)ccc1O	87111360	CECSZDLHXUAKEF-SFYZADRCSA-N	213.252	1.563	10	20	BDCD	
C[C@@H](NCCCO)c1cc(F)ccc1O	87111338	PFBZQRCQDKDGDM-MRVPVSSYSA-N	213.252	1.564	10	20	BDCD	
COC(C)(C)CC(=O)NCc1ccccc1O	230939089	QIECTKSRINLDLD-UHFFFAOYSA-N	237.299	1.824	10	20	BDCD	
C[C@]1(C(=O)C(=O)c2ccccn2)C=CC=CO1	253534047	XUYIFGKVHXRWFB-CYBMUJFWSA-N	229.235	1.692	10	20	BDCD	
Cc1cc(O)c(CNCCCC(=O)O)cc1C	818849186	CCJSUMUKFHHROY-UHFFFAOYSA-N	237.299	1.963	10	20	BDCD	
CCC1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C1	837258636	LYGHKHLSZYYWHB-GQCTYLIASA-N	247.294	1.979	10	20	BDCD	
CNCCN(C)Cc1c(O)ccc(Cl)c1F	843057665	QLLZAUXMSBWMPH-UHFFFAOYSA-N	246.713	1.836	10	20	BDCD	
CC[C@@H](N)CNCc1cccc(OC)c1O	841069483	AEFUIABQCLIUAO-SNVBAGLBSA-N	224.304	1.228	10	20	BDCD	
Cc1nnc(C(=O)NCc2ccccc2O)s1	758357499	PSKOCZTYIBRRIN-UHFFFAOYSA-N	249.295	1.482	10	20	BDCD	
Cc1nc(COC(=O)c2cc(O)cs2)no1	759521740	DNMGUANBBZKTMQ-UHFFFAOYSA-N	240.240	1.502	10	20	BDCD	
Cc1ccc(CN[C@@H]2CO[C@H](C)C2)c(O)c1	877608211	RMPDYCVKXDRFNL-PWSUYJOCSA-N	221.300	1.968	10	20	BDCD	
C[C@H](NCC[N+](=O)[O-])c1ccc(N(C)C)cc1	1119743374	JCNLCOZVSQFAFI-JTQLQIEISA-N	237.303	1.680	10	20	BDCD	
Oc1cc2c(cc1CN1CCO[C@@H]3C[C@H]31)CCC2	793618267	KXOJYLMJHJHIQT-UKRRQHHQSA-N	245.322	1.854	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]1F	1521254368	APICYPHFDPICMA-ZJUUUORDSA-N	223.247	1.709	10	20	BDCD	
Cc1ccc([C@@H](C)NCCN(C)C)c(O)c1	20083634	QHSHPJAWVRHAMP-LLVKDONJSA-N	222.332	1.913	10	20	BDCD	
Nc1ccc(CNC(=O)C[C@H]2CCOC2)cc1	401349555	OTGHRZYJNPGQKM-LLVKDONJSA-N	234.299	1.312	10	20	BDCD	
COC[C@](C)(O)CN[C@H](C)c1ccccc1O	382548969	GWHJOWAVEJKDJA-ZWNOBZJWSA-N	239.315	1.440	10	20	BDCD	
CN1CCCN(Cc2ccc(N(C)C)cc2)CC1	20010480	PDAIAOUEHIKMRH-UHFFFAOYSA-N	247.386	1.890	10	20	BDCD	
CC1(C)[C@@H](O)C[C@@H]1NCc1cc(F)ccc1O	189967859	RISCGNHGUPMMPW-RYUDHWBXSA-N	239.290	1.780	10	20	BDCD	
O=C(O)C[C@H]1CCCN1Cc1ccccc1O	86791299	DYHQHZZSBLTANY-LLVKDONJSA-N	235.283	1.831	10	20	BDCD	
O=C(O[C@H]1CCOC1)c1cccc(O)c1O	837648808	XEVNIAOWHPXDGZ-ZETCQYMHSA-N	224.212	1.044	10	20	BDCD	
Cc1cccc(CN2CCN[C@@H](C)[C@@H]2C)c1O	843058278	QSMRZGWLHWAIGT-RYUDHWBXSA-N	234.343	1.883	10	20	BDCD	
C[C@H](CN)NCc1cc(Cl)cc(F)c1O	841059613	IGXYQTMGCDUSSK-ZCFIWIBFSA-N	232.686	1.622	10	20	BDCD	
Cc1cccc(O)c1CN(C)CC[C@@H](C)O	876745423	HJSJSPZZEVFYLF-LLVKDONJSA-N	223.316	1.903	10	20	BDCD	
C[C@@H]1CNCc2c1cnn2-c1ccc(N)cc1	1898234659	MQRICJSZOOJSAR-SECBINFHSA-N	228.299	1.661	10	20	BDCD	
CCC[C@@H](NCc1ccccc1O)C(=O)OC	83364801	CEBJZVWCNUAGQK-LLVKDONJSA-N	237.299	1.824	10	20	BDCD	
O=C(O)CCNCc1ccc(F)c(F)c1O	703326131	BIVQSEOQUNKWOV-UHFFFAOYSA-N	231.198	1.235	10	20	BDCD	
Cc1ncsc1C(=O)N1CC(N=[N+]=[N-])C1	409422386	DIZMBAHZBSKQEY-UHFFFAOYSA-N	223.261	1.586	10	20	BDCD	
[N-]=[N+]=NCCN1C[C@@H]2CCCC[C@]2(CO)C1	409435218	SZBRCKWOLJYBGI-WDEREUQCSA-N	224.308	1.781	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CCC[C@@H](N)C2)cc1	834598282	AWRKAKSVCZUXQR-CHWSQXEVSA-N	247.342	1.197	10	20	BDCD	
CC[C@H](O)CN(C)Cc1ccccc1O	128446000	NIHQGOKRKFNXTA-NSHDSACASA-N	209.289	1.595	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@H]2CCOC2)c1	131192104	NPVIULSMWWYILP-ZJUUUORDSA-N	237.299	1.840	10	20	BDCD	
O=C(NCc1ccccc1O)c1cn[nH]c1	136334205	UBJNOBIWZGNNBO-UHFFFAOYSA-N	217.228	1.045	10	20	BDCD	
CC(=O)C(=O)CSc1ncccc1Cl	808020152	AJLXDVOCEHIJSZ-UHFFFAOYSA-N	229.688	1.985	10	20	BDCD	
CNCCCN[C@H](C)c1cc(C)ccc1O	817939975	IWIKVXHGSHYLHN-LLVKDONJSA-N	222.332	1.961	10	20	BDCD	
CC[C@H](O)[C@@H](C)C(=O)NCc1ccccc1O	822576125	JHUGAJSXYYVZLL-KOLCDFICSA-N	237.299	1.415	10	20	BDCD	
O=C(c1cc(O)cs1)N(CCCO)C1CC1	831448685	BRGVQWLMHWOYLE-UHFFFAOYSA-N	241.312	1.441	10	20	BDCD	
Cc1n[nH]c(C)c1/C=C1/SC(=S)NC1=O	915653635	FFKXWIHFEDIZGD-XVNBXDOJSA-N	239.325	1.515	10	20	BDCD	
C[C@H](O)CN(Cc1cc(F)ccc1O)C1CC1	848929744	ZMILPRWUJUBOCW-VIFPVBQESA-N	239.290	1.877	10	20	BDCD	
C[C@@H](O)CN(Cc1ccccc1O)C1CC1	848928621	JCEWOWOPMLVSLJ-SNVBAGLBSA-N	221.300	1.737	10	20	BDCD	
CNC[C@H](C)N[C@H](C)c1cc(F)ccc1O	854231699	JYUAWASRADADPQ-DTWKUNHWSA-N	226.295	1.790	10	20	BDCD	
Cc1ccc(CNC[C@@H](C)CCO)c(O)c1	877068498	XSZMJNWGUHYVHD-NSHDSACASA-N	223.316	1.809	10	20	BDCD	
O=C(O)[C@@H](NCc1ccc2c(c1)CCO2)C1CC1	86758679	KCUGSCJRFFIYIF-ZDUSSCGKSA-N	247.294	1.574	10	20	BDCD	
CCOC[C@@H]1CCCN(C(=O)CN=[N+]=[N-])C1	409431581	SQHDCKXWPMHTLA-SECBINFHSA-N	226.280	1.572	10	20	BDCD	
CN(C)c1ccc(CNc2ncnn2C)cc1	162172551	DGLXNLFKAOEJPP-UHFFFAOYSA-N	231.303	1.493	10	20	BDCD	
Oc1ccccc1CNc1ncc(F)cn1	158910431	ZSCZMWFVVYHPGQ-UHFFFAOYSA-N	219.219	1.933	10	20	BDCD	
C[C@H](C(=O)Nc1ccc(N)cc1)[C@@H](C)N	294873980	CQOFXJYUUJXALP-JGVFFNPUSA-N	207.277	1.191	10	20	BDCD	
C[C@@H](CCCCN)NCc1ccccc1O	309307491	DNRSQSJKBUVTDJ-NSHDSACASA-N	222.332	1.999	10	20	BDCD	
Cc1cc(O)c(CN2CCO[C@H]3C[C@H]32)cc1C	368143253	RVGLAHVIOJPGRC-OCCSQVGLSA-N	233.311	1.982	10	20	BDCD	
Cc1ccc([C@H](C)N[C@@H](C)CN)c(O)c1	817970077	KXZSUOZHJSOMTJ-UWVGGRQHSA-N	208.305	1.698	10	20	BDCD	
COc1ccc(N(C)CC[S@@](C)=O)cc1F	828041433	SZJATACVDNELSZ-MRXNPFEDSA-N	245.319	1.649	10	20	BDCD	
CN(C/C=C\c1ccc(N(C)C)cc1)CC(=O)O	901576753	IKQUYYNGHYPDHM-PLNGDYQASA-N	248.326	1.782	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](N)C2CC2)c1	841048132	BWEHSUKCJZRXDL-LBPRGKRZSA-N	236.315	1.228	10	20	BDCD	
COc1cccc(CNC[C@@H](N)C(C)C)c1O	841028808	HVPAINWJSJCTJG-LLVKDONJSA-N	238.331	1.474	10	20	BDCD	
COc1cccc(O)c1CN[C@H](C)CCN	841052046	UEQJDLWDOXDERU-SECBINFHSA-N	224.304	1.228	10	20	BDCD	
Cc1cccc(CN2CC[C@@H]3CNC[C@@H]32)c1O	841026649	NKNJRRYIXJHTMI-YPMHNXCESA-N	232.327	1.494	10	20	BDCD	
Cc1ccc(O)c(CNCC[C@H]2CCNC2)c1	841037798	XQRPCSDYQHTMAA-GFCCVEGCSA-N	234.343	1.790	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCC[N+](=O)[O-])c1	930217686	ZDDAEWXPEBKUFJ-MRVPVSSYSA-N	240.259	1.328	10	20	BDCD	
CN(C)c1ccc(CNC(=O)N2CC=CC2)cc1	866045206	HYIQIZHJWZBZFS-UHFFFAOYSA-N	245.326	1.834	10	20	BDCD	
Cc1ccc(C(=O)NOCC(F)F)c(O)c1O	760146070	FBIFFJKBOBYPFK-UHFFFAOYSA-N	247.197	1.333	10	20	BDCD	
COc1cccc(O)c1CN(C)C[C@@H](C)O	776521272	OLDSYTPAMGMXSQ-SECBINFHSA-N	225.288	1.213	10	20	BDCD	
CCN(C)c1ccc(CN(C)C[C@H](C)O)cc1	773751617	FWYJZVGZQNOHIQ-LBPRGKRZSA-N	236.359	1.955	10	20	BDCD	
CCOCCNC(=O)NCc1ccc(N)cc1	1353263063	ZLISUOVFBOQJTG-UHFFFAOYSA-N	237.303	1.105	10	20	BDCD	
COc1ccc(O)c(CN[C@@H](C)[C@@H](C)OC)c1	191696013	PXTOBBFHUTZBGK-VHSXEESVSA-N	239.315	1.914	10	20	BDCD	
C[C@@H](CN)NCc1ccc2c(c1)CCO2	162047135	YDEKOGOSGFVSJZ-VIFPVBQESA-N	206.289	1.058	10	20	BDCD	
C[C@@H](N[C@H]1C[C@H](CO)C1)c1ccc(F)cc1O	927149291	YBRKJSHWYGBWAS-FXPVBKGRSA-N	239.290	1.953	10	20	BDCD	
Nc1ccc(NC(=O)c2cnns2)cc1	59974217	BYKBDRCOUNBMII-UHFFFAOYSA-N	220.257	1.373	10	20	BDCD	
CCCOCC(=O)Nc1ccc(N)cc1	37024776	YVNVEZRWXSJIDG-UHFFFAOYSA-N	208.261	1.634	10	20	BDCD	
O=C1OCC[C@@]12CCCN2Cc1ccccc1O	190030781	WAKRXYMSUALBPC-AWEZNQCLSA-N	247.294	1.674	10	20	BDCD	
C[C@H](CCCO)CNCc1ccccc1O	294923799	YXSXZNNHFBFAGS-LLVKDONJSA-N	223.316	1.890	10	20	BDCD	
OCCN(Cc1ccccc1O)C1CCC1	275975917	LPAFXQHLDMVYOY-UHFFFAOYSA-N	221.300	1.739	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)CO	270777274	JCFDAXWQYYOWHN-UHFFFAOYSA-N	223.272	1.123	10	20	BDCD	
CC(=O)C(=O)COc1ccc(C)nc1Cl	808034959	ZSVUJGBPZZVWTM-UHFFFAOYSA-N	227.647	1.580	10	20	BDCD	
Cc1cccc(CN2CC[C@](F)(CO)C2)c1O	802661477	QMOUUZNNMQBOKO-CYBMUJFWSA-N	239.290	1.607	10	20	BDCD	
COc1ccc(O)c(CN2CC[C@@H]3CNC[C@@H]32)c1	385384775	PPNLXMIMDDIDIH-MFKMUULPSA-N	248.326	1.195	10	20	BDCD	
Cc1cccc(CNC/C=C/CO)c1O	717525633	PNACWTUMTDJRCE-NSCUHMNNSA-N	207.273	1.339	10	20	BDCD	
CC[C@H](O)CNCc1ccc(N2CC=CC2)cc1	819094761	LMDPSAHBUUYTPJ-HNNXBMFYSA-N	246.354	1.923	10	20	BDCD	
C[C@@H](N[C@H]1CCNC1)c1ccccc1O	817944565	GZWQSMVUSHXFHV-ZJUUUORDSA-N	206.289	1.405	10	20	BDCD	
CCOc1ccc(CNC2CC(N)C2)c(O)c1	906509268	DMZXLCPSEYSNEM-UHFFFAOYSA-N	236.315	1.370	10	20	BDCD	
CC(C)N(C)CCNC(=O)c1cc(O)cs1	732281866	DIUSWOFFFFEXRW-UHFFFAOYSA-N	242.344	1.524	10	20	BDCD	
CCN(CC)c1ccc(CN[C@H]2CCNC2)cc1	841045617	ZCDZYVYGMCYQOM-AWEZNQCLSA-N	247.386	1.984	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNCCC(N)=O	840938313	BJDXLZBCCBEDGG-UHFFFAOYSA-N	235.331	1.026	10	20	BDCD	
CN(C(=O)[C@@H](N)C(C)(C)C)c1ccc(N)cc1	877079463	ZGXLSODNDKYNRK-LLVKDONJSA-N	235.331	1.605	10	20	BDCD	
CC(=O)N1CC[C@@H](NCc2ccc(C)cc2O)C1	877647243	UUPRMELGNKLNFT-CYBMUJFWSA-N	248.326	1.411	10	20	BDCD	
C[C@@H](N[C@H](C)c1ncnn1C)c1ccccc1O	276696610	VKGVPXKGQMDEAH-NXEZZACHSA-N	246.314	1.933	10	20	BDCD	
Cc1cccc(CNCc2ccon2)c1O	162869459	GSNBEPHCQRFDPI-UHFFFAOYSA-N	218.256	1.978	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)CCO1	22145276	KDMDLLJWRQXWLR-SNVBAGLBSA-N	206.289	1.490	10	20	BDCD	
O=C(NCc1ccc[nH]1)c1cccc(O)c1O	187145733	VOWOZUNONDYXRA-UHFFFAOYSA-N	232.239	1.356	10	20	BDCD	
CCCNCc1ccc(N2CCN(C)CC2)cc1	34823188	ORYCNLBBJNAPCM-UHFFFAOYSA-N	247.386	1.938	10	20	BDCD	
CNC[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1	71142079	FDAVQGSQLYYLQZ-AWEZNQCLSA-N	247.386	1.794	10	20	BDCD	
COC(=O)[C@@H](C)NCc1ccc2c(c1)CCO2	42313029	JTTVVYYHCMLMCP-SECBINFHSA-N	235.283	1.273	10	20	BDCD	
Cc1ccc(O)c(CN(C)CCCN)c1	227743186	SJHZCBDDOXGMQK-UHFFFAOYSA-N	208.305	1.481	10	20	BDCD	
CCN(CCCO)c1ccc(OC)c(OC)c1	264205310	KETUEPDHQDDJHI-UHFFFAOYSA-N	239.315	1.913	10	20	BDCD	
C[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cc(F)ccc1O	817977311	HGJYDTGDOHKKSU-XDRUHAPNSA-N	236.290	1.400	10	20	BDCD	
C[C@@H]1CN=C(NC(=O)c2cc(O)cs2)S1	822482125	XYBLUFIXDITZAK-RXMQYKEDSA-N	242.325	1.675	10	20	BDCD	
N[C@H](CNCc1ccc2c(c1)CCO2)C1CC1	841049295	JKOONPMIUQLAJC-CYBMUJFWSA-N	232.327	1.448	10	20	BDCD	
COc1cccc(CNC[C@@H](C)CCO)c1O	97435948	ZZJPCKYWHGOAKS-JTQLQIEISA-N	239.315	1.509	10	20	BDCD	
COC(=O)CN[C@@H](C)c1cc(OC)ccc1O	19885505	YHFGHMNVBXATJG-QMMMGPOBSA-N	239.271	1.224	10	20	BDCD	
CC(=O)CCC(=O)NCc1ccc(N(C)C)cc1	171014389	MUTQOAZNJOQFMT-UHFFFAOYSA-N	248.326	1.738	10	20	BDCD	
CN(Cc1ccccc1O)C[C@@H]1COCCO1	1333027931	OPTMLZJYRPROTL-GFCCVEGCSA-N	237.299	1.239	10	20	BDCD	
COC(=O)C1(CNCc2cc(C)ccc2O)CC1	188691773	PUUWMCQURDMASL-UHFFFAOYSA-N	249.310	1.743	10	20	BDCD	
CN(C)CCCN[C@H]1CCc2cccc(O)c21	296126486	VPBFAMLFJOBPJI-LBPRGKRZSA-N	234.343	1.921	10	20	BDCD	
CCON(CC)C(=O)c1ccc(C)c(O)c1O	831467118	GNPALLUQMBNPSG-UHFFFAOYSA-N	239.271	1.820	10	20	BDCD	
CN(C)c1ccc(CN2CC[C@@H]2CO)cc1	934014716	NZZMRLSJGGEPKB-CYBMUJFWSA-N	220.316	1.319	10	20	BDCD	
C[C@H](O)CNCc1cc(F)c(N(C)C)cc1F	1118908508	BISORBNUTDYVLO-QMMMGPOBSA-N	244.285	1.501	10	20	BDCD	
COCCNCc1cc(F)cc(F)c1O	708390957	RWDOWKGRKMFUHM-UHFFFAOYSA-N	217.215	1.406	10	20	BDCD	
CC1(C)[C@H](O)C[C@H]1NCc1ccccc1O	163421522	KOGUUWCKIQKSKL-VXGBXAGGSA-N	221.300	1.641	10	20	BDCD	
COCCN(C)c1ccc(OC)c(OC)c1	63617134	YMIWOIJARVXEHQ-UHFFFAOYSA-N	225.288	1.786	10	20	BDCD	
OCCNCc1cccc(Cl)c1O	158471915	PKGAICHJFFEZAB-UHFFFAOYSA-N	201.653	1.128	10	20	BDCD	
C[C@@H](C[C@@H](C)O)NCc1ccc2c(c1)CCO2	228074550	OSKJWSZOUHNROG-WDEREUQCSA-N	235.327	1.871	10	20	BDCD	
CCN(Cc1cnn(C)n1)c1ccc(OC)cc1	289301181	CPEXYHVPGZDEEZ-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
NC1(CNCc2cc(F)ccc2O)CCCC1	849350395	YGVIIIPQZCPEPN-UHFFFAOYSA-N	238.306	1.892	10	20	BDCD	
COc1ccc(O)c(CNCc2cc(C)on2)c1	44692606	WJDHJAPPYNGCRZ-UHFFFAOYSA-N	248.282	1.987	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCc2c(CO)cccc21	409434883	RAFPXWRIYKVLCZ-UHFFFAOYSA-N	232.243	1.378	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@H]1C[C@H](O)C1)CC2	720935796	IMZKOUDRTPHHKO-YUSALJHKSA-N	233.311	1.740	10	20	BDCD	
CCCN(CCO)Cc1ccc(N)cc1	35364803	AJGDTMARNDEJLD-UHFFFAOYSA-N	208.305	1.473	10	20	BDCD	
CCONC(=O)NCc1cccc(OC)c1O	166489842	IXXMOPNXQITTBX-UHFFFAOYSA-N	240.259	1.152	10	20	BDCD	
O=C(NCc1ccccc1O)c1csnn1	157876106	KKIIBADVHHNZHH-UHFFFAOYSA-N	235.268	1.174	10	20	BDCD	
COc1cccc(O)c1CNCc1ccno1	843403195	VJQLIQMVBYQJCS-UHFFFAOYSA-N	234.255	1.679	10	20	BDCD	
CN(Cc1ccc(N(C)C)cc1)C(=O)CCO	902781181	IOMPAYIGUZETOF-UHFFFAOYSA-N	236.315	1.093	10	20	BDCD	
COc1cccc(CN[C@@H]2COC[C@@H]2C)c1O	699792029	VBQQRQYFFYCYBY-GXSJLCMTSA-N	237.299	1.525	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H]2O3)cc1	1122538499	ACLAIEMJNLMQJY-YNEHKIRRSA-N	246.310	1.247	10	20	BDCD	
CO[C@@H](C)C(=O)NCc1ccccc1O	136333773	BZMINBDNKSGFSD-QMMMGPOBSA-N	209.245	1.043	10	20	BDCD	
CCCOC(=O)c1ccc(C)c(O)c1O	60343464	YDXBWAHKZSJSCP-UHFFFAOYSA-N	210.229	1.973	10	20	BDCD	
COC[C@@H](C)NCc1cc(C)ccc1O	70954771	CWBMBRFQIDVQET-SNVBAGLBSA-N	209.289	1.825	10	20	BDCD	
Cc1n[nH]c(NC(=O)c2cccc(O)c2O)c1C	126649185	GMNPPYZOEOXUDR-UHFFFAOYSA-N	247.254	1.690	10	20	BDCD	
Oc1ccccc1CNCC[C@H]1CCOC1	230162482	DAHAPXXJMSHNIM-NSHDSACASA-N	221.300	1.908	10	20	BDCD	
NCC[C@@H]1CCN(Cc2ccccc2O)C1	723712723	RNROPVYEDNSJPK-LLVKDONJSA-N	220.316	1.563	10	20	BDCD	
CCC[C@H](O)C(=O)NCCc1ccc(N)cc1	911782287	HKUUZLPFVRFHCJ-LBPRGKRZSA-N	236.315	1.089	10	20	BDCD	
Oc1c(F)cccc1CNC[C@@H]1CCCN1	841035758	LKUCVAMQCBCHAM-JTQLQIEISA-N	224.279	1.373	10	20	BDCD	
C[C@H]1CN(Cc2cccc(F)c2O)C[C@@H](C)N1	843048943	BGZBMWVXYXRMAW-AOOOYVTPSA-N	238.306	1.714	10	20	BDCD	
CN(C)C1(CNC(=O)c2cc(O)cs2)CC1	842271591	LQMYQWJTVQDWGP-UHFFFAOYSA-N	240.328	1.278	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN(C)[C@H](C)CO	840949271	SUXLPNRMWANOHB-GFCCVEGCSA-N	236.359	1.874	10	20	BDCD	
O=C(NC1CC=CC1)c1c(F)ccc(O)c1O	789988250	DTVOARUXPMKUHU-UHFFFAOYSA-N	237.230	1.685	10	20	BDCD	
COc1ccc(CN[C@@H]2CCN(C)C2)cc1C	42545918	KLABIGYMNDUEKP-CYBMUJFWSA-N	234.343	1.797	10	20	BDCD	
CCOCC1(C)CCN(C(=O)CN=[N+]=[N-])CC1	409428965	HDANXNUUTUUDKD-UHFFFAOYSA-N	240.307	1.962	10	20	BDCD	
CNC[C@@H](C)NCc1ccc2c(c1)CCO2	162155307	BARNLDVEHHJHDL-SNVBAGLBSA-N	220.316	1.319	10	20	BDCD	
CNC(=O)C[C@H](C)NCc1cccc(C)c1O	322784275	LXMARSLATKRYHX-JTQLQIEISA-N	236.315	1.315	10	20	BDCD	
Cc1ccc(O)c(CN(CCO)C2CC2)c1	128125875	LPPCKAYXIRRPCP-UHFFFAOYSA-N	221.300	1.657	10	20	BDCD	
CC[C@@](C)(O)C(=O)NCc1ccccc1O	934936592	VHMGJCMQOIONEA-GFCCVEGCSA-N	223.272	1.169	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H]3C[C@@]3(CO)C2)c1	783734559	MQUWQRGQFOJVPM-RISCZKNCSA-N	249.310	1.215	10	20	BDCD	
Cc1ccc(C(=O)NCC2(C)CC2)c(O)c1O	780962319	KTMBHWSBNDOGCQ-UHFFFAOYSA-N	235.283	1.936	10	20	BDCD	
CCOCC(=O)CSc1nccs1	186264181	XUCJSBUNRNJYHE-UHFFFAOYSA-N	217.315	1.841	10	20	BDCD	
CCN1CCCN(Cc2ccc(N)cc2)CC1=O	1337838187	JTBRLDJOYURMCE-UHFFFAOYSA-N	247.342	1.323	10	20	BDCD	
COc1ccc(O)c(CNC2CSC2)c1	309065373	YZIKWVUGSJKAQR-UHFFFAOYSA-N	225.313	1.606	10	20	BDCD	
Cc1nc(CNC(=O)Nc2ccc(N)cc2)n[nH]1	392489345	BVJZZPBBAMSKGS-UHFFFAOYSA-N	246.274	1.017	10	20	BDCD	
CN(CCN)Cc1cc(Cl)ccc1O	54416790	ZEEMAHYOKCHQSJ-UHFFFAOYSA-N	214.696	1.436	10	20	BDCD	
CNCCN(C)Cc1cc(Cl)ccc1O	69800739	UWERSNQYSMYGTH-UHFFFAOYSA-N	228.723	1.697	10	20	BDCD	
COc1cccc(CNC[C@@H]2CCOC2)c1O	37738183	BXLPZQVJIQYZBW-JTQLQIEISA-N	237.299	1.527	10	20	BDCD	
CCCNC(=O)CNCc1ccc2c(c1)CCO2	37363086	HLLUSUYEWPUYTB-UHFFFAOYSA-N	248.326	1.237	10	20	BDCD	
CO[C@@H](CNCc1ccccc1O)C1CC1	292884432	CHPLSSKSPCZIBL-ZDUSSCGKSA-N	221.300	1.907	10	20	BDCD	
C[C@@H](CN)N[C@@H](C)c1ccc(N(C)C)cc1	817970475	WXTMJRLROFBMPS-QWRGUYRKSA-N	221.348	1.750	10	20	BDCD	
CCNCCN[C@H](C)c1ccc(C)cc1O	817951985	MMTDSDPECMJLBH-LLVKDONJSA-N	222.332	1.961	10	20	BDCD	
CCN(C)c1ccc([C@@H](C)NCCN)cc1	817934444	IQFRMASAHGLZHQ-LLVKDONJSA-N	221.348	1.752	10	20	BDCD	
OC[C@@H]1CCN1Cc1c(O)ccc2ccncc12	902631550	YXIOSPDWMQFKFO-NSHDSACASA-N	244.294	1.507	10	20	BDCD	
C[C@H]1COC[C@@H]1NC(=O)c1cc(O)cs1	928909408	DWTDRCJRHHMDAL-XPUUQOCRSA-N	227.285	1.218	10	20	BDCD	
CNC[C@H]1CCCN1Cc1ccc(N)cc1	1236421165	BDBGMRRGKPNINJ-CYBMUJFWSA-N	219.332	1.453	10	20	BDCD	
CC[C@@H](O)CN(C)c1ccc(OC)cc1OC	305229674	QXGWNGQCLNNWSW-SNVBAGLBSA-N	239.315	1.911	10	20	BDCD	
CN(CC(=O)N(C)C1CC1)Cc1ccccc1O	109771166	SRDLSMMVPDLWNN-UHFFFAOYSA-N	248.326	1.445	10	20	BDCD	
CO[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1	708413777	NYOASLDNIJRXAA-JTQLQIEISA-N	243.253	1.891	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)C1CCCC1	98074481	CAVPIKNCGCMORL-UHFFFAOYSA-N	249.310	1.947	10	20	BDCD	
N[C@@H]1CCC[C@@H](C(=O)NCc2ccccc2O)C1	168403636	XELJMMZJNPWMJB-ZYHUDNBSSA-N	248.326	1.526	10	20	BDCD	
Nc1ccc(CC(=O)N[C@@H]2CCC[C@H](N)C2)cc1	834598286	AWRKAKSVCZUXQR-QWHCGFSZSA-N	247.342	1.197	10	20	BDCD	
CCCN(Cc1ccccc1O)C(N)=O	108927330	TYKACSSPGPTLKG-UHFFFAOYSA-N	208.261	1.683	10	20	BDCD	
Cc1cc(O)c(CN(C)Cc2nnc[nH]2)cc1C	179793066	DAORWFZMQRQPSQ-UHFFFAOYSA-N	246.314	1.759	10	20	BDCD	
C[C@@H](NCCn1cccn1)c1ccccc1O	42538726	FHBIMASKKRAEEM-LLVKDONJSA-N	231.299	1.940	10	20	BDCD	
CO[C@H]1CCN(Cc2cc(F)ccc2O)C1	234889959	NTCSXYVSZNTXQR-NSHDSACASA-N	225.263	1.752	10	20	BDCD	
C[C@@H](C[C@@H](C)N)NCc1ccc2c(c1)CCO2	817902094	HZLRPDIFJKBNBF-MNOVXSKESA-N	234.343	1.837	10	20	BDCD	
COc1ccc(O)c(CNC(=O)c2cnco2)c1	759608568	NAUIIGBQSPRKKL-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
CC[C@@]1(C(=O)N(C)c2ccc(N)cc2)CCCN1	877077366	FTQPZZZACYYVAP-AWEZNQCLSA-N	247.342	1.764	10	20	BDCD	
C[C@H](CNCc1cccc(F)c1O)C(=O)O	1118331323	PFZNSNRPIXFOQZ-SSDOTTSWSA-N	227.235	1.342	10	20	BDCD	
CC[C@@H](C)C(=O)NCc1ccc(N)cc1	37666230	JNFJRAYWLVRTRP-SECBINFHSA-N	206.289	1.931	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H]1C[C@@H]1F	1521254366	APICYPHFDPICMA-UWVGGRQHSA-N	223.247	1.709	10	20	BDCD	
OCCCCNCc1cc(F)ccc1O	194530711	TWUIMVXSCZVOHI-UHFFFAOYSA-N	213.252	1.393	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)[C@H](C)CN1C	1120371047	NSKVUXFKFFFPJV-VXGBXAGGSA-N	233.359	1.793	10	20	BDCD	
CCOc1ccc(N(C)Cc2nncn2C)cc1	150727590	YLEUCWLQLSXYCN-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
OC[C@H](CC1CC1)NCc1ccccc1O	309560740	JEEQCYZKOAQYOJ-LBPRGKRZSA-N	221.300	1.643	10	20	BDCD	
COCC(COC)NCc1cccc(C)c1O	388426455	KPJPVVAJWZJLBF-UHFFFAOYSA-N	239.315	1.452	10	20	BDCD	
COC(=O)CN(C)Cc1cc(C)c(C)cc1O	171801724	XUCFCROLRJEZNU-UHFFFAOYSA-N	237.299	1.614	10	20	BDCD	
COc1cccc(CNC(=O)c2ccoc2)c1O	68488989	GSVKBIOXHQAORK-UHFFFAOYSA-N	247.250	1.924	10	20	BDCD	
COC1CCN(C(=O)Cc2ccc(N)cc2)CC1	37265765	MAAIHHXOPTYJLZ-UHFFFAOYSA-N	248.326	1.449	10	20	BDCD	
COc1ccc(O)c(CN2CCC[C@@H](N)C2)c1	41027945	DFFHIAXTDUIVOQ-LLVKDONJSA-N	236.315	1.324	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](C(=O)O)[C@@H]2C)c1	92942041	XHSUJZLWULQOQJ-JQWIXIFHSA-N	249.310	1.996	10	20	BDCD	
CCC[C@](C)(N)C(=O)NCCc1ccc(N)cc1	262568221	AKRXHGNAMVFCBI-AWEZNQCLSA-N	249.358	1.445	10	20	BDCD	
C[C@H](N)CN1CCCc2cc(CN)ccc21	843350373	NXWJBWZIMZXQBD-JTQLQIEISA-N	219.332	1.245	10	20	BDCD	
Nc1ccc(-n2cc(C[C@@H](O)C3CC3)nn2)cc1	849134715	MIFIDSUPRVMDQM-CYBMUJFWSA-N	244.298	1.163	10	20	BDCD	
CCCONC(=O)c1cc(O)cs1	844150519	OCNDGKCGLUSCKQ-UHFFFAOYSA-N	201.247	1.525	10	20	BDCD	
COc1ccc(N(C)C[C@H]2CCC(=O)O2)cc1	852209829	TXGPJMWKWVOLHB-GFCCVEGCSA-N	235.283	1.837	10	20	BDCD	
Cc1cc(C(=O)N(C)Cc2ccccc2O)n[nH]1	701180835	RAZIADGAIKBIDX-UHFFFAOYSA-N	245.282	1.696	10	20	BDCD	
Cc1ccc(O)c([C@H](C)N[C@@H]2CC(=O)N(C)C2)c1	273564588	JCVRFFBKBLRGON-WDEREUQCSA-N	248.326	1.582	10	20	BDCD	
C[C@H](O)[C@H](N)c1cccc(Br)c1O	95682424	AAFUDAAVJMVDRI-XNCJUZBTSA-N	246.104	1.535	10	20	BDCD	
COC[C@@H]1CN(C(=O)CN=[N+]=[N-])C[C@H]1C	409434041	NYFJDOPLAUFQQR-SFYZADRCSA-N	212.253	1.038	10	20	BDCD	
Cc1cccc(CN[C@H](C)C[C@H](C)O)c1O	164591606	AQYRANUDWXQLOD-MNOVXSKESA-N	223.316	1.950	10	20	BDCD	
C[C@H]1C[C@@H](O)CN(C(=O)Cc2ccc(N)cc2)C1	401810294	SRBIWWFOMTUGDA-GXFFZTMASA-N	248.326	1.041	10	20	BDCD	
CC[C@H](NCc1ccc2c(c1)CCO2)[C@H](C)O	386857607	JBHXACFPALARIC-GWCFXTLKSA-N	235.327	1.871	10	20	BDCD	
CCN1C[C@H](NCc2cc(C)ccc2O)CC1=O	391601101	JSXTZGQZPLYNTE-GFCCVEGCSA-N	248.326	1.411	10	20	BDCD	
COc1cccc(CNC(=O)C2CC2)c1O	68488715	KAVGQWCDKZZXDZ-UHFFFAOYSA-N	221.256	1.427	10	20	BDCD	
COc1cccc(CN(C)C[C@H](C)OC)c1O	289211768	CAFOEZPRYOJURK-JTQLQIEISA-N	239.315	1.868	10	20	BDCD	
CNCCC(=O)N(C)Cc1ccc(N(C)C)cc1	43604848	JGYOVZMUZLISNK-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
C[C@H](N[C@@H]1CCC[C@H]1O)c1ccccc1O	248384901	GJRWTRFGDASHGU-UFGOTCBOSA-N	221.300	1.956	10	20	BDCD	
CC(C)[C@H](O)C(=O)NCc1ccccc1O	292328001	WYWJICIYQGQFFQ-NSHDSACASA-N	223.272	1.025	10	20	BDCD	
C[C@@H](N[C@@H]1CCCNC1)c1cc(F)ccc1O	817940481	ICLBGZVTQSBFHF-MWLCHTKSSA-N	238.306	1.934	10	20	BDCD	
COc1cccc(O)c1CN(C)C1(CO)CC1	827903670	NLZJUIZPBCHYPY-UHFFFAOYSA-N	237.299	1.358	10	20	BDCD	
O=C1CC[C@@H](CSc2nccs2)O1	821078574	UWLSRJAQWJJLJS-LURJTMIESA-N	215.299	1.941	10	20	BDCD	
CN(C)c1ccc(CNCC2(N)CC2)cc1	904451635	XNUPPHIJRDORNB-UHFFFAOYSA-N	219.332	1.334	10	20	BDCD	
Cc1cc(NC(=O)c2cc(O)cs2)n(C)n1	731868788	VMPGZVUBQSRNTN-UHFFFAOYSA-N	237.284	1.748	10	20	BDCD	
O=[N+]([O-])c1ccc(O)c(CNCc2cocn2)c1	730819421	XBODCOUPDZSGQB-UHFFFAOYSA-N	249.226	1.578	10	20	BDCD	
Cc1cc(O)c(CN[C@H]2CCNC2)cc1C	841045407	UHSXANOXIOPWEJ-LBPRGKRZSA-N	220.316	1.461	10	20	BDCD	
O=C(CCC1CC1)NCc1ccc(O)cc1O	910951270	QNPPVOQCPPUKAW-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CC(C)[C@H](N)CNCc1cccc(F)c1O	841029033	DKLSRZAZGSAWLT-LLVKDONJSA-N	226.295	1.604	10	20	BDCD	
CN(C)c1ccc(CNC/C=C/CO)cc1F	850357210	BBVJNSODNRTLCL-ONEGZZNKSA-N	238.306	1.530	10	20	BDCD	
Cc1ccc(CNCc2nnc(C)n2C)c(O)c1	1331053814	SJDRLDZBZNOBHL-UHFFFAOYSA-N	246.314	1.427	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)O	786989446	RUCVGIQKMNDAFM-JTQLQIEISA-N	236.315	1.058	10	20	BDCD	
COc1ncccc1C(=O)N1CC(N=[N+]=[N-])C1	409424354	URAFVGKOEIXLKQ-UHFFFAOYSA-N	233.231	1.225	10	20	BDCD	
O=C(Nc1nncs1)c1cccc(O)c1O	163266128	GHYGDBFLGAEPMX-UHFFFAOYSA-N	237.240	1.202	10	20	BDCD	
COc1ccc(O)c(CNC[C@H](O)C(C)C)c1	164696636	LZQOXKWXVRTJAS-ZDUSSCGKSA-N	239.315	1.507	10	20	BDCD	
OC[C@@H]1CCCN1Cc1ccccc1O	164784535	CCQPFHFRXMZFKI-NSHDSACASA-N	207.273	1.349	10	20	BDCD	
CCN[C@@H](C)C(=O)N[C@H](C)c1ccccc1O	877255649	GMNNGZXJLSKZIH-ZJUUUORDSA-N	236.315	1.567	10	20	BDCD	
Cc1cccc(O)c1CN[C@H]1C[C@@H](O)C1	877574092	AOEFLXAKRLDVDT-AOOOYVTPSA-N	207.273	1.314	10	20	BDCD	
C[C@@H](NCC(=O)NC1CC1)c1ccccc1O	36782452	RMBBXNQVBVOLGT-SECBINFHSA-N	234.299	1.321	10	20	BDCD	
C[C@H](NCCCO)c1cc(F)cc(F)c1O	134904215	CPBSONISPXIQSF-ZETCQYMHSA-N	231.242	1.703	10	20	BDCD	
Cc1cccc(CNCC[C@H]2CCNC2)c1O	841036435	NLHZPWXGIHQVDJ-GFCCVEGCSA-N	234.343	1.790	10	20	BDCD	
CCNCCNCc1c(O)cccc1OC	841037224	RALYKLNOUNYZNL-UHFFFAOYSA-N	224.304	1.100	10	20	BDCD	
Cc1ccc(CN[C@H]2C[C@@H](CO)C2)c(O)c1	877666489	CSDIWPKTQSFKDR-KLPPZKSPSA-N	221.300	1.561	10	20	BDCD	
CCCOC(=O)NCc1ccc(O)cc1O	867417448	VXPDOJJHWXQIME-UHFFFAOYSA-N	225.244	1.734	10	20	BDCD	
COC[C@H](NCCc1ccc(N)cc1)C1CC1	398029819	NANNEEPTYSHZII-AWEZNQCLSA-N	234.343	1.826	10	20	BDCD	
CCn1[nH]cnc1=NCc1cccc(OC)c1O	1336505035	GNZHFIWFIARZAC-UHFFFAOYSA-N	248.286	1.046	10	20	BDCD	
NC[C@H]1CCCC[C@@H]1NCc1ccc(N)cc1	1352788135	DBEWNIAXPIFPQA-OCCSQVGLSA-N	233.359	1.876	10	20	BDCD	
C[C@H](O)CSc1ncc(C(=O)O)s1	1593472508	PDIMMSHYXWDENM-BYPYZUCNSA-N	219.287	1.314	10	20	BDCD	
c1cc2c(cc1CN[C@@H]1CCCNCC1)CCO2	841057766	NHCPCPPTTLVKSU-CQSZACIVSA-N	246.354	1.853	10	20	BDCD	
C[C@@H]1CCNC[C@@H]1NCc1ccc(N(C)C)cc1	841059393	RMGNIIKWWRGANC-DOMZBBRYSA-N	247.386	1.840	10	20	BDCD	
CC(C)[C@@H](CO)CNCc1cc(F)ccc1O	394031186	CJLZEMSTTVPYAS-LLVKDONJSA-N	241.306	1.885	10	20	BDCD	
CN(Cc1csnn1)Cc1ccccc1O	120066068	HUXGALATYXRYOK-UHFFFAOYSA-N	235.312	1.876	10	20	BDCD	
COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2C)c1	114543229	IPCRGUJBKKEIDR-LDYMZIIASA-N	235.283	1.673	10	20	BDCD	
Cn1cc(C(=O)NCc2ccccc2O)cn1	82279304	BTDIUGGCTBTPDR-UHFFFAOYSA-N	231.255	1.056	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2N)cc1	294643774	BKNBPBCUFFCEJY-NGERZBJRSA-N	245.326	1.581	10	20	BDCD	
N[C@@H](CN[C@@H]1CCc2cccc(O)c21)C1CC1	817964766	HJHGBZGWEIIBHN-NWDGAFQWSA-N	232.327	1.706	10	20	BDCD	
O=C(NCc1ccccc1O)NOC1CCC1	836569739	KPZURDBEOPLJRU-UHFFFAOYSA-N	236.271	1.676	10	20	BDCD	
C[C@@H]1NCCN(Cc2cccc(F)c2O)[C@H]1C	843057227	GXSVQLWCTJRGIF-UWVGGRQHSA-N	238.306	1.714	10	20	BDCD	
Cc1cccc(CN2Cc3cnn(C)c3C2)c1O	877632522	CSAGPZAPOKFWMQ-UHFFFAOYSA-N	243.310	1.950	10	20	BDCD	
CC(=O)OC[C@@H](C)NCc1cc(C)ccc1O	895583164	WIYUZLYPYJFRNZ-SNVBAGLBSA-N	237.299	1.742	10	20	BDCD	
CC[C@H](NC(=O)c1cccc(O)c1O)C(F)F	833204437	NHZSPGZKPMEUCH-ZETCQYMHSA-N	245.225	1.871	10	20	BDCD	
C[C@@H](O)CCN(C)C(=O)Cc1ccc(N)cc1	157067386	RSBWKDLIMFBRCE-SNVBAGLBSA-N	236.315	1.041	10	20	BDCD	
CCCNC(=S)NCc1cccn1C	231647872	RWJYVOOJAZYZON-UHFFFAOYSA-N	211.334	1.399	10	20	BDCD	
COC(=O)C[C@H]1CCCN1Cc1ccccc1O	180195765	LUBIUSZYQRYTRW-GFCCVEGCSA-N	249.310	1.920	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H]2CC(=O)N(C)C2)c1	264977736	SWVHMRQKIXUGLI-LLVKDONJSA-N	234.299	1.021	10	20	BDCD	
c1cc2c(cc1CN[C@@H]1CCOC1)CCO2	87416064	GSXJJJVEYWLXIA-GFCCVEGCSA-N	219.284	1.500	10	20	BDCD	
COc1ccc(O)c(CNCC2(C)COC2)c1	94721957	DGRRWYJESOUZRZ-UHFFFAOYSA-N	237.299	1.527	10	20	BDCD	
CC[C@@H]1CN(Cc2cc(F)ccc2O)C[C@@H]1O	272355106	DQWGERXUKJTDKS-RNCFNFMXSA-N	239.290	1.734	10	20	BDCD	
O=C(CC1CC1)NCc1ccc(O)c(O)c1	272291486	HCVHNCSWKQNWKA-UHFFFAOYSA-N	221.256	1.514	10	20	BDCD	
C[C@H](NC/C=C\CO)c1ccccc1O	717533038	MAJPWVZJDWTZEC-LWTINBJPSA-N	207.273	1.591	10	20	BDCD	
Cc1cc(Cl)cc(CN[C@@H](C)C(=O)O)c1O	820976667	QTDIJYHLVVCRNI-ZETCQYMHSA-N	243.690	1.917	10	20	BDCD	
O=C(O)CCCCOC(=O)c1cc(O)cs1	738576187	XZCYDKULNNMLKM-UHFFFAOYSA-N	244.268	1.865	10	20	BDCD	
C[C@H](N)[C@H]1CCN(Cc2cccc(F)c2O)C1	843058755	XNTFKSGCMNVVJB-UWVGGRQHSA-N	238.306	1.700	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@@H](N)C1CC1	841052138	ZVPPVJVBEIAGOK-OAHLLOKOSA-N	247.386	1.888	10	20	BDCD	
Cc1cc(O)c(CN2C[C@@H](N)[C@H](C)C2)cc1C	843120581	QKMWNEXUVRYABP-DGCLKSJQSA-N	234.343	1.788	10	20	BDCD	
CNC[C@H](C)N[C@H](C)c1cc(OC)ccc1O	854231375	GSKJPQUSAUWNCD-VHSXEESVSA-N	238.331	1.659	10	20	BDCD	
COc1ccc(O)c(CNCC[C@H](C)O)c1	82992625	VWPVXWQCCLLKNA-VIFPVBQESA-N	225.288	1.261	10	20	BDCD	
CCOC[C@H]1CN(CCN=[N+]=[N-])C[C@@H]1C	409429902	HYUXHBQDFBDADH-VHSXEESVSA-N	212.297	1.901	10	20	BDCD	
CN(C(=O)[C@H]1[C@H]2C(=O)CC[C@H]21)c1ccc(N)cc1	1263168847	XZLFUYRACNEVON-RAIGVLPGSA-N	244.294	1.457	10	20	BDCD	
C[C@H]1C[C@@H](NCc2ccccc2O)CO1	401968297	IBLUXNBKZIKOMC-GXSJLCMTSA-N	207.273	1.659	10	20	BDCD	
NC(=O)C[C@@H]1CCCN(Cc2ccccc2O)C1	179582769	KPPBSRBTRZUHMY-NSHDSACASA-N	248.326	1.480	10	20	BDCD	
CCCCN(CC(N)=O)Cc1ccc(N)cc1	35366627	OFKNIKMNSGIFLZ-UHFFFAOYSA-N	235.331	1.356	10	20	BDCD	
CCN(C)C(=O)CNCc1ccc(N(C)C)cc1	185182152	ISVAATQYKQKCNQ-UHFFFAOYSA-N	249.358	1.321	10	20	BDCD	
C[C@]1(NCc2ccccc2O)CCOC1=O	289746927	HYWXJBLVMBEBBS-LBPRGKRZSA-N	221.256	1.187	10	20	BDCD	
Cc1ccc(O)c(CN2C[C@H](C)NC[C@@H]2C)c1	86467020	PRPHOYXHQQRYFY-RYUDHWBXSA-N	234.343	1.883	10	20	BDCD	
C[C@@H](NCCC(=O)O)c1cc(F)ccc1O	87111354	WYGILOZFVXPHBN-SSDOTTSWSA-N	227.235	1.657	10	20	BDCD	
C[C@@H](NC1CNC1)c1cc(F)ccc1O	817955871	JXJUSBWVJHJGQG-SSDOTTSWSA-N	210.252	1.154	10	20	BDCD	
C[C@@H](NC(=O)[C@@](C)(O)C1CC1)c1ccccc1O	827946286	CNPRXBNPJVGTKX-OTYXRUKQSA-N	249.310	1.730	10	20	BDCD	
CC[C@@H](N)CNCc1cc(Cl)ccc1O	841070209	MQNDACOYDJVLMZ-SNVBAGLBSA-N	228.723	1.873	10	20	BDCD	
CCN(C(=O)c1cc(O)cs1)[C@@H](C)CO	854663328	DBOFHRREOTXRJK-ZETCQYMHSA-N	229.301	1.297	10	20	BDCD	
Cc1cccc(O)c1CN1CCS(=O)CC1	876692991	LXBFUYSJYKDRAR-UHFFFAOYSA-N	239.340	1.265	10	20	BDCD	
C[C@@H](NCc1cnon1)c1ccccc1O	879649425	SLISKKVANAIERZ-MRVPVSSYSA-N	219.244	1.626	10	20	BDCD	
CC1(NC(=O)/C=C\c2ccc(O)c(O)c2)COC1	870664776	YKQDAHWCNQMPLC-HYXAFXHYSA-N	249.266	1.016	10	20	BDCD	
C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)O	49357094	PSWUROCAAJEDNB-NXEZZACHSA-N	236.315	1.876	10	20	BDCD	
Nc1ccc(CC(=O)NC[C@H]2CCCCO2)cc1	42811296	VDXNPHKIETTZAG-CYBMUJFWSA-N	248.326	1.497	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)C[S@](C)=O)c1	164301263	VZIPTOJJZANOFJ-QLJPJBMISA-N	241.356	1.557	10	20	BDCD	
C[C@@H](NCc1cccc(Cl)c1O)C(=O)O	165157944	OMFMMDPURROWJV-ZCFIWIBFSA-N	229.663	1.608	10	20	BDCD	
NC1(CNCc2ccc3c(c2)CCCO3)CC1	258995180	DSSSOEVJNUNEER-UHFFFAOYSA-N	232.327	1.593	10	20	BDCD	
O=C(O)c1nccnc1NCc1ccccc1O	1602579795	PHBIBWIRGFNHFK-UHFFFAOYSA-N	245.238	1.493	10	20	BDCD	
Cc1cccc(CN2CCNC(=O)[C@@H]2C)c1O	179920681	SNWZCCFIPYJOHV-JTQLQIEISA-N	234.299	1.021	10	20	BDCD	
C[C@@H](C(=O)NCc1ccc(O)c(O)c1)C1CC1	182526777	ONUDVEIMGXUKFY-MRVPVSSYSA-N	235.283	1.760	10	20	BDCD	
COc1cccc(CN[C@H]2C[C@@H](O)C2)c1O	294948201	VSFHEAIPPJRHOG-AOOOYVTPSA-N	223.272	1.014	10	20	BDCD	
CC[C@H]1C(=O)NCCN1Cc1cc(C)ccc1O	93050556	HFFCISUIIAOTNF-LBPRGKRZSA-N	248.326	1.411	10	20	BDCD	
C[C@H]1CN(C(=O)c2cc(O)cs2)CCO1	731865033	IIQYYPNUGKBKJS-ZETCQYMHSA-N	227.285	1.315	10	20	BDCD	
C[C@H](CN)CNCc1c(O)ccc(Cl)c1F	841047694	BSZSBOUZVIFEHL-SSDOTTSWSA-N	246.713	1.869	10	20	BDCD	
Cc1ccc(CNC[C@H](O)C(C)C)c(O)c1	877037623	SZGFBRNBDBUHOM-ZDUSSCGKSA-N	223.316	1.807	10	20	BDCD	
Cc1ccc(CN2CC[C@@H](CC(N)=O)C2)c(O)c1	877535516	PEVQBNRFOAXRDH-NSHDSACASA-N	248.326	1.398	10	20	BDCD	
C[C@H](NCCO)c1ccc(N(C)C)cc1	37250488	QRESTVSSBZKUFF-JTQLQIEISA-N	208.305	1.396	10	20	BDCD	
CO[C@@H](C)[C@@H](C)NC(=O)Nc1ccc(N)cc1	841299615	LMYFDNWUKKPWAT-BDAKNGLRSA-N	237.303	1.814	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](C(N)=O)C2)c1	157194694	OZYYKNWJWLXBGL-SNVBAGLBSA-N	234.299	1.008	10	20	BDCD	
COc1ccc(N(C)Cc2cn(C)nn2)cc1	844352662	BBTKKLMIXDAXOZ-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
CN1C[C@H](N[C@H]2CCc3cccc(O)c32)CC1=O	297509513	CLBFIDQYEITBBP-MNOVXSKESA-N	246.310	1.200	10	20	BDCD	
CO[C@@H]1COC[C@@H]1NCc1ccc(C)cc1O	877586960	ZQTFFZOGPHGKHF-WCQYABFASA-N	237.299	1.204	10	20	BDCD	
CCN(CCC(=O)OC)Cc1ccccc1O	179562367	YDFFIZMFMOZKHS-UHFFFAOYSA-N	237.299	1.777	10	20	BDCD	
CC[C@H](CO)N[C@H](C)c1cc(OC)ccc1O	20195337	MBOKSNBRCAFLER-NXEZZACHSA-N	239.315	1.822	10	20	BDCD	
COc1ccc(O)c([C@@H](C)NCCN)c1	37712457	FHIYHFGNJWNNRJ-MRVPVSSYSA-N	210.277	1.010	10	20	BDCD	
CN(Cc1ccccc1O)Cc1cncn1C	177065176	URBNJKSJZLFGOZ-UHFFFAOYSA-N	231.299	1.758	10	20	BDCD	
CO[C@@H](C)CCC(=O)NCc1ccc(N)cc1	228490591	IAQWKRQGEKVSJY-JTQLQIEISA-N	236.315	1.700	10	20	BDCD	
CC[C@@H](O)CCNCc1cc(F)ccc1O	226616543	SDLVTNZXHNJKAD-LLVKDONJSA-N	227.279	1.782	10	20	BDCD	
O=C(COCC1CC1)NCc1ccccc1O	299464586	DDRXRIWCUXCBPD-UHFFFAOYSA-N	235.283	1.435	10	20	BDCD	
O=C(CCCF)NCCc1ccc(O)c(O)c1	830531536	JTESXBMXUAJJKV-UHFFFAOYSA-N	241.262	1.506	10	20	BDCD	
C[C@@H](N)C[C@@H](C)NCc1cccc(F)c1O	843129581	PXIDOIYLXMHSMR-RKDXNWHRSA-N	226.295	1.747	10	20	BDCD	
CN[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1C	848415406	UETJJEVZMMYINS-NSHDSACASA-N	249.358	1.285	10	20	BDCD	
COC[C@H](C)NC(=O)c1ccc(C)c(O)c1O	751530538	NOHKKBFBQFCCAX-QMMMGPOBSA-N	239.271	1.171	10	20	BDCD	
CC1(C)[C@@H](NC(=O)c2cc(O)cs2)C[C@H]1O	779454373	OFXYHRFAMFZCKW-DTWKUNHWSA-N	241.312	1.343	10	20	BDCD	
c1cc2c(cc1CN[C@H]1CCCNC1)CCO2	84516339	XHDMOMAWLFUTIR-ZDUSSCGKSA-N	232.327	1.463	10	20	BDCD	
Cc1nnccc1C(=O)NCc1ccccc1O	701797712	LTWODGCBIGAIOC-UHFFFAOYSA-N	243.266	1.421	10	20	BDCD	
C[C@H]1C[C@@H](NCc2ccccc2O)CCN1	709372056	SYVZTLIIAKYDFZ-JQWIXIFHSA-N	220.316	1.622	10	20	BDCD	
CC[C@H](N[C@H](C)c1ccccc1O)C(=O)O	1589570279	NPDLWPQGACLQKJ-SCZZXKLOSA-N	223.272	1.906	10	20	BDCD	
COc1cccc(CNC(C)(C)C(=O)O)c1O	1599674809	ZSQYEXFVAZSRGY-UHFFFAOYSA-N	239.271	1.354	10	20	BDCD	
O=C(O)C1(CNCc2ccccc2O)CCC1	854244404	DQBAMIMRFMHENT-UHFFFAOYSA-N	235.283	1.737	10	20	BDCD	
CC(C)n1nnnc1Sc1nccs1	60218828	DHMFUBZZLHPXLY-UHFFFAOYSA-N	227.318	1.862	10	20	BDCD	
CC[C@](C)(O)CNCc1cc(F)ccc1O	180425006	STJAIKVZDFSFTA-LBPRGKRZSA-N	227.279	1.782	10	20	BDCD	
Cc1nc(C)c(C(=O)NCc2ccccc2O)o1	135839230	LXQYIVJTDZFNDO-UHFFFAOYSA-N	246.266	1.927	10	20	BDCD	
CO[C@H](C)CNCc1ccc2c(c1)CCO2	191202140	VSRIFYVAPMRJBL-SNVBAGLBSA-N	221.300	1.746	10	20	BDCD	
C[C@H](NCC(C)(C)O)c1ccccc1O	83461040	DBRYTHBIAFUBQP-VIFPVBQESA-N	209.289	1.814	10	20	BDCD	
COc1ccc(O)c([C@H](C)NC(=O)C(F)F)c1	194775476	AZWRLIIJKCWQEF-LURJTMIESA-N	245.225	1.843	10	20	BDCD	
COCC[C@@H](CO)N[C@H](C)c1ccccc1O	281541117	IQXSFCLNWLHEFE-MNOVXSKESA-N	239.315	1.440	10	20	BDCD	
CC(=O)C(=O)COc1ccccc1[N+](=O)[O-]	808012976	VVNJVYZLTYERGV-UHFFFAOYSA-N	223.184	1.132	10	20	BDCD	
Cc1ccc(C(=O)N2CCO[C@H]3C[C@@H]32)c(O)c1O	816901419	LQFKTCLNXCDHGP-UWVGGRQHSA-N	249.266	1.020	10	20	BDCD	
CCCNC(=N)NCc1ccc(OC)cc1O	849024888	DISJSNCCRJCWRD-UHFFFAOYSA-N	237.303	1.425	10	20	BDCD	
CC1=NNC(=O)[C@H]1Sc1ncc(Cl)s1	918096837	YHCJCWSEFBTHTQ-YFKPBYRVSA-N	247.732	1.763	10	20	BDCD	
NCc1ccc2c(c1)CCCN2C[C@H]1CCNC1	843351322	KBHZUHXEZWKBGY-ZDUSSCGKSA-N	245.370	1.507	10	20	BDCD	
CS/C=C\C(=O)NCc1ccc(O)c(O)c1	778919129	VAGUUUFRHLDQMN-PLNGDYQASA-N	239.296	1.591	10	20	BDCD	
COc1ccc(O)c(CN2C[C@@H](O)[C@H](C)C2)c1	897681364	SQYCQZDEEOPFET-NOZJJQNGSA-N	237.299	1.213	10	20	BDCD	
Cc1cc(CNCc2cc(F)ccc2O)ncn1	779101128	LIJPUOPHFLWBDJ-UHFFFAOYSA-N	247.273	1.920	10	20	BDCD	
CNC[C@H]1CCCN1Cc1ccccc1O	169233844	JPUWJPNXZJGZHY-GFCCVEGCSA-N	220.316	1.576	10	20	BDCD	
O=C(N[C@@H]1C=CCCC1)c1cccc(O)c1O	185835985	VSKDLYIKKJCMMB-SECBINFHSA-N	233.267	1.936	10	20	BDCD	
Cc1n[nH]cc1CNC(=O)c1cccc(O)c1O	126325432	YHSNMOGSRFFPDJ-UHFFFAOYSA-N	247.254	1.059	10	20	BDCD	
Oc1ccc(Cl)cc1CN1CC[C@@H](O)C1	128082804	WVHGSLIFJYTGIM-SNVBAGLBSA-N	227.691	1.612	10	20	BDCD	
OC[C@H]1CCCN1Cc1ccccc1O	128550266	CCQPFHFRXMZFKI-LLVKDONJSA-N	207.273	1.349	10	20	BDCD	
COc1cccc(CNCCSC)c1O	68890379	XYJCUAGNXMRIEP-UHFFFAOYSA-N	227.329	1.853	10	20	BDCD	
CCC[C@H](O)CNC(=O)Cc1ccc(N)cc1	156976558	PKVXWMSFYQUZFM-LBPRGKRZSA-N	236.315	1.089	10	20	BDCD	
C[C@H](O)CNCc1c(O)cccc1Cl	83551128	ONWIJCDMVUKNTL-ZETCQYMHSA-N	215.680	1.516	10	20	BDCD	
CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@@H]1O	272038317	ZRIADYVQSWNTBG-YPMHNXCESA-N	235.327	1.903	10	20	BDCD	
CC[C@@H](CO)N(C)Cc1ccccc1O	295027393	CVNCIPZGPIYXGH-NSHDSACASA-N	209.289	1.595	10	20	BDCD	
OC[C@H]1CCCN(Cc2ccccc2O)CC1	294100235	RZZTZBIDJZAPRL-LBPRGKRZSA-N	235.327	1.987	10	20	BDCD	
CC(C)C(=O)OCC(=O)c1ccc(O)c(O)c1	916590110	JWRNMNQNQFHJSO-UHFFFAOYSA-N	238.239	1.480	10	20	BDCD	
Cc1cccc(CN2C[C@H](C)NC[C@@H]2C)c1O	843120113	XVAXHMUNUWWCIZ-RYUDHWBXSA-N	234.343	1.883	10	20	BDCD	
CN(Cc1cc(F)ccc1O)CC1(C)COC1	862477762	QLIHVLQELKTJHU-UHFFFAOYSA-N	239.290	2.000	10	20	BDCD	
Cc1ccc(CN2CC(=O)N[C@@H](C)C2)c(O)c1	877568095	XKFKPGYBFXNBCC-JTQLQIEISA-N	234.299	1.021	10	20	BDCD	
CN(CC1CC1)C(=O)NCc1ccc(N)cc1	1338800340	YTXAFLINZFRBRF-UHFFFAOYSA-N	233.315	1.820	10	20	BDCD	
Nc1ccc(N2CC[C@@H](O)[C@@H](CCF)C2)cc1	409425352	AJLIYYXIJJINKF-GXFFZTMASA-N	238.306	1.816	10	20	BDCD	
Oc1ccccc1CNC[C@H]1CCCNC1	162935787	AEQWHIYBHPQMED-NSHDSACASA-N	220.316	1.481	10	20	BDCD	
CNC1(C(=O)N(C)Cc2ccccc2O)CCC1	311033359	TVSNGPCGESGCJY-UHFFFAOYSA-N	248.326	1.493	10	20	BDCD	
CN(CC(=O)N(C)C)Cc1cc(F)ccc1O	179886644	SEIYJTAIKPKSKW-UHFFFAOYSA-N	240.278	1.051	10	20	BDCD	
C[C@@H]1CNCCN1Cc1ccccc1O	107093369	PTIIEYIJBSMKBU-SNVBAGLBSA-N	206.289	1.186	10	20	BDCD	
CC[C@@H](NC[C@H](C)O)c1ccccc1O	35601762	GLPQHFJETHNBNS-GXSJLCMTSA-N	209.289	1.814	10	20	BDCD	
CC(C)OCCNC(=O)Cc1ccc(N)cc1	159814304	WDZBTSHVGPZTSB-UHFFFAOYSA-N	236.315	1.353	10	20	BDCD	
CNC[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1	92135706	BOMBDRPPTRBQTL-LLVKDONJSA-N	249.358	1.224	10	20	BDCD	
COCCCNC(=O)c1c(F)ccc(O)c1O	276680894	OVKHUIZFBDFDJA-UHFFFAOYSA-N	243.234	1.003	10	20	BDCD	
C[C@H](CCN)NCc1cc(Cl)ccc1O	841052048	UFVLYIXZSNREDL-MRVPVSSYSA-N	228.723	1.873	10	20	BDCD	
COc1ccc(O)c(CN(C)CCC(=O)O)c1	86774932	CRORTLVNUWXGBB-UHFFFAOYSA-N	239.271	1.307	10	20	BDCD	
C[C@@H](O)[C@@H]1CCCN(c2ccc(N)cc2)C1	409434015	ZOWURHCKYJJOEL-GHMZBOCLSA-N	220.316	1.866	10	20	BDCD	
CNC[C@@H]1CCCN1Cc1ccc(N)cc1	1336284632	BDBGMRRGKPNINJ-ZDUSSCGKSA-N	219.332	1.453	10	20	BDCD	
CC(=O)C(=O)COc1ccc(C(=O)O)c(C)c1	1589020449	CKLPZODJLSYEHZ-UHFFFAOYSA-N	236.223	1.230	10	20	BDCD	
Cc1cccc(CN[C@H](C)C[S@@](C)=O)c1O	164410423	XZLIAZLAGMVDIL-HWPZZCPQSA-N	241.356	1.557	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)[C@@H](C)C(=O)O	901443929	BRGRNHOYYKWIOT-ZJUUUORDSA-N	249.310	1.820	10	20	BDCD	
C[C@H]1OCCN(Cc2ccc(N)cc2)[C@@H]1C	380443499	SCMGSQBNQXGIAO-GHMZBOCLSA-N	220.316	1.878	10	20	BDCD	
CC(=O)C(=O)CSc1nnc(C(C)(C)C)[nH]1	289542296	FNUPGYQRQSDXTH-UHFFFAOYSA-N	241.316	1.352	10	20	BDCD	
CC(=O)C(=O)COc1cc(F)ccc1F	808021447	NGDCTNWRGWJBJA-UHFFFAOYSA-N	214.167	1.502	10	20	BDCD	
Cc1cccc(CN2CC[C@H]([C@H](C)N)C2)c1O	843056955	DEEFFOSCOIUEPO-RYUDHWBXSA-N	234.343	1.870	10	20	BDCD	
CC[C@@H](C)C[C@H](N)C(=O)Nc1ccc(N)cc1	911660890	NWISYQBOKOCACX-SKDRFNHKSA-N	235.331	1.971	10	20	BDCD	
COC[C@@H](C)NC(=O)c1ccc(CN=[N+]=[N-])o1	1537962260	BHOHLLQSVKKGLQ-SSDOTTSWSA-N	238.247	1.855	10	20	BDCD	
Cc1nc(CN(C)Cc2ccccc2O)no1	111235316	ZSJJPBNONIBVDI-UHFFFAOYSA-N	233.271	1.716	10	20	BDCD	
C[C@H](N)[C@@H]1CCCN(Cc2ccc(N)cc2)C1	1334774814	OXZWRQCUCPYWFC-WCQYABFASA-N	233.359	1.828	10	20	BDCD	
CC[C@H](O)CN[C@H](C)c1cc(OC)ccc1O	163988979	SGYYXRHVLZMHHR-ZJUUUORDSA-N	239.315	1.822	10	20	BDCD	
Nc1ccc(CC(=O)N2CCC(F)CC2)cc1	701774392	ZBHBDZRRJBLDPS-UHFFFAOYSA-N	236.290	1.772	10	20	BDCD	
NC[C@H]1CCN(Cc2c(O)cccc2Cl)C1	128320179	SIHJNYDOUYHRCI-SECBINFHSA-N	240.734	1.826	10	20	BDCD	
CN[C@H]1CCN(Cc2cc(C)ccc2O)C1	150064278	BLGCXZKVTNYQKF-LBPRGKRZSA-N	220.316	1.494	10	20	BDCD	
COc1cccc(CN[C@H](C)[C@H](C)OC)c1O	289739767	HKNJXTOKHNKFBH-ZJUUUORDSA-N	239.315	1.914	10	20	BDCD	
COc1ccc(O)c(CNCCC[C@@H](C)O)c1	228090737	BDHDCAUFMNLPMM-SNVBAGLBSA-N	239.315	1.651	10	20	BDCD	
Nc1ccc(NC(=O)CC2CCNCC2)cc1	238133136	XGLGOMKCBVCUQY-UHFFFAOYSA-N	233.315	1.597	10	20	BDCD	
O=C(O)CNCc1c(O)ccc(Cl)c1F	380277821	YCOKWWRYVIDRKM-UHFFFAOYSA-N	233.626	1.359	10	20	BDCD	
CC(=O)C(=O)CSc1nc(C)c(C)o1	808020456	GDLRMEGOUUWMFC-UHFFFAOYSA-N	213.258	1.542	10	20	BDCD	
CC[C@H](N[C@H]1CCNC1)c1ccc(F)cc1O	817945165	WARRLEVCSNVKJT-JQWIXIFHSA-N	238.306	1.934	10	20	BDCD	
CCC(=O)CNC(=O)c1cc(O)cs1	831453431	GURDPMARNPGFMF-UHFFFAOYSA-N	213.258	1.163	10	20	BDCD	
C[C@H](NCCCON)c1ccc(F)cc1O	902425915	PFMZOBLAIYMRNF-QMMMGPOBSA-N	228.267	1.462	10	20	BDCD	
CC(=O)C(=O)CSc1cc(C)ccn1	918815755	OGYGQJSBJLYDPP-UHFFFAOYSA-N	209.270	1.640	10	20	BDCD	
C[C@@H](C(=O)NCc1ccc(N(C)C)cc1)N(C)C	750015727	OYSVVALYYSGUKS-NSHDSACASA-N	249.358	1.319	10	20	BDCD	
CNC[C@H](C)N[C@@H](C)c1ccc(F)cc1O	854231102	DTCFXQOFXRBPGM-IUCAKERBSA-N	226.295	1.790	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)C2=COCC2)c1	862758763	KDZZJFCBUFIGPW-UHFFFAOYSA-N	233.267	1.621	10	20	BDCD	
COc1cccc(O)c1CN(C)Cc1nc[nH]n1	769461257	TXAMBLQAYMRSCK-UHFFFAOYSA-N	248.286	1.151	10	20	BDCD	
C[C@@H]1C[C@H](O)CN1Cc1cc(F)cc(F)c1O	894539843	XKDLVCKCFOPKHH-XCBNKYQSSA-N	243.253	1.626	10	20	BDCD	
Cc1ccc([C@@H](C)NCc2nncn2C)c(O)c1	38007641	GZDRMVLIADARNF-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
COC[C@H](O)CNCc1c(O)cccc1Cl	83748639	MYASJQAGJQEQIP-MRVPVSSYSA-N	245.706	1.143	10	20	BDCD	
COCC(COC)N[C@H](C)c1ccccc1O	388444263	URZVLQJXSNRQHY-SNVBAGLBSA-N	239.315	1.704	10	20	BDCD	
Cc1ccc(CN2CCC[C@H]3CNC[C@H]32)c(O)c1	1579692204	USNSLTALYKVTRR-GXTWGEPZSA-N	246.354	1.884	10	20	BDCD	
CC[C@H](NCc1ncn(C)n1)c1ccccc1O	157006505	PMUZBLOWXBRWHQ-NSHDSACASA-N	246.314	1.762	10	20	BDCD	
COc1ccc(O)c(CNC/C=C\CO)c1	717547166	JWDISDQHUGQXGT-IHWYPQMZSA-N	223.272	1.039	10	20	BDCD	
CCc1cccc(CN[C@H](CO)CCF)c1O	848918723	JNMCZADOOVPYEO-LBPRGKRZSA-N	241.306	1.765	10	20	BDCD	
N[C@H](CNCc1c(O)cccc1Cl)C1CC1	841048937	HHAGRDNMHTXYPV-LLVKDONJSA-N	240.734	1.873	10	20	BDCD	
Oc1c(F)cccc1CN1CC[C@@H]2CNC[C@@H]21	841026543	HPYHORIUJWTFFC-SKDRFNHKSA-N	236.290	1.325	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H]3C[C@H]3C2)c1	862444047	WXGREWVCIAYBIF-AOOOYVTPSA-N	219.284	1.853	10	20	BDCD	
Cc1ccc(CNC[C@@H](O)C(C)C)c(O)c1	877037622	SZGFBRNBDBUHOM-CYBMUJFWSA-N	223.316	1.807	10	20	BDCD	
CNC[C@H](C)NCc1ccc(N2CCCC2)cc1	1328508083	VNHGWXULYLLCMK-ZDUSSCGKSA-N	247.386	1.984	10	20	BDCD	
Cc1cc(O)c(CNCC2(C(=O)O)CC2)cc1C	1600286290	NYRFMJQFUSLKQN-UHFFFAOYSA-N	249.310	1.963	10	20	BDCD	
CCN[C@H](C)c1cccc(-c2nn[nH]n2)c1O	1590745061	AMVWOLGALUIVJT-SSDOTTSWSA-N	233.275	1.243	10	20	BDCD	
COc1ccc(N(C)CC(OC)OC)cc1F	161533753	XOBFYAJUDOHVPV-UHFFFAOYSA-N	243.278	1.889	10	20	BDCD	
CCN(C)CCN[C@H]1CCc2cccc(O)c21	295831053	DXNKFJJWHPHDME-LBPRGKRZSA-N	234.343	1.921	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@H](C)N1	153355600	YVNZGEKEOVWSKM-QWRGUYRKSA-N	247.342	1.020	10	20	BDCD	
C[C@@H]1C[C@@H](C)N(C(=O)c2cccc(O)c2O)C1	126568287	FSAXBSXBFGIVAZ-RKDXNWHRSA-N	235.283	1.968	10	20	BDCD	
CNC(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1	44989742	ISQQOQJDFZHOQE-NSHDSACASA-N	249.358	1.539	10	20	BDCD	
COc1cccc(CN2CC[C@H](OC)C2)c1O	234901862	NOLGFFDUJIMXRJ-NSHDSACASA-N	237.299	1.622	10	20	BDCD	
CCN(Cc1ncnn1C)c1ccc(OC)cc1	267369927	JYQIKWFUTPLQCR-UHFFFAOYSA-N	246.314	1.850	10	20	BDCD	
CC1(C(=O)NCc2ccc(O)c(O)c2)CCC1	272365607	SYDXSFOWFMIXRU-UHFFFAOYSA-N	235.283	1.904	10	20	BDCD	
CN(C)c1ccc(CN2C[C@H]3C[C@H]2C(=O)O3)cc1	294671010	AWRLMPLNQKLGAB-OLZOCXBDSA-N	246.310	1.252	10	20	BDCD	
COC(=O)[C@H](C)NCc1cc(C)c(C)cc1O	793184973	CXVCPTCCMMMBHI-JTQLQIEISA-N	237.299	1.660	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CC[C@@]2(CCCCO2)C1	409426399	HZBRHFJWNNLENF-JTQLQIEISA-N	224.264	1.468	10	20	BDCD	
COC[C@@H]1CCCCN1C(=O)CN=[N+]=[N-]	409432862	WSWXKWUVOKZHBR-QMMMGPOBSA-N	212.253	1.324	10	20	BDCD	
Nc1ccc(CNC(=O)NCCCF)cc1	1346739123	NNJNGDKPLYRTPP-UHFFFAOYSA-N	225.267	1.428	10	20	BDCD	
CN(C)C1CN(C(=O)Nc2ccc(N)cc2)C1	394403406	DEPIYPBNNPNRSR-UHFFFAOYSA-N	234.303	1.047	10	20	BDCD	
CN(C)c1ccc(CN[C@@H](CN)C2CC2)cc1	841027484	BYUAIVVLONPBQK-AWEZNQCLSA-N	233.359	1.580	10	20	BDCD	
COc1ccc(O)c(CNC(=O)CC2CC2)c1	114540558	QKLKRPONDAMNCG-UHFFFAOYSA-N	235.283	1.817	10	20	BDCD	
CCCN(CCO)Cc1cccc(C)c1O	132483143	KRBGJNKMESXGLG-UHFFFAOYSA-N	223.316	1.905	10	20	BDCD	
CCC[C@H](O)CN(C)Cc1ccccc1O	295021952	UXQOXDYBDXZFBN-LBPRGKRZSA-N	223.316	1.985	10	20	BDCD	
CCOC(=O)CC(C)(C)CC(=O)C(=O)CC	808095650	NAUCSWSNYHDZMK-UHFFFAOYSA-N	228.288	1.904	10	20	BDCD	
CN(CCc1cnn[nH]1)Cc1ccccc1O	821390767	DTYUVEKIVGIIAV-UHFFFAOYSA-N	232.287	1.185	10	20	BDCD	
Nc1ccc(CCNC(=O)C[C@H](N)C2CC2)cc1	832659305	ZJDWNCSSGRUWTG-ZDUSSCGKSA-N	247.342	1.055	10	20	BDCD	
CCOc1ccc(O)c(CN(C)CCCN)c1	843051275	VXNIUAPKZBKXJI-UHFFFAOYSA-N	238.331	1.572	10	20	BDCD	
CNC[C@@H](C)NCc1cc(C)c(C)cc1O	853249348	PXKPUKBCCPLSFB-LLVKDONJSA-N	222.332	1.707	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CO[C@H](C)C2)c1	862757041	FEBJAMIIVWNLPS-PWSUYJOCSA-N	249.310	1.742	10	20	BDCD	
CC(C)(C)[C@H](CO)NCc1ccc(N)cc1	1262487962	LIGJYUQLFQAKGW-LBPRGKRZSA-N	222.332	1.765	10	20	BDCD	
O=C1CC[C@H](NCc2ccccc2O)CCN1	396649848	JXCNWVSGSCFTME-NSHDSACASA-N	234.299	1.151	10	20	BDCD	
OCCNCc1ccc(N2CCCCC2)cc1	20305941	SZRPTYUCPCOOJU-UHFFFAOYSA-N	234.343	1.759	10	20	BDCD	
C[C@H](CO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O	273435645	WWHNQNDCKOLWAB-HTQZYQBOSA-N	240.259	1.332	10	20	BDCD	
CNC(=O)C1CN(Cc2cc(C)c(C)cc2O)C1	297377631	JDYVRVLDZLWUDB-UHFFFAOYSA-N	248.326	1.187	10	20	BDCD	
O=C(O)CCCCNCc1cccc(F)c1O	821522363	ZCDMHAMUTXCRFM-UHFFFAOYSA-N	241.262	1.876	10	20	BDCD	
CCC1(C(=O)N[C@H](C)c2ccccc2O)COC1	827937061	JJZUCGCLTGGIBA-SNVBAGLBSA-N	249.310	1.996	10	20	BDCD	
C[C@H]1C[C@H](CNCCc2ccc(N)cc2)CCN1	841037594	AZTURAPXUIGATL-GXTWGEPZSA-N	247.386	1.789	10	20	BDCD	
Oc1c(Cl)cccc1CNC[C@H]1CCCN1	841036207	PQDPKLDKRSQXNI-SNVBAGLBSA-N	240.734	1.887	10	20	BDCD	
Cc1cccc(O)c1CN(C)[C@H](C)CO	877526810	LVNQDWKNJBSOKW-SNVBAGLBSA-N	209.289	1.513	10	20	BDCD	
Cc1ccc(CN2CC[C@H](O)[C@H](C)C2)c(O)c1	877434748	TZKCBRDXGPDEQK-YPMHNXCESA-N	235.327	1.903	10	20	BDCD	
CCOc1ccc(CN2CCOCC2)c(O)c1	771927139	GAYVEGNMODDTMD-UHFFFAOYSA-N	237.299	1.623	10	20	BDCD	
C[C@H](N[C@H]1CCOC1=O)c1ccc(N(C)C)cc1	774481026	HBPYPHCFSVIIGM-GWCFXTLKSA-N	248.326	1.719	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@](CO)(C(F)(F)F)C1	409435886	XBRDAPSANVZJFR-ZETCQYMHSA-N	238.213	1.543	10	20	BDCD	
CC(C)ONC(=O)NCc1ccc(N)cc1	1337017720	DBBXWYIAZRIEJV-UHFFFAOYSA-N	223.276	1.408	10	20	BDCD	
O=C(O)[C@H](CF)NCc1cccc(F)c1O	1601651845	XJXXMOFGXTWYNU-QMMMGPOBSA-N	231.198	1.044	10	20	BDCD	
CNCCNCc1ccc(OC)c(C)c1	258852375	XNUWQYHPARQLCG-UHFFFAOYSA-N	208.305	1.313	10	20	BDCD	
CC(C)[C@H](O)CNCc1ccccc1O	123922481	VSPGAJVZUBTMOC-GFCCVEGCSA-N	209.289	1.499	10	20	BDCD	
C[C@H]1CN(Cc2cc(F)ccc2O)CCO1	179897364	WCYFXCKNUQWBBP-VIFPVBQESA-N	225.263	1.752	10	20	BDCD	
CO[C@H]1CN(c2ccc(N)cc2)C[C@@H]1OC	234858150	UQPBKPAXHRNTNW-RYUDHWBXSA-N	222.288	1.119	10	20	BDCD	
C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(N)=O	37261361	BWNVFQBCNIUVPK-NXEZZACHSA-N	235.331	1.277	10	20	BDCD	
COc1cccc(CN2CCN[C@H](C)C2)c1O	88058706	JLXBUIILBKZTGQ-SNVBAGLBSA-N	236.315	1.195	10	20	BDCD	
C[S@@](=O)CCCNCc1cc(F)ccc1O	226610836	QENBEQZXFQCHPN-MRXNPFEDSA-N	245.319	1.390	10	20	BDCD	
CN(C[C@H]1CCCO1)C(=O)Cc1ccc(N)cc1	42463302	KYUMPBGQULFOBG-CYBMUJFWSA-N	248.326	1.449	10	20	BDCD	
COC(=O)[C@@H](C)N(C)C(=O)c1cc(O)cs1	834819411	NAHJSUKWJXXHJY-ZCFIWIBFSA-N	243.284	1.087	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN1CCC(N)CC1	843047704	WVQKRLCVWUQRLM-UHFFFAOYSA-N	247.386	1.984	10	20	BDCD	
C[C@@H]1C[C@H]1[C@@H]1C[C@H]1NC(=O)c1cccc(O)c1O	928037410	BLUSUHKRUHIBLU-CZULRBLNSA-N	247.294	1.872	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@@](C)(C(N)=O)C1	877494550	YFXGHTZXHVOVFG-CQSZACIVSA-N	248.326	1.398	10	20	BDCD	
CC[C@@]1(C(=O)Nc2ccc(N)cc2)CCNC1=O	876504263	LDIDMAPUXNFOLD-CYBMUJFWSA-N	247.298	1.124	10	20	BDCD	
CN(C(=O)[C@@H](N)CC1CC1)c1ccc(N)cc1	884441712	NTQJKQHYQLGFTL-LBPRGKRZSA-N	233.315	1.359	10	20	BDCD	
COC(=O)CN(C)Cc1cc(F)cc(F)c1O	893947415	IPTMTANMJBEMTF-UHFFFAOYSA-N	245.225	1.275	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1COCO1)CCO2	894870551	LXFSKMSYCSIOQG-LBPRGKRZSA-N	235.283	1.084	10	20	BDCD	
COc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)O)c1	49353972	IPTYVMQUEVGTEZ-SFYZADRCSA-N	239.271	1.525	10	20	BDCD	
C[C@H](C(=O)O)N(C)Cc1cc(Cl)ccc1O	83406653	BWPCQJHBWTYUQV-SSDOTTSWSA-N	243.690	1.951	10	20	BDCD	
CN1CC[C@@H](NCc2ccccc2O)C1	42544017	ORSJPWUATGTDEW-LLVKDONJSA-N	206.289	1.186	10	20	BDCD	
Oc1c(F)cc(F)cc1CNC[C@H](O)C1CC1	708441043	HWJMQSIXEHBCHX-NSHDSACASA-N	243.253	1.531	10	20	BDCD	
CN[C@H](C)CCNCc1cccc(F)c1O	1345105047	OYZGCCCCXPDCJS-SECBINFHSA-N	226.295	1.619	10	20	BDCD	
O=C(NCc1cccc(O)c1O)[C@@H]1CC12CC2	1350299512	BRGDKNSPYRKQHZ-VIFPVBQESA-N	233.267	1.514	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N)cc2)[C@H](C)CO1	35782507	VEUCBBYBKGZDDZ-GHMZBOCLSA-N	220.316	1.878	10	20	BDCD	
COc1ccc(N(C)CC[C@@H](C)O)cc1OC	827491732	PISSYCLBHJSOEC-SNVBAGLBSA-N	239.315	1.911	10	20	BDCD	
COC[C@](C)(O)CNCc1cccc(C)c1O	382551130	HMJIGOARQUTUGC-CYBMUJFWSA-N	239.315	1.188	10	20	BDCD	
C[C@H](N[C@H]1C[C@H](CO)C1)c1ccc(F)cc1O	927149292	YBRKJSHWYGBWAS-QXEWZRGKSA-N	239.290	1.953	10	20	BDCD	
C[C@@H]1NCC[C@@H]1C(=O)NCc1ccccc1O	228421968	SNSDKJUIOKJBOE-ONGXEEELSA-N	234.299	1.006	10	20	BDCD	
CCn1ncnc1CN(C)c1ccc(N)cc1	88595624	WXAPDKRQIZTAOF-UHFFFAOYSA-N	231.303	1.517	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccoc1	136334697	ZDQRWEJHZIXRNU-UHFFFAOYSA-N	217.224	1.915	10	20	BDCD	
C[C@@H](N[C@H]1CCN(C)C1)c1cc(F)ccc1O	94617860	QZUUWIWSDVNAGL-KOLCDFICSA-N	238.306	1.886	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NCC(F)(F)CN)c1	817966148	HFHYEVWQFBZVJA-VIFPVBQESA-N	244.285	1.945	10	20	BDCD	
C[C@@H](N)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O	817972903	PJHRPWAXMIJZCF-HTQZYQBOSA-N	239.275	1.298	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCO[C@@H]2C[C@@H]21	832634315	NHVJPIWNNXPASS-JGVFFNPUSA-N	225.269	1.067	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)OCC(F)F	759579602	NCCJWESEPJSVOJ-RQOWECAXSA-N	244.193	1.919	10	20	BDCD	
COC(=O)C(C)(C)N(C)Cc1ccccc1O	770510839	RNINLMIMCYFBBG-UHFFFAOYSA-N	237.299	1.776	10	20	BDCD	
CCOCCC(=O)NCCc1ccc(N)cc1	53732692	ITIOMJUYKCLCQA-UHFFFAOYSA-N	236.315	1.354	10	20	BDCD	
COCC[C@H](CO)NCc1cc(F)ccc1O	281375845	VWBFAGWCRUTODP-LLVKDONJSA-N	243.278	1.018	10	20	BDCD	
C[C@H](O)CNCc1cc(F)cc(F)c1O	708387207	ARWUQNTXKHTQHA-LURJTMIESA-N	217.215	1.141	10	20	BDCD	
C[C@H](CN(C)Cc1cccc(F)c1O)C(=O)O	1589033776	CXOQKNZVBKFKRW-MRVPVSSYSA-N	241.262	1.684	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@H](CC(N)=O)C2)c1	368135266	PDZODWCSPJRYLS-NSHDSACASA-N	248.326	1.398	10	20	BDCD	
OCC1(NCc2ccccc2O)CCC1	157498295	NGBWUDPUXYQUEA-UHFFFAOYSA-N	207.273	1.397	10	20	BDCD	
COC[C@H](CNCc1cccc(C)c1O)OC	227717483	YRIDWAUUYZRFNY-LBPRGKRZSA-N	239.315	1.452	10	20	BDCD	
COc1ccc(CNCc2c[nH]cn2)c(O)c1	88750586	NYTKSSRSPBUUDM-UHFFFAOYSA-N	233.271	1.414	10	20	BDCD	
CC[C@@H](NC[C@@H](C)N)c1ccc(F)cc1O	817974173	ZXGLGKUJQDQNIF-LDYMZIIASA-N	226.295	1.919	10	20	BDCD	
N[C@H]1CCCN(Cc2cccc(Cl)c2O)C1	843043968	RIZCZEWEHFCOKE-JTQLQIEISA-N	240.734	1.969	10	20	BDCD	
Cc1cc(O)c(CN2CC[C@@H]3CNC[C@@H]32)cc1C	841026836	RTKVWAZXPBZZNX-OCCSQVGLSA-N	246.354	1.803	10	20	BDCD	
C[C@@H]1C[C@@H](CNCCc2ccc(N)cc2)CCN1	841037597	AZTURAPXUIGATL-OCCSQVGLSA-N	247.386	1.789	10	20	BDCD	
CNC[C@@H](C)NCc1cccc(C)c1O	853249639	SGZVSLYJUCVUIV-SNVBAGLBSA-N	208.305	1.398	10	20	BDCD	
CO[C@@H](C)C(=O)NCc1cc(C)ccc1O	862759120	WPNFWTKJQPQFMM-VIFPVBQESA-N	223.272	1.352	10	20	BDCD	
Cc1ccc(CNCCn2ccnc2)c(O)c1	876892200	NBCQMOMAZONKDF-UHFFFAOYSA-N	231.299	1.687	10	20	BDCD	
Cc1ccc(CNCC2(C)OCCO2)c(O)c1	877118241	SMJGNQPSAHRIBB-UHFFFAOYSA-N	237.299	1.553	10	20	BDCD	
CC[C@H](C)[C@H](O)CNC(=O)c1cc(O)cs1	771063149	DWGIYFSCZSKYSC-IONNQARKSA-N	243.328	1.591	10	20	BDCD	
c1cc2c(cc1CNC[C@H]1COCO1)CCCO2	894891078	YCCBMQSCCSYGJR-ZDUSSCGKSA-N	249.310	1.474	10	20	BDCD	
C[C@H](N[C@H](C)C(=O)O)c1ccc(N(C)C)cc1	49357089	PSWUROCAAJEDNB-VHSXEESVSA-N	236.315	1.876	10	20	BDCD	
Oc1cc2c(cc1CNC1CSC1)OCO2	701972475	JOFXYAZZQVHTPL-UHFFFAOYSA-N	239.296	1.326	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H](N)CC2CC2)cc1	1342699420	LUGIABRJXUAANQ-LBPRGKRZSA-N	233.315	1.012	10	20	BDCD	
CN(C(=O)Cc1ccc(N)cc1)C1(CN)CCC1	843483955	GKQNHFCHZSXVAO-UHFFFAOYSA-N	247.342	1.151	10	20	BDCD	
C[C@H](CCCN)NCc1ccc2c(c1)CCO2	841080090	NQKLOORZZCRVPY-LLVKDONJSA-N	234.343	1.839	10	20	BDCD	
Cc1cccc(CN(C)[C@@H]2CCNC2=O)c1O	775743466	HJNQWLAAMDLIKG-LLVKDONJSA-N	234.299	1.021	10	20	BDCD	
C[C@@H](CN[C@@H](C)c1ccccc1O)C(=O)O	1603193486	WLPQCKSZVQSPEQ-IUCAKERBSA-N	223.272	1.764	10	20	BDCD	
CN[C@@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1	54074799	IRNRFIHDIFMVBR-NSHDSACASA-N	249.358	1.319	10	20	BDCD	
C[C@@H](NCC(F)(F)CO)c1cc(F)ccc1O	184712913	JMPURMLBWYHDOE-SSDOTTSWSA-N	249.232	1.810	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@H](C)[C@@H]2CO)c1	191185883	LFMPQMBZVVSUBL-AAEUAGOBSA-N	235.327	1.903	10	20	BDCD	
COC(=O)c1ccc(O)c([C@H](C)NCCF)c1	280975900	ISVRMRVCRVVYRI-QMMMGPOBSA-N	241.262	1.799	10	20	BDCD	
CC(C)[C@@H]1NCC[C@@H]1C(=O)Nc1ccc(N)cc1	294785028	OATZHPNBOJRRKX-STQMWFEESA-N	247.342	1.841	10	20	BDCD	
C[C@@H]1C[C@@H](NCCc2ccc(N)cc2)CCO1	817956437	YYPPZWLLNXKDNF-RISCZKNCSA-N	234.343	1.968	10	20	BDCD	
CC(=O)NCC(C)(C)C(=O)Nc1ccc(N)cc1	846662630	VPGJRZRWIOEPGN-UHFFFAOYSA-N	249.314	1.370	10	20	BDCD	
CCN1C[C@@H](CNCc2ccccc2O)CC1=O	846092478	DILHDJAIROOFML-LLVKDONJSA-N	248.326	1.350	10	20	BDCD	
Oc1cccc(Cl)c1CN[C@@H]1CCNC1	841044804	INKGFHOXZKRBPV-MRVPVSSYSA-N	226.707	1.497	10	20	BDCD	
COc1cccc(O)c1CN1CCN[C@@H](C)C1	768140883	YKGZKFXRWJJFKI-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@H]2CCCCO2)c1	862758029	MNXSKAXFHYFUCA-CYBMUJFWSA-N	249.310	1.886	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CCO[C@@H]3C[C@@H]32)c1	793620590	WZYJIWTYZQWTJF-QWHCGFSZSA-N	233.311	1.982	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccccn2)C1	409423457	OHGQUTQTMKYQQU-UHFFFAOYSA-N	203.205	1.216	10	20	BDCD	
C[C@H]1CNCCN1Cc1cc(F)c(F)cc1O	1576857236	ZVCBLQZLGSMRDF-QMMMGPOBSA-N	242.269	1.464	10	20	BDCD	
O=C(O)CCNCc1ccc(Cl)cc1O	1574709146	FMNDSSBGVMZPLD-UHFFFAOYSA-N	229.663	1.610	10	20	BDCD	
COCC(C)(C)NCc1cccc(OC)c1O	66995942	KMLFEPAXGXMSAD-UHFFFAOYSA-N	239.315	1.915	10	20	BDCD	
CCCNC(=O)NCc1ccccc1O	136335517	AGFMBRCUBJDUAB-UHFFFAOYSA-N	208.261	1.601	10	20	BDCD	
Nc1ccc(CN2C[C@H]3[C@H](C2)C3(F)F)cc1	715539276	MIEUFNPPMRYFFJ-QWRGUYRKSA-N	224.254	1.966	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)Cc1ncc[nH]1	816889313	TZQGZOGCGFSXLL-UHFFFAOYSA-N	245.282	1.316	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@H](O)C(F)(F)F	865711768	QIGBYQYMOODXPY-XVKPBYJWSA-N	249.232	1.794	10	20	BDCD	
CC(=O)C1=NN(c2cccc(C)c2)C(=O)C1	871941144	WIHNRRURZBFCFC-UHFFFAOYSA-N	216.240	1.677	10	20	BDCD	
C[C@@H](CC(=O)O)NCc1c(O)cccc1Cl	1603132873	GHCHAIRJWUSPKE-ZETCQYMHSA-N	243.690	1.998	10	20	BDCD	
C[C@@H]1CN(Cc2ccccc2O)C[C@@]1(C)C(=O)O	710268818	UWJUOBBITJOJSX-QMTHXVAHSA-N	249.310	1.935	10	20	BDCD	
C[C@H](O)C1(NCc2ccc3c(c2)CCO3)CC1	827579903	LANARPURSWWWON-JTQLQIEISA-N	233.311	1.625	10	20	BDCD	
C[C@H](NCc1ccccc1O)[C@@H]1CCOC1	127042178	UKCTUNZLCHDHGP-CMPLNLGQSA-N	221.300	1.907	10	20	BDCD	
Cn1cnnc1CNCc1ccc2c(c1)CCO2	38007978	RRDSTYJPCLHDDS-UHFFFAOYSA-N	244.298	1.040	10	20	BDCD	
Cc1cc(O)c(CN[C@@H]2CC[C@H]2O)cc1C	378790161	NBSNIPFMYCUYAU-VXGBXAGGSA-N	221.300	1.622	10	20	BDCD	
C[C@H]1C[C@@H](C(=O)NCc2ccccc2O)CO1	132779984	OCRIOIMFYCRHFM-GXSJLCMTSA-N	235.283	1.433	10	20	BDCD	
C[C@@H](NCC(C)(C)C(N)=O)c1ccccc1O	183638069	HXQBAWDFYXWNAS-SECBINFHSA-N	236.315	1.554	10	20	BDCD	
C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@H]1O	253232224	BBXURCOIUWHRRZ-IUODEOHRSA-N	248.370	1.955	10	20	BDCD	
C[C@H](CN)N[C@H](C)c1ccc(F)cc1O	817965897	FADKZQPUNAYFNI-HTQZYQBOSA-N	212.268	1.529	10	20	BDCD	
CN(C)c1ccc(CN[C@H](CO)CCF)cc1	846096471	IAPMJJILSPJBKR-LBPRGKRZSA-N	240.322	1.563	10	20	BDCD	
Nc1ccc(CCNC[C@H]2CCCOC2)cc1	841035083	KFLRFWTWLXPAOY-CYBMUJFWSA-N	234.343	1.828	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1C[C@H]2C[C@H]2N1)c1ccccc1O	877255889	JPOIIGBFMPROBM-IQIPOGNMSA-N	246.310	1.320	10	20	BDCD	
C[C@H](CO)NCc1ccc(N2CCCC2)cc1	37258394	JHGMVXKGYLCIMH-GFCCVEGCSA-N	234.343	1.757	10	20	BDCD	
C[C@H]1CN(Cc2ccc(N(C)C)cc2)[C@H](C)CN1	86466780	WHXKGXMNJSTLIV-QWHCGFSZSA-N	247.386	1.935	10	20	BDCD	
C[C@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@H]1C	92081951	YIDMOIGAXRWJJU-QWRGUYRKSA-N	232.327	1.926	10	20	BDCD	
CCC1(C(=O)NCCc2ccc(O)c(O)c2)CC1	762261383	KNIPGZLLFCSEOG-UHFFFAOYSA-N	249.310	1.947	10	20	BDCD	
COC(=O)[C@@H](C)Sc1ncc(C(=O)O)s1	1598693128	SHGQZXHZWNOHDF-SCSAIBSYSA-N	247.297	1.495	10	20	BDCD	
Cc1cccc(CNC[C@@H](C)CO)c1O	162829769	HEWPCXKWFZRPJG-SECBINFHSA-N	209.289	1.419	10	20	BDCD	
COC(=O)[C@H](C)NCc1cccc(Cl)c1O	165151857	DTIUVFSLGHXIRV-ZETCQYMHSA-N	243.690	1.697	10	20	BDCD	
C[C@H](NC(=O)Cc1ccc(N)cc1)[C@H]1CCCO1	35734286	DUMWFFAUTPHGDB-GXFFZTMASA-N	248.326	1.495	10	20	BDCD	
COc1cccc(O)c1CN(C)C[C@@H](C)N	863653174	DRMROXVRCXSLAD-SECBINFHSA-N	224.304	1.180	10	20	BDCD	
Oc1ccccc1CN[C@@H]1CCCC[C@H]1O	51991276	OXIYYLGPQMPKBV-DGCLKSJQSA-N	221.300	1.785	10	20	BDCD	
CN(C)c1ccc(OCCC2OCCO2)cc1	283964951	ZBLUUYLWEILJLZ-UHFFFAOYSA-N	237.299	1.894	10	20	BDCD	
Cc1ccc(O)c(CN2CCCNCC2)c1	70955769	XOKGLGDBICQCPZ-UHFFFAOYSA-N	220.316	1.496	10	20	BDCD	
C[C@@H](C(=O)O)C(=O)N(C)Cc1ccccc1O	229343260	CTQGCJNIPAJHLF-MRVPVSSYSA-N	237.255	1.071	10	20	BDCD	
COC(=O)[C@H](C)CN(C)Cc1ccccc1O	179561090	HUTHAPJQIZLUPV-SNVBAGLBSA-N	237.299	1.633	10	20	BDCD	
NC(=O)CC1CCN(Cc2ccc(N)cc2)CC1	42427197	YICABCGZJYJWQB-UHFFFAOYSA-N	247.342	1.356	10	20	BDCD	
NCc1ccc2c(c1)CCCN2Cc1cc[nH]n1	700869105	WPXIRPPSSQIWRU-UHFFFAOYSA-N	242.326	1.821	10	20	BDCD	
CN(C)c1ccc(OCc2ncnn2C)cc1	289336491	FHDZCYGOOGJYOU-UHFFFAOYSA-N	232.287	1.460	10	20	BDCD	
COC(=O)CC1CC(NCc2ccccc2O)C1	818329690	CBSHHHZHHLTCFI-UHFFFAOYSA-N	249.310	1.824	10	20	BDCD	
NC[C@@H]1CC[C@H](NCc2ccccc2O)C1	724090546	SAZYQIYSHTUEAV-PWSUYJOCSA-N	220.316	1.609	10	20	BDCD	
C[C@@H](Cc1cnccn1)NCc1ccccc1O	725849392	MBWOSTABWQCDOP-NSHDSACASA-N	243.310	1.903	10	20	BDCD	
O=C(/C=C\c1ccc(O)c(O)c1)NCCCF	588408379	YVQOGTGDJFYUBI-HYXAFXHYSA-N	239.246	1.587	10	20	BDCD	
Cc1ccc(O)c(CNCc2cnn(C)c2)c1	71408314	RLGAIUUJYOGTTP-UHFFFAOYSA-N	231.299	1.724	10	20	BDCD	
CN(C(=O)C1CCNCC1)c1ccc(N)cc1	877079178	UAUKLUTXVMXQRK-UHFFFAOYSA-N	233.315	1.231	10	20	BDCD	
NC[C@@H](NCc1ccc(N)cc1)C1CC1	1120371051	NWNOKMXCAQJUMV-GFCCVEGCSA-N	205.305	1.096	10	20	BDCD	
Cc1cccc(CN2CC(=O)N(C)C[C@@H]2C)c1O	783734888	WOKDURPMLMDKDE-NSHDSACASA-N	248.326	1.363	10	20	BDCD	
Nc1ccc(CNC[C@@H]2CCCO2)cc1	40410239	PUMJDIWEXAGGOM-LBPRGKRZSA-N	206.289	1.537	10	20	BDCD	
COc1ccc(CNC2(C(N)=O)CC2)cc1C	792174975	KRGLTBPEKHGNBS-UHFFFAOYSA-N	234.299	1.111	10	20	BDCD	
CC[C@H](C(=O)O)N(C)Cc1ccc(C)cc1O	1589443477	JTJKMAZRUXVLMT-LLVKDONJSA-N	237.299	1.996	10	20	BDCD	
COCCN[C@@H](C)c1cc(C(=O)O)ccc1O	1599244366	IGJYTKVDMBBHDC-QMMMGPOBSA-N	239.271	1.387	10	20	BDCD	
COc1cccc(CNCC2CC2)c1O	19884820	BRLWASJXJJXRDT-UHFFFAOYSA-N	207.273	1.900	10	20	BDCD	
COC[C@@H](CO)N[C@@H](C)c1ccc(F)cc1O	234890948	BTGOLSAUKLMKSA-WCBMZHEXSA-N	243.278	1.189	10	20	BDCD	
O=C(O)CCCCNCc1ccccc1O	236417763	HGJDUOJCZSPLHX-UHFFFAOYSA-N	223.272	1.737	10	20	BDCD	
Cc1ccc([C@H](C)N[C@@H]2COC[C@H]2O)c(O)c1	296084269	XNSYNCIFKLTXEW-UFGOTCBOSA-N	237.299	1.111	10	20	BDCD	
C[C@H]1NCCN(Cc2ccccc2O)[C@@H]1C	379445586	WWYVHIASCSBOMC-GHMZBOCLSA-N	220.316	1.574	10	20	BDCD	
O=C(N[C@@H]1CC12CCC2)c1cccc(O)c1O	721151598	UWVKORMRFKJCLH-SNVBAGLBSA-N	233.267	1.770	10	20	BDCD	
CCN1C[C@@H](NCc2ccccc2O)CC1=O	391480878	OHPKUMSAWBDMHJ-NSHDSACASA-N	234.299	1.103	10	20	BDCD	
OC[C@@H](NCc1cc(F)cc(F)c1O)C1CC1	883001577	HUXCUWDCTLNLJC-LLVKDONJSA-N	243.253	1.531	10	20	BDCD	
CCCNC(=O)CN(C)Cc1ccccc1O	109770301	YFZKMHITSQPTLI-UHFFFAOYSA-N	236.315	1.350	10	20	BDCD	
COc1cccc(CN2C[C@@H](N)[C@H](C)C2)c1O	300048740	MCQVBJZAHDRSDX-MWLCHTKSSA-N	236.315	1.180	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC(=N)N	304217306	HEFNTTYNDWEHIU-UHFFFAOYSA-N	206.293	1.044	10	20	BDCD	
COC[C@@H](CO)N[C@H](C)c1ccc(C)cc1O	234899302	VASWKLQCASEKSW-GHMZBOCLSA-N	239.315	1.359	10	20	BDCD	
CC[C@H](N)CN[C@H](C)c1ccc(F)cc1O	817980959	YOMMZIUDLFVWSL-SCZZXKLOSA-N	226.295	1.919	10	20	BDCD	
Cc1cc(O)c(CNCCC(=O)O)cc1C	818849316	RZFWKOVLUKIITE-UHFFFAOYSA-N	223.272	1.573	10	20	BDCD	
C[C@H](CN)CN[C@@H]1CCc2cccc(O)c21	817963907	YBKNCGLKGQRWFR-MWLCHTKSSA-N	220.316	1.564	10	20	BDCD	
C[C@H](NCC1(N)CC1)c1ccc(N(C)C)cc1	902417546	SOSLMENBZHGGKN-NSHDSACASA-N	233.359	1.895	10	20	BDCD	
C[C@H](CCCCO)NC(=O)c1cc(O)cs1	833696484	URIBLFBIPMIOFY-MRVPVSSYSA-N	243.328	1.735	10	20	BDCD	
CC[C@@]1(NC(=O)c2cc(O)cs2)CCOC1	834356214	VHYWKBXNSBREOK-LLVKDONJSA-N	241.312	1.753	10	20	BDCD	
Cc1cccc(O)c1CNC[C@@H](C)N(C)C	877149612	DPZRFPXBHVNTQL-LLVKDONJSA-N	222.332	1.740	10	20	BDCD	
Cc1cc(C)c(O)c(CN2CCCNC(=O)C2)c1	872825389	JWXKQLGKONXKDU-UHFFFAOYSA-N	248.326	1.331	10	20	BDCD	
CCOCCN(C)C(=O)c1cc(O)cs1	772930666	HEFUBMUSCIXHMN-UHFFFAOYSA-N	229.301	1.562	10	20	BDCD	
Cc1ccc(CNC2(C)COC2)c(O)c1	877691714	UEUBSONNHPDOKA-UHFFFAOYSA-N	207.273	1.579	10	20	BDCD	
CN(C)c1ccc(CNC2(C)COC2)cc1F	877691379	OKVPPBVCRPQXHS-UHFFFAOYSA-N	238.306	1.770	10	20	BDCD	
Cc1cccc(O)c1CN[C@H](CO)CCF	877614628	KCMKEEZAAMXFPB-JTQLQIEISA-N	227.279	1.511	10	20	BDCD	
Cc1nnc(Sc2ncc(Cl)s2)n1N	780907339	UQNXNQCQOPGFQV-UHFFFAOYSA-N	247.736	1.561	10	20	BDCD	
O=C(COC(=O)c1cc(O)cs1)CC1CC1	783608163	NXQUYCDXTCEGOL-UHFFFAOYSA-N	240.280	1.980	10	20	BDCD	
Cc1cccc(CN[C@H](C)c2ncnn2C)c1O	276411325	FILQQLLEUIGTFI-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccnc(Cl)c2)C1	409424997	ZWGGQDDLWKFJSW-UHFFFAOYSA-N	237.650	1.870	10	20	BDCD	
CCN[C@H](C)C(=O)NCc1ccc(N(C)C)cc1	707980632	SMQKFBYBLLUNOH-LLVKDONJSA-N	249.358	1.367	10	20	BDCD	
COc1ccc(N(C)C[C@H]2CCNC2)cc1F	258854552	IEPBHUDWOLWMGH-JTQLQIEISA-N	238.306	1.880	10	20	BDCD	
NC[C@@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2	841028535	BEPXDNDAURPTBT-KBPBESRZSA-N	246.354	1.839	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H](C(=O)O)C2)c1	86728709	FEDVWOCDJHZGMR-NSHDSACASA-N	249.310	1.997	10	20	BDCD	
C[C@H](O)[C@H]1CCN(Cc2ccccc2O)C1	134735154	AKKCRFDCTQIEJJ-QWRGUYRKSA-N	221.300	1.595	10	20	BDCD	
C[C@@H](NC(=O)C1=COCC1)c1ccccc1O	827930297	GCADDPMUGRGFIA-SECBINFHSA-N	233.267	1.874	10	20	BDCD	
Cc1cc(N(C)C)ccc1CN[C@H]1C[C@H](O)C1	827831832	CKEBQFBOXMVLJA-MQMHXKEQSA-N	234.343	1.674	10	20	BDCD	
Cn1cccc1CNC(=O)c1cc(O)cs1	743821587	QKVCMADDZXFLCR-UHFFFAOYSA-N	236.296	1.722	10	20	BDCD	
CC[C@@H](N)CNCc1cccc(Cl)c1O	841071339	DIWCNMZYVQXFEE-SECBINFHSA-N	228.723	1.873	10	20	BDCD	
CCC(N)(CC)CNCc1ccccc1O	841031574	WSPUDPSQKVKJNQ-UHFFFAOYSA-N	222.332	1.999	10	20	BDCD	
CN(C(=O)c1cc(O)cs1)c1cnn(C)c1	751070565	KETSUAPQZRUHSB-UHFFFAOYSA-N	237.284	1.464	10	20	BDCD	
CC(=O)N[C@H]1CCN(Cc2ccc(C)cc2O)C1	877594946	NHORIXABKCUYAG-ZDUSSCGKSA-N	248.326	1.411	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1CC=CCC1	779546331	NSDYJGWTSZEOAW-FNORWQNLSA-N	245.278	1.900	10	20	BDCD	
COC(C)(C)CCNC(=O)c1cc(O)cs1	871258072	UYWHJPXDUJGDET-UHFFFAOYSA-N	243.328	1.999	10	20	BDCD	
CCOC[C@@H](C)NCc1cccc(OC)c1O	44688773	LVWQLACUQYMQKX-SNVBAGLBSA-N	239.315	1.915	10	20	BDCD	
CC[C@H](N[C@H]1CC(=O)N(C)C1)c1ccccc1O	274859951	CQOUTCQKYXWLAW-JQWIXIFHSA-N	248.326	1.664	10	20	BDCD	
c1cc2c(cc1CN[C@H]1CCCNC1)CCCO2	84565848	PNUUPBHXFKBHRI-AWEZNQCLSA-N	246.354	1.853	10	20	BDCD	
[N-]=[N+]=NCCN1CC[C@H](O)[C@@H](CCF)C1	409429949	IAMFCAMDQYJCIS-IUCAKERBSA-N	216.260	1.339	10	20	BDCD	
C[C@H](CO)CN[C@H](C)c1ccccc1O	83215432	VZSFWQZCKKDXQX-VHSXEESVSA-N	209.289	1.671	10	20	BDCD	
CN(C)C(C)(C)CNCc1ccccc1O	20125735	LRGJKELGETXZAS-UHFFFAOYSA-N	222.332	1.822	10	20	BDCD	
Cn1ncnc1NCc1c(O)cccc1Cl	309574323	OFDNWYLNFFDACR-UHFFFAOYSA-N	238.678	1.786	10	20	BDCD	
CN(Cc1c(O)cccc1Cl)[C@@H]1CCNC1	128326876	YCWWYTYBFFTVFO-SECBINFHSA-N	240.734	1.839	10	20	BDCD	
CC[C@H](N[C@H](C)CO)c1ccccc1O	35602847	YWQZBLCLTGPWSI-KOLCDFICSA-N	209.289	1.814	10	20	BDCD	
CC[C@H](COC)NC(=O)Cc1ccc(N)cc1	79731690	AWYAVDGNWDULKJ-GFCCVEGCSA-N	236.315	1.353	10	20	BDCD	
CC(=O)NC1CCN(Cc2ccccc2O)CC1	135652634	BQEKDOLKVIXTEJ-UHFFFAOYSA-N	248.326	1.493	10	20	BDCD	
CO[C@@H]1CCN(Cc2ccccc2O)C1	300044331	BJRIDLNRQGBHAX-LLVKDONJSA-N	207.273	1.613	10	20	BDCD	
C[C@H]1C[C@@H](C)O[C@H]1C(=O)NCc1ccccc1O	282244512	BTLSNFBXIRCNCJ-OPQQBVKSSA-N	249.310	1.822	10	20	BDCD	
CC(=O)C(=O)COC(=O)c1ccc(Cl)nc1	808488369	FFFOHYAADSPGCX-UHFFFAOYSA-N	241.630	1.050	10	20	BDCD	
Cc1cccc(CN2CCC[C@@H]2C(=O)O)c1O	821112364	VQECCROIRGMVOU-LLVKDONJSA-N	235.283	1.750	10	20	BDCD	
C[C@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1	768443971	KEISHHWBFQAHRR-TVQRCGJNSA-N	249.310	1.660	10	20	BDCD	
Cc1cccc(CN2C[C@H]3C[C@]3(CO)C2)c1O	783744657	SXYJTZBFYABHGH-TZMCWYRMSA-N	233.311	1.515	10	20	BDCD	
Cc1cc(N(C)C)ccc1CNC[C@H]1CCN1C	896595347	JJBFSURYXJNODM-OAHLLOKOSA-N	247.386	1.855	10	20	BDCD	
CC(C)[C@H](F)C(=O)NCc1ccc(O)c(O)c1	784441921	JMKIIUHPYPTFLL-NSHDSACASA-N	241.262	1.708	10	20	BDCD	
CC(C)NC(=O)CSc1nccs1	60740340	KADDEFYCEIIFKD-UHFFFAOYSA-N	216.331	1.760	10	20	BDCD	
CC1=NO[C@](C)(C(=O)NCc2ccccc2O)C1	1335853938	AAUNNEHPPOQDKW-ZDUSSCGKSA-N	248.282	1.563	10	20	BDCD	
Cc1ccc(O)c(CNC(=O)[C@@H]2CCCN2)c1	1574156317	CNNQFHIBGLUYCM-NSHDSACASA-N	234.299	1.069	10	20	BDCD	
COC(C)(C)CNC(=O)Nc1ccc(N)cc1	160591582	IMKOGTSTDZHTGP-UHFFFAOYSA-N	237.303	1.815	10	20	BDCD	
C[C@@H](C[S@@](C)=O)N[C@@H](C)c1ccccc1O	164490449	LAYSUMWEBRFCOO-PUTJDCORSA-N	241.356	1.810	10	20	BDCD	
COc1cc(C(=O)NCc2ccccc2O)on1	704742684	AMNBVXHXTYNSMZ-UHFFFAOYSA-N	248.238	1.319	10	20	BDCD	
CO[C@@H]1COC[C@H]1NCc1cc(C)ccc1O	842752745	UBRLGSMQOKPAMB-DGCLKSJQSA-N	237.299	1.204	10	20	BDCD	
Cc1ccc(CNC[C@H]2CCCN2C)c(O)c1	876985973	YQBWDULKGWELKX-CYBMUJFWSA-N	234.343	1.884	10	20	BDCD	
CC(=O)N[C@H](C)c1ccc(N(C)C)cc1	75824249	FLNOGNVLLYIJMX-SECBINFHSA-N	206.289	1.950	10	20	BDCD	
COC[C@H](O)CN[C@H](C)c1cc(C)ccc1O	71265164	LBIKVFCCIAOASP-GHMZBOCLSA-N	239.315	1.359	10	20	BDCD	
CN(Cc1ncc[nH]1)C(=O)c1cccc(O)c1O	126442679	QVBUGQTTWMVNIC-UHFFFAOYSA-N	247.254	1.093	10	20	BDCD	
C[C@@H](O)CCCNCc1cc(F)ccc1O	228091006	QBXCGFUFXXHHNO-SECBINFHSA-N	227.279	1.782	10	20	BDCD	
CN(CCn1cccn1)c1ccc(N)cc1	49314786	JSKWUAMZZSDMNH-UHFFFAOYSA-N	216.288	1.602	10	20	BDCD	
Oc1cccc2c1[C@H](NC[C@@H]1CCCN1)CC2	817953601	OXXXQNLHKJOAEM-NWDGAFQWSA-N	232.327	1.721	10	20	BDCD	
CC[C@H](NC/C=C\CO)c1ccccc1O	717533782	ZNXRWDODVZPDFP-FJOGCWAESA-N	221.300	1.981	10	20	BDCD	
Cc1cc(O)c(CN(C)[C@@H]2CCNC2)cc1C	843049586	RQOVUHLAWGIXCM-CYBMUJFWSA-N	234.343	1.803	10	20	BDCD	
COCc1nc(Cc2ccc(N)cc2)no1	843162750	LSVXFHQFPQNSQS-UHFFFAOYSA-N	219.244	1.389	10	20	BDCD	
CCOc1ccc(CNC/C=C\CO)c(O)c1	850357999	YHAZDLPRGACILT-ARJAWSKDSA-N	237.299	1.429	10	20	BDCD	
CCOc1ccc(CNC/C=C/CO)c(O)c1	850358000	YHAZDLPRGACILT-ONEGZZNKSA-N	237.299	1.429	10	20	BDCD	
CNC[C@@H](C)CNCc1cc(F)ccc1O	1118020450	WFLAFXRDLXHGNU-SECBINFHSA-N	226.295	1.476	10	20	BDCD	
C[C@@H](N[C@H](CO)CCF)c1c(O)cccc1F	886632758	DFWJNPMHJRFDEQ-BDAKNGLRSA-N	245.269	1.902	10	20	BDCD	
CCOC(=O)[C@@H](C)NCc1cc(F)ccc1O	83369144	YRDNYMVSAKCAQN-MRVPVSSYSA-N	241.262	1.573	10	20	BDCD	
COC1(C(F)(F)F)CN(CCN=[N+]=[N-])C1	409435092	SHEKTLPRWYTYKU-UHFFFAOYSA-N	224.186	1.560	10	20	BDCD	
CC1(N)CCN(C(=O)Cc2ccc(N)cc2)CC1	834589482	ONZBMAGHTRPAGT-UHFFFAOYSA-N	247.342	1.151	10	20	BDCD	
C[C@]1(O)CCN(Cc2ccccc2O)C1	180244807	IBJYIDPEGRFJFU-LBPRGKRZSA-N	207.273	1.349	10	20	BDCD	
CC[C@@H](CO)N[C@H](C)c1cc(F)ccc1O	87111341	COJWEHCPVQVWFR-SCZZXKLOSA-N	227.279	1.953	10	20	BDCD	
OC[C@H]1CCN(Cc2cc(Cl)ccc2O)C1	92763757	MYWIBLWJLDNDLA-VIFPVBQESA-N	241.718	1.860	10	20	BDCD	
C[C@](O)(C(=O)NCc1ccccc1O)C1CC1	287326113	OBNQGQVOILPCSE-CYBMUJFWSA-N	235.283	1.169	10	20	BDCD	
C[C@@H](N[C@H](CO)CCF)c1ccccc1O	846207677	BCJSORLFVRDVDB-ZJUUUORDSA-N	227.279	1.763	10	20	BDCD	
O=C1CC[C@@H](C(=O)NCc2ccccc2O)C1	843833870	YJNRGENQLOASEF-SECBINFHSA-N	233.267	1.378	10	20	BDCD	
CN(C[C@H](O)C1CC1)C(=O)c1cc(O)cs1	760805998	VYTVRYGLKKVZNH-VIFPVBQESA-N	241.312	1.297	10	20	BDCD	
Cc1cc(O)c(CNC[C@H]2C[C@H](O)C2)cc1C	873177417	KPLVYKLXKXOROV-AULYBMBSSA-N	235.327	1.870	10	20	BDCD	
CCOC[C@H](C)NCc1cccc(OC)c1O	44688775	LVWQLACUQYMQKX-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
CC(C)[C@H]1C(=O)NCCN1Cc1ccc(N)cc1	1356083596	UHDDZAJKJWFEJW-ZDUSSCGKSA-N	247.342	1.225	10	20	BDCD	
CCOC(=O)[C@@H](NCc1ccccc1O)C1CC1	1343507427	GUXRNPXOTXWGGN-ZDUSSCGKSA-N	249.310	1.824	10	20	BDCD	
C[C@H](CC(=O)O)NCc1cc(F)ccc1O	1603132617	BYZSOWOLCMCSKW-SSDOTTSWSA-N	227.235	1.484	10	20	BDCD	
CC[C@@H](N)C(=O)NCc1ccc(N(C)C)cc1	40825883	IXCMILYGPWOQQA-GFCCVEGCSA-N	235.331	1.106	10	20	BDCD	
COc1ccc(O)c(CN(C)C[C@@H](C)N)c1	380690619	IPDXWRWKPHKHHS-SECBINFHSA-N	224.304	1.180	10	20	BDCD	
COc1ccc(O)c(CNCCn2cccn2)c1	42539170	PQCLETXQYVBMOA-UHFFFAOYSA-N	247.298	1.387	10	20	BDCD	
O=C(NCc1ccccc1O)c1ccc(F)nc1	134789909	RGOAAVXQNGFGSW-UHFFFAOYSA-N	246.241	1.856	10	20	BDCD	
C[C@H](CO)N[C@H](C)c1cc(F)ccc1O	87111366	KYKZMGFKYQAOSP-HTQZYQBOSA-N	213.252	1.563	10	20	BDCD	
CC[C@H](N[C@H]1C[C@@H](O)C1)c1ccccc1O	294896033	RFOIFYXRJDVRLC-UMNHJUIQSA-N	221.300	1.956	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@@H]2CO)c1	92471014	KQFIHBQRNFMOGI-GFCCVEGCSA-N	221.300	1.657	10	20	BDCD	
C[C@@H](O)[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1	272522727	LLUSNCXLJKZVMF-OCCSQVGLSA-N	248.370	1.955	10	20	BDCD	
Cc1cccc(CN(C)CCOCCO)c1O	282842034	VTPZGMQYJCTZKI-UHFFFAOYSA-N	239.315	1.141	10	20	BDCD	
Cc1ccc([C@@H](C)NC[C@H](C)N)c(O)c1	817972748	OHQSCDVPTLQXCD-VHSXEESVSA-N	208.305	1.698	10	20	BDCD	
C[C@@H]1COCC[C@H]1NCCc1ccc(N)cc1	817957634	NHBJGIHSTBYUOL-BXUZGUMPSA-N	234.343	1.826	10	20	BDCD	
C[C@@H]1C[C@H](O)CN(Cc2ccccc2O)C1	825311062	GARUUWNZYZCRQG-PWSUYJOCSA-N	221.300	1.595	10	20	BDCD	
CC(=O)CCCOC(=O)c1cc(O)cs1	732353416	HNGJBEABBQHCIO-UHFFFAOYSA-N	228.269	1.980	10	20	BDCD	
CC(C)(NCc1cc(F)cc(F)c1O)C(=O)O	904007320	DIHCFDUTMIDQLV-UHFFFAOYSA-N	245.225	1.623	10	20	BDCD	
CCOc1cccc(CNC[C@H](N)CC)c1O	841071708	JGMUGFZEVLUWRZ-LLVKDONJSA-N	238.331	1.618	10	20	BDCD	
Cc1cccc(CN2C[C@H](C)N[C@@H](C)C2)c1O	843049753	VPZGBYUJKJGTEB-RYUDHWBXSA-N	234.343	1.883	10	20	BDCD	
CC[C@@H](CCO)NCc1c(C)cccc1O	877055584	QIFCVYKRHSAHDW-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
COc1ccc2c(c1)CCCN2C[C@@H](C)N	1118260676	FBWNITSPIBYHEQ-SNVBAGLBSA-N	220.316	1.795	10	20	BDCD	
CON(C)CCNCc1c(O)cccc1Cl	883172543	KVYZHCYJYHHMST-UHFFFAOYSA-N	244.722	1.628	10	20	BDCD	
C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H]1O	897684641	UKYCONJMBNVKLS-PELKAZGASA-N	241.718	1.858	10	20	BDCD	
O=C1OCC[C@@H]1NCc1c(O)cccc1Cl	895800538	CVGBXECYQHSHPU-VIFPVBQESA-N	241.674	1.451	10	20	BDCD	
C[C@@H]1C[C@@H]1NC(=O)Cc1ccc(N)cc1	52268068	KNJSDBRWBOHMPQ-KCJUWKMLSA-N	204.273	1.336	10	20	BDCD	
C[C@@H](NC(=O)[C@@H]1[C@H]2CNC[C@H]21)c1ccccc1O	877256448	WLENZDPKOULSHI-GOONRYMUSA-N	246.310	1.035	10	20	BDCD	
C[C@H](CC(=O)O)NCc1c(O)cccc1Cl	1603132870	GHCHAIRJWUSPKE-SSDOTTSWSA-N	243.690	1.998	10	20	BDCD	
COc1ccc(CNC[C@@H]2CCCN2)cc1C	258898104	LZGSRLKYKVWCOC-ZDUSSCGKSA-N	234.343	1.845	10	20	BDCD	
C[C@@H](NCCCCN)c1cc(F)ccc1O	87111386	XNQWGWCQMCICES-SECBINFHSA-N	226.295	1.921	10	20	BDCD	
CCN(CC(=O)NC)c1ccc(OC)cc1	269600010	KQLVCLNQZPRQBC-UHFFFAOYSA-N	222.288	1.268	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@H](O)C1CC1	830141801	YQWGUOWODSZZHV-GFCCVEGCSA-N	235.283	1.122	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2NC3)cc1	841846219	LNTXCJFXZHUGEU-OASPWFOLSA-N	245.326	1.595	10	20	BDCD	
CC(C)C[C@H](O)CNC(=O)c1cc(O)cs1	771051112	TWNMJGBFIXTVIA-QMMMGPOBSA-N	243.328	1.591	10	20	BDCD	
Cc1ccc(O)c(CN(C)CCC(=O)O)c1	83410494	STDYMBXAIBFWOE-UHFFFAOYSA-N	223.272	1.607	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](C)CCO)c1	85126302	CSWJMSMLCLLTOX-LLVKDONJSA-N	223.316	1.809	10	20	BDCD	
Nc1ccc(N2C[C@@H](CO)C3(CCC3)C2)cc1	409434833	QUJPRVLYODZQPN-NSHDSACASA-N	232.327	1.868	10	20	BDCD	
O=C(NC1(C2CC2)CC1)c1cccc(O)c1O	829306972	LUOQWYGQWDKGLB-UHFFFAOYSA-N	233.267	1.770	10	20	BDCD	
CC[C@H](C)C[C@H](N)C(=O)NCc1ccc(N)cc1	1356237802	AXPQFUIMNSBWCN-GWCFXTLKSA-N	249.358	1.649	10	20	BDCD	
C[C@@H](CN)NCc1ccc2c(c1)CCCO2	162066871	HAMOAQSPXPDZFK-JTQLQIEISA-N	220.316	1.448	10	20	BDCD	
Cc1cccc(CNC[C@H]2CCOC2)c1O	162827745	SLYUTELQIVDTRK-LLVKDONJSA-N	221.300	1.827	10	20	BDCD	
O=C(O)C1=NN(c2ccc(F)cc2)C(=O)C1	104712956	BFTVZFSTJVWLSO-UHFFFAOYSA-N	222.175	1.003	10	20	BDCD	
C[C@@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)CCN1	834673851	WUSVVXMYTCYGQE-ZWNOBZJWSA-N	247.342	1.068	10	20	BDCD	
Cc1ccc(CN2CC[C@@]3(CCNC3)C2)c(O)c1	1579692031	PDQOTMDBYGKNKN-OAHLLOKOSA-N	246.354	1.886	10	20	BDCD	
CC[C@H]1CN(Cc2ccccc2O)CC[C@@H]1N	122246419	WXJLLGPQUSDMTL-AAEUAGOBSA-N	234.343	1.951	10	20	BDCD	
CCOCC(=O)NCc1ccc(N(C)C)cc1	61528838	RWGUXSCLYKYLJC-UHFFFAOYSA-N	236.315	1.405	10	20	BDCD	
C[C@H](NCc1nc[nH]n1)c1ccc(N(C)C)cc1	37919756	BVBLTBLNOJTINE-JTQLQIEISA-N	245.330	1.722	10	20	BDCD	
Nc1ccc(CC(=O)N2C[C@H]3C[C@@H]3C2)cc1	379522497	PECWQZDRRKKXQA-GHMZBOCLSA-N	216.284	1.290	10	20	BDCD	
CC1(C)CN(Cc2ccccc2O)CC[C@H]1O	275838243	GNNPGQXEHTXDGN-CYBMUJFWSA-N	235.327	1.985	10	20	BDCD	
COC(=O)[C@@H](C)N(C)Cc1cc(C)ccc1O	280934813	SBONYTVEXVAGAE-SNVBAGLBSA-N	237.299	1.694	10	20	BDCD	
Cc1cc(O)c(CNCc2cnnn2C)cc1C	288354714	CLPWDMWIXVBLMJ-UHFFFAOYSA-N	246.314	1.427	10	20	BDCD	
C[C@H](CF)NC(=O)/C=C/c1ccc(O)c(O)c1	292026756	XTBOGXXTOOIKGJ-RYEJSQLPSA-N	239.246	1.585	10	20	BDCD	
CC[C@@H](N[C@@H]1CCNC1)c1ccccc1O	817944915	OYTKDFREGPLTGM-ZYHUDNBSSA-N	220.316	1.795	10	20	BDCD	
C[C@H](NC1CC1)C(=O)NCCc1ccc(N)cc1	832659107	MKZQDJZUMJOKSQ-JTQLQIEISA-N	247.342	1.068	10	20	BDCD	
Cc1cccc(O)c1CN1CCO[C@@H](C)C1	876556871	WTLOSSJULYWVPF-NSHDSACASA-N	221.300	1.921	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)c2ccccc2F)C1	409422765	IOEMUZCFPDPBKS-UHFFFAOYSA-N	220.207	1.960	10	20	BDCD	
C[C@H]1OCC[C@H]1C(=O)NCc1ccccc1O	163138430	ZHECCSVZLJFIQE-MWLCHTKSSA-N	235.283	1.433	10	20	BDCD	
O=C(NOCC1CCC1)c1cccc(O)c1O	856350193	FIBFNPGBHWSRFW-UHFFFAOYSA-N	237.255	1.559	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C1(C(=O)O)CC1	844246796	UWELMWZFNOOJNJ-UHFFFAOYSA-N	249.266	1.215	10	20	BDCD	
CC1(C)[C@H]2CN(C(=O)c3cccc(O)c3O)C[C@H]21	193097123	WVJJDVGOQSWPLF-AOOOYVTPSA-N	247.294	1.826	10	20	BDCD	
CCc1cccc(CN[C@@H](C)CN(C)C)c1O	691503700	GODNLFUQFHHITE-NSHDSACASA-N	236.359	1.994	10	20	BDCD	
C[C@@H](C(=O)N[C@H](C)c1ccccc1O)N(C)C	827936905	GBWPHFONBHPXLS-ZJUUUORDSA-N	236.315	1.520	10	20	BDCD	
C[C@@H](N[C@@H]1CCN(C)C1)c1ccc(F)cc1O	62748157	DAUYLUTXJRVQSQ-MWLCHTKSSA-N	238.306	1.886	10	20	BDCD	
CCCCN(CCO)Cc1ccccc1O	128549734	KPXKDVGIJSZFCX-UHFFFAOYSA-N	223.316	1.987	10	20	BDCD	
Cc1cc(C(=O)NCc2ccc(O)c(O)c2)on1	182524997	MEANWYNKUPKCNO-UHFFFAOYSA-N	248.238	1.324	10	20	BDCD	
O=C(NCCc1ccc(O)c(O)c1)C1CC=CC1	156651634	LUJZVMIYNXQKLY-UHFFFAOYSA-N	247.294	1.723	10	20	BDCD	
CC[C@@](C)(CO)NCc1cc(OC)ccc1O	80886383	TWPRLAVIYIFZAK-ZDUSSCGKSA-N	239.315	1.651	10	20	BDCD	
CCc1nnc(N(C)Cc2ccccc2O)n1C	809864662	ACMJHHYALCCDQS-UHFFFAOYSA-N	246.314	1.720	10	20	BDCD	
Cc1ccc(O)c(CNC[C@H](N)C(C)C)c1	841028847	IRVHKVMZHXTWIN-LBPRGKRZSA-N	222.332	1.774	10	20	BDCD	
Cc1cc(CN(C)CCN)ccc1N(C)C	923379501	QBEZZJINLRQCBJ-UHFFFAOYSA-N	221.348	1.452	10	20	BDCD	
Cc1cc(O)c(CNC/C=C\CO)cc1C	850357699	RZAAUSJSMOVPFQ-ARJAWSKDSA-N	221.300	1.647	10	20	BDCD	
Cc1cccc(CN[C@H]2C[C@@H](C(=O)O)C2)c1O	874046388	WUFWHIQYCXXMBY-PHIMTYICSA-N	235.283	1.653	10	20	BDCD	
C[C@@H]1C[C@@H](O)CN1C(=O)c1cc(O)cs1	788592311	QCIVDCWNTLVIST-RNFRBKRXSA-N	227.285	1.049	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)C[C@H]1CCCO1	77258411	GQNPMLCAGROUJV-GFCCVEGCSA-N	249.310	1.920	10	20	BDCD	
[N-]=[N+]=NCC(=O)N1CCC[C@@]2(CCCCO2)C1	409426067	HLDCDHMEVPZHBN-NSHDSACASA-N	238.291	1.858	10	20	BDCD	
[N-]=[N+]=NCCN1CCC[C@@]2(C[C@@H](O)CCO2)C1	409428594	GSWDXHIUAAGPCR-WDEREUQCSA-N	240.307	1.303	10	20	BDCD	
CC(C)[C@@H](CO)NCc1cc(F)cc(F)c1O	708487031	VEQRELWMXVOQJQ-LLVKDONJSA-N	245.269	1.777	10	20	BDCD	
C[C@@H]1C[C@H](NCc2ccccc2O)CCN1	709372061	SYVZTLIIAKYDFZ-ZYHUDNBSSA-N	220.316	1.622	10	20	BDCD	
CCc1cccc(CNC[C@H](C)O)c1O	691458861	DHEQMZUQXNPGQX-VIFPVBQESA-N	209.289	1.425	10	20	BDCD	
CCNC(=O)CNCc1ccc2c(c1)CCCO2	921489189	YVDUHAMTYRQYFG-UHFFFAOYSA-N	248.326	1.237	10	20	BDCD	
O=C(NCC(F)F)c1cc(O)cs1	306183766	BZUIBGWBZRPTOK-UHFFFAOYSA-N	207.201	1.449	10	20	BDCD	
O=C(CSc1nccs1)[C@H]1CCOC1	134169519	UNOFUJPTSKNQOQ-ZETCQYMHSA-N	229.326	1.841	10	20	BDCD	
O=C(CCn1ccnc1)NCc1ccccc1O	134240754	JVJLUQMZOSCLLX-UHFFFAOYSA-N	245.282	1.295	10	20	BDCD	
CN(C)C(=O)NCc1ccc(N(C)C)c(F)c1	194636487	RAJLXWMUBSPXDE-UHFFFAOYSA-N	239.294	1.663	10	20	BDCD	
C[C@H](CC(C)(C)O)NC(=O)c1cc(O)cs1	854762016	SNWPTOBHQSNJTD-SSDOTTSWSA-N	243.328	1.733	10	20	BDCD	
Cc1cccc(O)c1CN(C)C[C@H](C)O	877320727	SMVGCDMLSBGWNO-JTQLQIEISA-N	209.289	1.513	10	20	BDCD	
C[C@@H]1C[C@H](NC(=O)c2cc(O)cs2)CCO1	770412778	WIDSQZNTGGLKHJ-HTQZYQBOSA-N	241.312	1.751	10	20	BDCD	
C[C@@H](O)CCCNC(=O)c1cc(O)cs1	791010057	DXSNZAOMHGDYJS-SSDOTTSWSA-N	229.301	1.345	10	20	BDCD	
COc1ccc(CNCC(F)F)c(O)c1OC	1352055763	XQRLDNYHLGJCLG-UHFFFAOYSA-N	247.241	1.764	10	20	BDCD	
Cc1cccc(CN2CC[C@@H](CC(N)=O)C2)c1O	377852922	VFWZSFRQOOQXJM-NSHDSACASA-N	248.326	1.398	10	20	BDCD	
CN(CCC1OCCO1)Cc1ccccc1O	124946261	XDOBSZDYQRBMGJ-UHFFFAOYSA-N	237.299	1.587	10	20	BDCD	
CC(C)[C@@H](CO)NCc1ccccc1O	38313032	SHVPVNHYJGUUJF-LLVKDONJSA-N	209.289	1.499	10	20	BDCD	
C[C@@H]1C[C@@H]1CNC(=O)Cc1ccc(N)cc1	136316396	APRVFHMROWSQMG-MWLCHTKSSA-N	218.300	1.584	10	20	BDCD	
C[C@H](CCO)CNCc1ccc(N(C)C)cc1	97439051	FWEZDGHJGMEWJX-GFCCVEGCSA-N	236.359	1.861	10	20	BDCD	
CCCN(Cc1ccccc1O)C(=O)[C@@H](C)N	156730083	CKYQCISBHPCOCP-SNVBAGLBSA-N	236.315	1.478	10	20	BDCD	
CC(=O)C(=O)CSc1nnc(C(C)C)n1C	808021116	AITADPIWQKHVRN-UHFFFAOYSA-N	241.316	1.189	10	20	BDCD	
CC[C@H](NC[C@@H](C)N)c1ccc(F)cc1O	817974171	ZXGLGKUJQDQNIF-KCJUWKMLSA-N	226.295	1.919	10	20	BDCD	
C/C(=C\CN(C)Cc1ccccc1O)C(=O)O	825729641	JAUUHHGQXQKYNT-JXMROGBWSA-N	235.283	1.855	10	20	BDCD	
C[C@H]1C[C@H](NC(=O)c2cc(O)cs2)CO1	844152993	JFKIKWBZGZUTLI-BQBZGAKWSA-N	227.285	1.361	10	20	BDCD	
C[C@H](N=c1nc[nH]n1C)c1ccc(N(C)C)cc1	846750953	JLFUGBZFXXRUQC-JTQLQIEISA-N	245.330	1.476	10	20	BDCD	
COc1cccc([C@@H](C)NC[C@H](C)O)c1O	846138299	QEOVCYYSVFFBJN-DTWKUNHWSA-N	225.288	1.432	10	20	BDCD	
Oc1ccc(F)cc1CN[C@@H]1CCCNCC1	841058835	VZASWFWOYSACMV-GFCCVEGCSA-N	238.306	1.763	10	20	BDCD	
CNC[C@H](C)NCc1cc(Cl)ccc1O	853250085	ZSZFOWNBKWUQTA-QMMMGPOBSA-N	228.723	1.743	10	20	BDCD	
Cc1ccc(CNCCc2cnn(C)c2)c(O)c1	876955141	SJPHQWIDQFLYKP-UHFFFAOYSA-N	245.326	1.766	10	20	BDCD	
Cc1cccc(O)c1CN1CC[C@](C)(O)C1	876791705	PAHHCSASPJDCGK-ZDUSSCGKSA-N	221.300	1.657	10	20	BDCD	
Cc1ccc(CN[C@@H](C)CCCO)c(O)c1	877109893	TWGKRTUKRKNLIV-NSHDSACASA-N	223.316	1.951	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C)c2ncnn2C)c1	276755089	UACMZBIKZOUGLN-SNVBAGLBSA-N	246.314	1.680	10	20	BDCD	
CN1CC[C@@H]1CNCc1ccccc1O	712608575	NBZLBCJVUHGHJX-LLVKDONJSA-N	206.289	1.186	10	20	BDCD	
Cc1cc(O)c(CN[C@H](C)CC(=O)O)cc1C	1611157965	IKPNOKFGGUEPDV-SNVBAGLBSA-N	237.299	1.962	10	20	BDCD	
O=C(Nc1nccs1)c1cccc(O)c1O	163266662	KZRHNQCTDLTEDC-UHFFFAOYSA-N	236.252	1.807	10	20	BDCD	
CCOCCN(C)Cc1cc(OC)ccc1O	156089179	HGDMKUYJHUDMMH-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
Cc1ccc(O)c(CN[C@@H](C)c2ncn(C)n2)c1	275772811	HELOPBFLSSXAQD-JTQLQIEISA-N	246.314	1.680	10	20	BDCD	
CO[C@@H](C)CNCc1ccc(N(C)C)cc1	191207227	KOZUFMRWIXURQN-NSHDSACASA-N	222.332	1.877	10	20	BDCD	
Nc1ccc(NC(=O)[C@@]23CCC[C@@H]2CNC3)cc1	294773252	MYFHCZINZOGIBC-QMTHXVAHSA-N	245.326	1.597	10	20	BDCD	
C[C@@]1(NCc2cccc(F)c2O)CCOC1=O	290936468	PJLPAFADVRAFRK-GFCCVEGCSA-N	239.246	1.327	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC[C@H](C)CN)c1	817963211	SJBPULAKGSWPIS-MNOVXSKESA-N	222.332	1.946	10	20	BDCD	
C[C@@H]1C[C@H](NCCc2ccc(N)cc2)[C@@H](C)O1	817956794	DBVJPFMIXBEELH-GYSYKLTISA-N	234.343	1.967	10	20	BDCD	
Cc1cccc(CN2CC(C(C)(C)O)C2)c1O	839140683	SRYPIVNIFUQJAJ-UHFFFAOYSA-N	235.327	1.903	10	20	BDCD	
CCNCC(=O)NCc1ccc(N(C)C)cc1C	844186849	YCXHRNRIRXDGJH-UHFFFAOYSA-N	249.358	1.287	10	20	BDCD	
CN1CC(=O)N[C@H]1c1cc(Cl)cc(F)c1O	768273044	CZGQARJYMZSCHV-SNVBAGLBSA-N	244.653	1.245	10	20	BDCD	
CCCN(CCO)Cc1ccc(C)cc1O	876537803	CTCZRTGCXRDVHN-UHFFFAOYSA-N	223.316	1.905	10	20	BDCD	
Cc1ccc(CN2CCN(C)C(=O)[C@@H]2C)c(O)c1	877433084	ITQODYASIFJGQI-NSHDSACASA-N	248.326	1.363	10	20	BDCD	
C[C@H](N[C@H]1CCN(C)C1)c1c(O)cccc1F	886522913	SYBPNBJNWVTUBA-UWVGGRQHSA-N	238.306	1.886	10	20	BDCD	
C[C@@H](N[C@@H]1CC(=O)N(C)C1)c1ccccc1O	272919350	XULWYGVCQKNPKI-NXEZZACHSA-N	234.299	1.274	10	20	BDCD	
Oc1cccc(Cl)c1CNC[C@H]1C[C@@H](O)C1	720962872	NARDPSAOOKWXQY-DTORHVGOSA-N	241.718	1.906	10	20	BDCD	
C[C@](CCF)(NCc1ccc(N)cc1)C(=O)O	1604141416	CNLSYDJUJKLRNE-GFCCVEGCSA-N	240.278	1.561	10	20	BDCD	
CSC[C@](C)(O)CNCc1ccccc1O	164251366	YFHDZERKQZBVSB-GFCCVEGCSA-N	241.356	1.596	10	20	BDCD	
CC(C)(NCc1ccc2c(c1)CCO2)C(=O)O	258917555	ZTQIMUFJWFVKJG-UHFFFAOYSA-N	235.283	1.574	10	20	BDCD	
CN(Cc1cc(F)ccc1O)Cc1nccn1C	230935697	XQLOPQVQTLUASP-UHFFFAOYSA-N	249.289	1.897	10	20	BDCD	
CCN(CCN)Cc1cc(Cl)ccc1O	300799236	ITHBNUNBDYMNHC-UHFFFAOYSA-N	228.723	1.826	10	20	BDCD	
Cc1ccc(O)c(CN2CC[C@@]3(CCNC3)C2)c1	310808023	AJKSTMUXXCREEQ-OAHLLOKOSA-N	246.354	1.886	10	20	BDCD	
C[C@@H]1COCCN(Cc2cc(F)ccc2O)C1	369451438	JNLNVPMNQUVDPZ-JTQLQIEISA-N	239.290	2.000	10	20	BDCD	
COC[C@H](C)N(C)Cc1cccc(OC)c1O	132679300	WLKJJYKWRFEXJY-JTQLQIEISA-N	239.315	1.868	10	20	BDCD	
N[C@@H]1CCCC[C@H]1NCc1ccccc1O	138446178	QYCOIDDSGOZUPC-VXGBXAGGSA-N	220.316	1.752	10	20	BDCD	
CC(C)(C)[C@H](N)C(=O)NCCc1ccc(N)cc1	262585254	UIPPOGFEMNFZMF-GFCCVEGCSA-N	249.358	1.301	10	20	BDCD	
Nc1ccc(NC(=O)[C@H]2C[C@@]23CCNC3)cc1	376245054	OQIDGYIHSVUQHU-DGCLKSJQSA-N	231.299	1.207	10	20	BDCD	
C[C@H](CO)N(C)Cc1cc(F)ccc1O	289179920	AKDWHFRIQPHYGU-MRVPVSSYSA-N	213.252	1.344	10	20	BDCD	
CC(=O)C(=O)COc1cc(C)ccc1[N+](=O)[O-]	808016216	HIXMWHYANZETPD-UHFFFAOYSA-N	237.211	1.440	10	20	BDCD	
C[C@H](CN)N[C@H](C)c1cc(F)cc(F)c1O	817965828	CPRHXCGBDGRQNH-RNFRBKRXSA-N	230.258	1.668	10	20	BDCD	
CCO[C@@H]1C[C@@H]1C(=O)N[C@H](C)c1ccccc1O	827930229	FKEOHCMQWMJLFJ-SUZMYJTESA-N	249.310	1.994	10	20	BDCD	
O=C(NCCC1CC(O)C1)c1cc(O)cs1	762918577	HIKYWZLBBXFQML-UHFFFAOYSA-N	241.312	1.345	10	20	BDCD	
COc1ccc(O)c([C@H](C)NCC(C)=O)c1	878361030	VULOWFKIWQVAGT-VIFPVBQESA-N	223.272	1.640	10	20	BDCD	
C[C@@H]1CCC(=O)CN1C(=O)c1cccc(O)c1O	885083448	OFQXIHGCBXRGDS-MRVPVSSYSA-N	249.266	1.291	10	20	BDCD	
Cc1ccc(O)c(CNCCCCN)c1	70955246	BCXJKNSMIIXZEZ-UHFFFAOYSA-N	208.305	1.529	10	20	BDCD	
O=C(CCC(F)F)NCc1cccc(O)c1O	1347234754	PGVXMDBRGXMVRP-UHFFFAOYSA-N	245.225	1.759	10	20	BDCD	
CCOC(=O)C[C@H]1CNc2ccccc2N1	34453104	RJOAMELXRNIPRB-VIFPVBQESA-N	220.272	1.846	10	20	BDCD	
Cc1cnn(C)c1CNCc1ccc(N)cc1	1579826437	LFBOBPRHXORETN-UHFFFAOYSA-N	230.315	1.601	10	20	BDCD	
Cc1ccc(O)c([C@@H](C)NC[C@@H](C)CO)c1	83216053	XZLJDFQLWLQPHY-GHMZBOCLSA-N	223.316	1.980	10	20	BDCD	
COc1ccc(O)c(CN[C@H](CO)C2CC2)c1	776176980	HDTFAGCSZVLGJJ-GFCCVEGCSA-N	237.299	1.261	10	20	BDCD	
COc1ccc2c(c1)CCCN2CCCN	84781428	SWUQCIBTLQNRES-UHFFFAOYSA-N	220.316	1.797	10	20	BDCD	
C[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(N(C)C)cc1	817976519	MWSLVCGSEZUDPW-RABLLNBGSA-N	245.370	1.621	10	20	BDCD	
Cc1ccc([C@H](C)NC[C@@H](C)N)c(O)c1	817972749	OHQSCDVPTLQXCD-ZJUUUORDSA-N	208.305	1.698	10	20	BDCD	
C[C@H](N[C@H]1CCCNC1)c1ccc(F)cc1O	817942134	XADDSTHUDCLDOS-ONGXEEELSA-N	238.306	1.934	10	20	BDCD	
CCOc1ccc(O)c(CN2CC[C@@H](N)C2)c1	843045495	SLXCPEWBBIGBBS-LLVKDONJSA-N	236.315	1.324	10	20	BDCD	
C[C@@]1(O)CCCN(C(=O)c2cc(O)cs2)C1	767157621	UALDLWFUSALPMP-LLVKDONJSA-N	241.312	1.441	10	20	BDCD	
C[C@@H]1C[C@@H](O)CN1Cc1ccccc1O	788268585	GKHCDJNANZDBNI-MWLCHTKSSA-N	207.273	1.347	10	20	BDCD	
O=C1[C@H](Sc2nccs2)CCN1C1CC1	1319381718	XYHKDBNATMTFDL-MRVPVSSYSA-N	240.353	1.999	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@@H](O)C1)c1cc(F)ccc1O	720908044	TVRWWJFQSJCONN-KKZNHRDASA-N	239.290	1.953	10	20	BDCD	
COc1cccc(O)c1CN[C@H]1CCN(C)C1	729682097	MSUAVARAYIZSTL-JTQLQIEISA-N	236.315	1.195	10	20	BDCD	
CC(C)CN(C)C(=O)c1cccc(O)c1O	163270108	YZZFIWKJWVYZMB-UHFFFAOYSA-N	223.272	1.826	10	20	BDCD	
C[C@@H](CC(N)=O)N[C@H](C)c1ccc(F)cc1O	168828225	WALTZGSTMGJHEM-JGVFFNPUSA-N	240.278	1.446	10	20	BDCD	
CCOCCC(=O)Nc1ccc(N)cc1	22222356	MXLQCFVIUUATDN-UHFFFAOYSA-N	208.261	1.634	10	20	BDCD	
C[C@H](CN)CNCc1ccc2c(c1)CCO2	258798217	QZQCORAIHOJZRK-SNVBAGLBSA-N	220.316	1.306	10	20	BDCD	
Cc1ccc([C@H](C)N[C@H]2C[C@H](O)C2)c(O)c1	850577889	DYLBHEQSEROZOG-DCAQKATOSA-N	221.300	1.875	10	20	BDCD	
COC[C@@H](NC(=O)Nc1ccc(N)cc1)C1CC1	397353963	JKSBMKLOYUVBFZ-GFCCVEGCSA-N	249.314	1.815	10	20	BDCD	
Cn1cc(CCNCc2ccccc2O)cn1	112017372	XRCZGRDYZIWRMP-UHFFFAOYSA-N	231.299	1.458	10	20	BDCD	
C[C@H](CO)NCc1ccc(N(C)C)cc1	35603829	QYOVVUOICGPJHS-SNVBAGLBSA-N	208.305	1.223	10	20	BDCD	
OC[C@@H]1CCN(Cc2cc(F)ccc2O)C1	180026209	HKOQCUSWJFARRP-SECBINFHSA-N	225.263	1.346	10	20	BDCD	
CC(C)CONC(=O)NCc1ccccc1O	269735498	KTMKKTADMAIJFR-UHFFFAOYSA-N	238.287	1.779	10	20	BDCD	
NCCC(=O)NCc1c(O)ccc2c1CCCC2	295287475	WSHXFVVNJRDPGQ-UHFFFAOYSA-N	248.326	1.236	10	20	BDCD	
CC(=O)C(=O)Cn1ccc2sccc2c1=O	808032277	RULXVOMGFPRXNA-UHFFFAOYSA-N	235.264	1.221	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCCOCC1	732279775	YQLQNYQBTNJRCP-UHFFFAOYSA-N	227.285	1.316	10	20	BDCD	
NC[C@@H]1CCN(Cc2cccc(F)c2O)C1	843048364	MCUKPSGZWIGNTN-VIFPVBQESA-N	224.279	1.312	10	20	BDCD	
COc1cccc(O)c1CNC[C@H](N)C1CC1	841051185	VBDIBZMMQBKUPM-NSHDSACASA-N	236.315	1.228	10	20	BDCD	
CC[C@@H](CO)C(=O)NCc1cc(C)ccc1O	862757239	MPGRXVXWLCUXAP-JTQLQIEISA-N	237.299	1.335	10	20	BDCD	
CCN(CC(N)=O)Cc1ccc(N(C)CC)cc1	773887215	DNZIXCAAQOYENH-UHFFFAOYSA-N	249.358	1.450	10	20	BDCD	
C[C@@H](N[C@H]1CCN(C)C1)c1c(O)cccc1F	886522915	SYBPNBJNWVTUBA-ZJUUUORDSA-N	238.306	1.886	10	20	BDCD	
[N-]=[N+]=NCCN1CCOC[C@H]2CCC[C@@H]21	409435186	STPRRNJFHGBTRA-ZJUUUORDSA-N	210.281	1.798	10	20	BDCD	
C[C@H]1[C@@H](CO)CCCN1Cc1ccc(N)cc1	1335288430	FVEKJEDXLVGCRC-WCQYABFASA-N	234.343	1.862	10	20	BDCD	
O=C(/C=C/c1ccc(O)c(O)c1)N1CC2(CC2)C1	1354220179	HIRNGJMGCRXTGF-DUXPYHPUSA-N	245.278	1.733	10	20	BDCD	
NCCCCNCc1cccc(Cl)c1O	165153543	USLMYZQPWXTJMX-UHFFFAOYSA-N	228.723	1.874	10	20	BDCD	
C[C@@H](Cn1ccnc1)NCc1cc(F)ccc1O	226584584	YEMFFIMTIKENQZ-JTQLQIEISA-N	249.289	1.906	10	20	BDCD	
CN(C(=O)C(C)(C)F)c1ccc(N)cc1	309043806	LRRWMOUPPHCPKJ-UHFFFAOYSA-N	210.252	1.980	10	20	BDCD	
Cc1ccc(O)c([C@H](C)NC[C@H](C)CO)c1	83216068	XZLJDFQLWLQPHY-QWRGUYRKSA-N	223.316	1.980	10	20	BDCD	
COCCCCNCc1ccccc1O	44655363	UAACRXISOTWNLY-UHFFFAOYSA-N	209.289	1.908	10	20	BDCD	
C[C@H](N[C@@H](C)c1nncn1C)c1ccccc1O	37017446	MVVIGOBWSNPIOU-UWVGGRQHSA-N	246.314	1.933	10	20	BDCD	
O=C(OCCCCCO)c1cc(O)cs1	803346648	VXYATQXSDUJRDF-UHFFFAOYSA-N	230.285	1.773	10	20	BDCD	
Nc1ccc(/C=C2\SC(=S)NC2=O)cn1	821022480	RMKQHDRXVHUSRT-UTCJRWHESA-N	237.309	1.153	10	20	BDCD	
CN(C)CCCN(C)C(=O)c1cc(O)cs1	831706260	CRFWZMUNDCWUMJ-UHFFFAOYSA-N	242.344	1.477	10	20	BDCD	
CCc1cccc(CN(C)Cc2nc[nH]n2)c1O	848886349	DQKIRHIHEMHPEM-UHFFFAOYSA-N	246.314	1.705	10	20	BDCD	
C[C@@H](O)CCN(C)Cc1cc(F)cc(F)c1O	894033275	FVYAGUFHOPCPAA-MRVPVSSYSA-N	245.269	1.873	10	20	BDCD	
CN(C)C(C)(C)CNC(=O)Cc1ccc(N)cc1	42288134	IHNZIVIVUMEELW-UHFFFAOYSA-N	249.358	1.268	10	20	BDCD	
CC1(CNCc2ccc(N)cc2)CCNCC1	1262488297	XRSVUCDXSXBXHU-UHFFFAOYSA-N	233.359	1.748	10	20	BDCD	
CC(C)C(=O)N1Cc2cccc(O)c2C1	536952441	CFZIWGCMBIFIGY-UHFFFAOYSA-N	205.257	1.890	10	20	BDCD	
OCCOCCNCc1cc(Cl)ccc1O	20198853	FHHKSHFDMDHFOZ-UHFFFAOYSA-N	245.706	1.144	10	20	BDCD	
CC[C@@H](NCCO)c1ccc(N(C)C)cc1	166486865	BSXAWMBYRQRURF-CYBMUJFWSA-N	222.332	1.786	10	20	BDCD	
Cc1ccc(O)c(CN2CCC[C@H](C(N)=O)C2)c1	155011113	SWVLMMBNWLNLHU-NSHDSACASA-N	248.326	1.398	10	20	BDCD	
CON(C)CCN[C@@H](C)c1ccc(C)cc1O	850479392	RPSRCEUTAPKAGV-NSHDSACASA-N	238.331	1.844	10	20	BDCD	
Nc1ccc(NC(=O)C[C@H]2CCOC2)cc1	401250590	AAYBFJXGEAQXQK-SECBINFHSA-N	220.272	1.634	10	20	BDCD	
CC[C@H](N[C@@H]1COC[C@@H]1O)c1ccccc1O	323503529	DJZFXHSQTYEGAY-LOWVWBTDSA-N	237.299	1.193	10	20	BDCD	
C[C@H]1COCCN(Cc2cc(F)ccc2O)C1	369451439	JNLNVPMNQUVDPZ-SNVBAGLBSA-N	239.290	2.000	10	20	BDCD	
C[C@@H](NC(=O)C1CSC1)c1ccccc1O	827952496	VPHWGJWFVZXZTL-MRVPVSSYSA-N	237.324	1.932	10	20	BDCD	
CC[C@@H](N)CNCc1ccc(N(C)C)cc1	841070594	RIJNJQNDJIIUBC-GFCCVEGCSA-N	221.348	1.580	10	20	BDCD	
C[C@H](CO)N[C@H](C)c1ccc(F)cc1O	62745819	PNPUWQFNRGTZNU-HTQZYQBOSA-N	213.252	1.563	10	20	BDCD	
CCN(CCN)Cc1cccc(OC)c1O	300870712	XEMVRSNXDVAFEQ-UHFFFAOYSA-N	224.304	1.181	10	20	BDCD	
OCCN(Cc1ccccc1O)C1CC1	128550729	DUGUZJUULTWNMQ-UHFFFAOYSA-N	207.273	1.349	10	20	BDCD	
CC(C)OCCNCc1ccccc1O	134123822	ZWWWQEVQLQYSKJ-UHFFFAOYSA-N	209.289	1.907	10	20	BDCD	
C[C@H](CF)NCc1cc(F)ccc1O	290264107	XAXKHBPALMUODW-SSDOTTSWSA-N	201.216	1.979	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@H]1CCO	832544420	ZPNNEAIIOAXKMG-QMMMGPOBSA-N	241.312	1.441	10	20	BDCD	
Cc1cccc(CN2CC[C@H]3NCC[C@@H]3C2)c1O	843127262	PCQWBTMSVVHONB-TZMCWYRMSA-N	246.354	1.884	10	20	BDCD	
Cn1cccc1CNC(=S)NC1(C)CCC1	840733439	RCFNVBSQQZGIOZ-UHFFFAOYSA-N	237.372	1.932	10	20	BDCD	
C[C@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1	768443972	KEISHHWBFQAHRR-ZANVPECISA-N	249.310	1.660	10	20	BDCD	
COC[C@@H](CCO)NCc1ccc(C)cc1O	877050409	ZQQXPGJSUOJOCX-GFCCVEGCSA-N	239.315	1.188	10	20	BDCD	
C[C@@H](NC[C@H]1C[C@H](N)C1)c1ccccc1O	873257994	WNBKXIXRKZEJIZ-GMTAPVOTSA-N	220.316	1.780	10	20	BDCD	
COC(=O)[C@@H]1CCCN1Cc1ccc(C)cc1O	876563194	ZWGYGBCJSOXGLP-LBPRGKRZSA-N	249.310	1.838	10	20	BDCD	
CC(=O)Cn1cc(COc2ccc(N)cc2)nn1	880956683	RJAOBRAHOGZBDD-UHFFFAOYSA-N	246.270	1.028	10	20	BDCD	
COc1cccc(CNC[C@@H](C)CO)c1O	82367472	VSASQVUFQMZYCJ-SECBINFHSA-N	225.288	1.119	10	20	BDCD	
C[C@@H](O)C(=O)N(C)Cc1ccc(N(C)C)cc1	276087803	JRDFJJAQJZRYJR-SNVBAGLBSA-N	236.315	1.092	10	20	BDCD	
Cc1ccc(O)c(CN[C@H](C(=O)O)C2CC2)c1	86758695	BZYISWCWYKAYAD-LBPRGKRZSA-N	235.283	1.653	10	20	BDCD	
CCN(C(=O)CN=[N+]=[N-])[C@@H]1CCSC1	409425976	BQGKVKPQCQDSHN-SSDOTTSWSA-N	214.294	1.651	10	20	BDCD	
NCC[C@H]1CCN(Cc2ccc(N)cc2)C1	1356083524	QYQLHGYPNSELIU-LBPRGKRZSA-N	219.332	1.440	10	20	BDCD	
CN(C)c1ccc(OCCOCCO)cc1	810000590	IYCTTYMROZHBKL-UHFFFAOYSA-N	225.288	1.140	10	20	BDCD	
C[C@@H]1CCCN1C(=O)c1cccc(O)c1O	163272097	IDXJKRFDCBUVLG-MRVPVSSYSA-N	221.256	1.722	10	20	BDCD	
COc1ccc(O)c(CNC(=O)C=C(C)C)c1	154638479	QCLJPDVJZKXMPJ-UHFFFAOYSA-N	235.283	1.983	10	20	BDCD	
COc1cc(O)c(CN(C)OC)cc1OC	159654085	LWSVAWGISXQWJB-UHFFFAOYSA-N	227.260	1.403	10	20	BDCD	
Nc1ccc(CNC(=O)[C@@H]2C[C@H]2F)cc1	1122540281	RHOAPAXQPFVSFK-NXEZZACHSA-N	208.236	1.243	10	20	BDCD	
CCCN[C@H]1CCC2=C(C1)[S@](=O)C(=N)N2	2048531918	MZOCOESUNXMDIR-ZIDLFYJRSA-N	227.333	1.037	10	20	BDCD	
CN(C(=O)[C@H]1CCCOC1)c1ccc(N)cc1	62192643	LJAQDGIEMFZSQM-JTQLQIEISA-N	234.299	1.658	10	20	BDCD	
CCOc1cccc(CN(C)CCOC)c1O	133463051	WKDHZYWVZGXCPV-UHFFFAOYSA-N	239.315	1.869	10	20	BDCD	
COC[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1	81039799	FPNYQLYLUTUKNX-LBPRGKRZSA-N	248.326	1.306	10	20	BDCD	
CN(C)c1ccc(CN2C[C@H](O)C(C)(C)C2)cc1	279961763	YJFPGJDNGOMTBR-AWEZNQCLSA-N	248.370	1.955	10	20	BDCD	
CCN(Cc1cc(F)ccc1O)[C@@H](C)CO	816653855	KUHOYCZOSQKNIA-VIFPVBQESA-N	227.279	1.734	10	20	BDCD	
CCc1cccc(CN2CC[C@@H](CO)C2)c1O	848886133	TWAVOVCSVUHBQF-LLVKDONJSA-N	235.327	1.769	10	20	BDCD	
CN(C)c1ccc(CN[C@H]2C[C@H](C(=O)O)C2)cc1	849230933	NRKRWDHOQKLCFP-HAQNSBGRSA-N	248.326	1.705	10	20	BDCD	
COc1cccc(CN[C@H]2CCCNC2)c1O	841043663	UWQLBEXCZCHNDR-NSHDSACASA-N	236.315	1.242	10	20	BDCD	
O=C(NCCOCCF)c1cc(O)cs1	856473097	KSHLVCMBLYBOID-UHFFFAOYSA-N	233.264	1.170	10	20	BDCD	
CN(C)c1ccc(CN2CC(C)(O)C2)cc1F	877580379	BHYJVAAVXJWSHS-UHFFFAOYSA-N	238.306	1.458	10	20	BDCD	
O=C(NCCCF)c1c(F)ccc(O)c1O	789996803	SIDQDHXABKLUIL-UHFFFAOYSA-N	231.198	1.326	10	20	BDCD	
Nc1ccc(CN2CCC[C@H](N)C2)cc1	1337838216	KQTVDHCFPRDPIF-LBPRGKRZSA-N	205.305	1.192	10	20	BDCD	
Nc1ccc(CNC(=O)NCCF)cc1	1353539562	MPKANJOUCJWECL-UHFFFAOYSA-N	211.240	1.038	10	20	BDCD	
C[C@@H](NCc1c(O)ccc(Cl)c1F)C(N)=O	309725573	XTJNLKDAZOXPKE-RXMQYKEDSA-N	246.669	1.148	10	20	BDCD	
CC(C)NC(=O)/C=C/c1ccc(O)c(O)c1	26263679	UZSZFSBQBDPEJD-GQCTYLIASA-N	221.256	1.636	10	20	BDCD	
CCN(C)C(=O)NCCc1ccc(N)cc1	85964728	VLAXFBMZSHMIGL-UHFFFAOYSA-N	221.304	1.473	10	20	BDCD	
C[C@H]1CSC[C@H]1NC(=O)c1cc(O)cs1	807692529	ZSIGOEPJJIKWNZ-POYBYMJQSA-N	243.353	1.935	10	20	BDCD	
C[C@H](OC(=O)c1cc(O)cs1)C(=O)O	736692919	ZDKQEIPWBXLICS-BYPYZUCNSA-N	216.214	1.084	10	20	BDCD	
O=C(c1cc(O)cs1)N1CCC[C@@H]1CO	789912198	ZBKGIXAUWLAKRQ-SSDOTTSWSA-N	227.285	1.051	10	20	BDCD	
COc1ccc(O)c(CN2C[C@H](O)C[C@@H]2C)c1	788270951	XPABBELVVIWMFU-GXSJLCMTSA-N	237.299	1.356	10	20	BDCD	
C[C@@H]1C[C@@H]1C(=O)NCc1ccc(N)cc1	37666212	FVFXTUYJYHSRIN-KCJUWKMLSA-N	204.273	1.541	10	20	BDCD	
CCC[C@H]1CN(CCN=[N+]=[N-])CC[C@H]1O	409436168	YLGIUOBHGZQVTH-VHSXEESVSA-N	212.297	1.780	10	20	BDCD	
Cc1cccc(CN[C@H]2CC=C(C(=O)O)C2)c1O	1600532492	SSNHKZLQCMZTMG-LBPRGKRZSA-N	247.294	1.964	10	20	BDCD	
C[C@H](NC1CC1)c1cc(C(=O)O)ccc1O	1609774302	JUKQFIBBEFGCPG-ZETCQYMHSA-N	221.256	1.903	10	20	BDCD	
Cc1ccoc1C(=O)NCc1ccc(O)c(O)c1	159077278	PJSRFTCWCREMDE-UHFFFAOYSA-N	247.250	1.929	10	20	BDCD	
NCc1ccc2c(c1)CCCN2C[C@H]1CCOC1	400561278	LXBLWIQNHXUXIY-CYBMUJFWSA-N	246.354	1.934	10	20	BDCD	
C[C@H](NCc1ccc2c(c1)CCO2)C(C)(C)O	393970990	MMSKKTWTIQHLKW-JTQLQIEISA-N	235.327	1.871	10	20	BDCD	
C[C@@H](N)C1CCN(Cc2ccccc2O)CC1	104136513	YCBPLBAJGDFXCX-LLVKDONJSA-N	234.343	1.951	10	20	BDCD	
C[C@@H](NCC1(C)OCCO1)c1ccccc1O	183634980	UGZXZNAWYNRMJK-SNVBAGLBSA-N	237.299	1.806	10	20	BDCD	
COc1ccc(O)c(CN[C@@H]2CCSC2)c1	129580961	PCTFCNKQJXZWKW-SNVBAGLBSA-N	239.340	1.996	10	20	BDCD	
COc1ccc(N2CCN(CC(C)=O)CC2)cc1	35181761	UJHNCOMTVRMQFL-UHFFFAOYSA-N	248.326	1.406	10	20	BDCD	
Nc1ccc(CC(=O)N2C[C@@H]3C[C@H]3C2)cc1	379522506	PECWQZDRRKKXQA-QWRGUYRKSA-N	216.284	1.290	10	20	BDCD	
C[C@@H](NCCN(C)C)c1cc(F)ccc1O	87111296	YZYDETNOFAPVGI-SECBINFHSA-N	226.295	1.744	10	20	BDCD	
Nc1ccc(NC(=O)[C@@H]2CCOC2)cc1	40941339	SONXXYUIUDJGCC-MRVPVSSYSA-N	206.245	1.244	10	20	BDCD	
COC(=O)C[C@@H](C)NC(=O)c1cc(O)cs1	829715042	RHZCZGLGTLUALW-ZCFIWIBFSA-N	243.284	1.135	10	20	BDCD	
C[C@@H]1CCN(Cc2ccccc2O)C[C@H]1CO	857061321	OIGGLOUYIHGJDY-YPMHNXCESA-N	235.327	1.843	10	20	BDCD	
CCOCCONC(=O)c1cc(O)cs1	776265332	WIGIOLAKKWTKNJ-UHFFFAOYSA-N	231.273	1.152	10	20	BDCD	
O=C(Cc1ccoc1)NCc1ccccc1O	773397492	LJIILAZURDRIBY-UHFFFAOYSA-N	231.251	1.844	10	20	BDCD	
C[C@H]1C[C@H]1NC(=O)Cc1ccc(N)cc1	52268076	KNJSDBRWBOHMPQ-GZMMTYOYSA-N	204.273	1.336	10	20	BDCD	
CN[C@H](C)CCNCc1ccccc1O	1327414738	DPXIYZJAGGVZDG-SNVBAGLBSA-N	208.305	1.480	10	20	BDCD	
CO[C@@]1(C)C[C@H]1NCc1ccccc1O	694437886	KKDXYZIHBXFBHW-NEPJUHHUSA-N	207.273	1.659	10	20	BDCD	
O=C(NCc1cccc(O)c1O)C1CSC1	1347540745	ATQZODDRWXEILI-UHFFFAOYSA-N	239.296	1.077	10	20	BDCD	
Oc1c(CNC[C@@H]2CCN2)ccc2ccccc12	1580885483	ABRKXWJDEHOUEK-ZDUSSCGKSA-N	242.322	1.997	10	20	BDCD	
CCc1cccc(CNCc2cnnn2C)c1O	691435075	DLPFHNVDTWTUEN-UHFFFAOYSA-N	246.314	1.373	10	20	BDCD	
COc1cccc(CN[C@]2(C)CCOC2)c1O	120242702	ROOCMPHTNIZJDR-CYBMUJFWSA-N	237.299	1.669	10	20	BDCD	
Nc1ccc(CC(=O)Nc2cc[nH]n2)cc1	42413694	PWVUZSHLXZLQLU-UHFFFAOYSA-N	216.244	1.173	10	20	BDCD	
C[C@H](Cn1cccn1)NCc1cc(F)ccc1O	226584453	HIOGFBIBMFTSDS-SNVBAGLBSA-N	249.289	1.906	10	20	BDCD	
N[C@@H]1CCCC[C@@H]1C(=O)NCc1ccccc1O	228423690	PVHSUBILARDSJT-NWDGAFQWSA-N	248.326	1.526	10	20	BDCD	
CN(C)c1ccc(CNC(=O)[C@@H]2CCCN2)cc1	40429877	KGQCVPRKMQGKOJ-ZDUSSCGKSA-N	247.342	1.121	10	20	BDCD	
CO[C@@H](C)CNC(=O)Nc1ccc(N)cc1	224315864	QQFRYJNOUDUTRP-QMMMGPOBSA-N	223.276	1.425	10	20	BDCD	
C[C@@H]1C[C@H](CO)CN(Cc2ccccc2O)C1	817412728	ONBBIHFUUTWYID-NEPJUHHUSA-N	235.327	1.843	10	20	BDCD	
Oc1cccc2c1[C@@H](N[C@@H]1CCCNC1)CC2	817941953	USIHIAPPXGQHCV-NEPJUHHUSA-N	232.327	1.721	10	20	BDCD	
CCN(Cc1nnnn1C)c1ccc(OC)cc1	749905786	RPHMBNJVJVADIS-UHFFFAOYSA-N	247.302	1.245	10	20	BDCD	
C[C@@H](NCC[C@@H]1CCOC1=O)c1ccccc1O	879648486	RCVVZUFPHCBRKU-GHMZBOCLSA-N	249.310	1.996	10	20	BDCD	
COc1ccc(CNC[C@H]2COCO2)cc1C	894871699	VSVUWUZYDMYJFO-LBPRGKRZSA-N	237.299	1.466	10	20	BDCD	
COCC1CN(Cc2cc(OC)ccc2O)C1	895971098	KVOTYRZYEGZUNW-UHFFFAOYSA-N	237.299	1.479	10	20	BDCD	
[N-]=[N+]=NC1CN(C(=O)[C@H]2CC=CCC2)C1	409422970	KGPPGFCHFPITLD-QMMMGPOBSA-N	206.249	1.864	10	20	BDCD	
C[C@@H](O)[C@@H]1CCCCN1C(=O)CN=[N+]=[N-]	409424653	CNFSTFGEOAEKIY-SFYZADRCSA-N	212.253	1.059	10	20	BDCD	
CCO[C@@H]1C[C@H]1C(=O)NCc1ccc(N)cc1	689957561	QVANATAMSBNORS-VXGBXAGGSA-N	234.299	1.310	10	20	BDCD	
COc1ccc(CNC[C@H](C)O)cc1C	35052333	SXZXRHPWASCLLV-JTQLQIEISA-N	209.289	1.474	10	20	BDCD	
CN1CCC[C@@H]1C(=O)NCc1ccccc1O	299580192	SXNOQNAHWCFXDX-LLVKDONJSA-N	234.299	1.103	10	20	BDCD	
CC(=O)N1CCN(Cc2cccc(C)c2O)CC1	124505697	ZGTQCFDZWBYCQN-UHFFFAOYSA-N	248.326	1.365	10	20	BDCD	
Oc1ccccc1CNC[C@@H](O)C1CC1	70880282	RTNHHAZPHGGSJN-GFCCVEGCSA-N	207.273	1.253	10	20	BDCD	
CC(=O)N[C@H]1CCN(Cc2cc(C)ccc2O)C1	228356043	SMCRVUWEJIXKIS-ZDUSSCGKSA-N	248.326	1.411	10	20	BDCD	
CCOc1ccc(O)c(CNC[C@H](C)OC)c1	191146059	GESCZHJNVUUZIG-JTQLQIEISA-N	239.315	1.915	10	20	BDCD	
CC1(C)OC[C@H](CNCc2ccccc2O)O1	228842357	KBZMCRPLWVSBPF-NSHDSACASA-N	237.299	1.633	10	20	BDCD	
C[C@@H]1CCNC(=O)[C@H]1NCc1ccccc1O	193687307	BUNGSUKQRXSLDE-SKDRFNHKSA-N	234.299	1.006	10	20	BDCD	
CN(Cc1ccccc1O)C(=O)[C@](C)(O)C1CC1	287621372	ZDKUWICDWZNBRV-CQSZACIVSA-N	249.310	1.512	10	20	BDCD	
CNC(=O)CN(C)Cc1ccc(N(C)C)c(C)c1	293564917	SFXPAVFBHZWWCM-UHFFFAOYSA-N	249.358	1.239	10	20	BDCD	
Cc1cc(Cl)cc([C@H](C)NC2CNC2)c1O	817956311	WGZMAMLLKNRBPT-QMMMGPOBSA-N	240.734	1.976	10	20	BDCD	
Cc1ccc([C@@H](C)NC[C@@H](C)CN)c(O)c1	817962050	HFEPSGURSZGYAX-WDEREUQCSA-N	222.332	1.946	10	20	BDCD	
COCCc1nc(Cc2ccc(N)cc2)no1	843160359	XKUJBMKSSSEGPO-UHFFFAOYSA-N	233.271	1.432	10	20	BDCD	
CCOc1ccc(CN[C@@H](C)CNC)c(O)c1	853248656	IEIWEMUKPUPGHA-JTQLQIEISA-N	238.331	1.488	10	20	BDCD	
Cc1cc(C)c(O)c(CN(C)[C@H]2CCNC2=O)c1	758396018	BBEVLLRTULHRRP-LBPRGKRZSA-N	248.326	1.329	10	20	BDCD	
CCC(F)(F)C(=O)NCc1ccc(N)cc1	692354274	VXMVKUKZXPGEQT-UHFFFAOYSA-N	228.242	1.930	10	20	BDCD	
C[C@@H](NC(=O)Cc1ccc(N)cc1)c1ncon1	397919577	JUKYXRKXQMTGMZ-MRVPVSSYSA-N	246.270	1.072	10	20	BDCD	
COC[C@H](O)CN[C@@H](C)c1cc(F)ccc1O	94618277	SEPVVXWBBRPPTM-WCBMZHEXSA-N	243.278	1.189	10	20	BDCD	
OC/C=C/CNCc1cc(F)cc(F)c1O	708420544	JMFXVHOZFUSJQT-OWOJBTEDSA-N	229.226	1.309	10	20	BDCD	
C[C@@H](NC[C@H](N)C1CC1)c1cc(F)ccc1O	817965963	XSUNLGJHIFGGPC-PELKAZGASA-N	238.306	1.919	10	20	BDCD	
CC(C)[C@H](N)CNCc1ccc(N(C)C)cc1	841028882	JVHIRSOODRLMKL-CQSZACIVSA-N	235.375	1.826	10	20	BDCD	
CCNC(=N)NCc1ccc(N(C)C)cc1C	849009258	QCPSTVZLESYSKI-UHFFFAOYSA-N	234.347	1.695	10	20	BDCD	
Cc1cccc(O)c1CNCCCN(C)C	876886888	CVCRZQKOLWRYTC-UHFFFAOYSA-N	222.332	1.742	10	20	BDCD	
CCCN(CC(N)=O)Cc1c(C)cccc1O	877547894	NTNNVRQOUZNSBN-UHFFFAOYSA-N	236.315	1.398	10	20	BDCD	
OCCN(Cc1cc(F)cc(F)c1O)C1CC1	893944034	NHRQWXKTDJDBJR-UHFFFAOYSA-N	243.253	1.627	10	20	BDCD	
CCc1cccc(CN[C@@H](C)C(=O)O)c1O	691468369	VKCRWDOWRBKMHB-QMMMGPOBSA-N	223.272	1.517	10	20	BDCD	
C[C@H](N)C[C@@H](C)NCc1ccc(N)cc1	1336284930	DXKONDUVQGTBMB-VHSXEESVSA-N	207.321	1.484	10	20	BDCD	
C[C@H](N[C@H](C)CC(N)=O)c1ccccc1O	163988446	JRLIEGIHMNPHAY-BDAKNGLRSA-N	222.288	1.307	10	20	BDCD	
CCOCC(=O)NCc1cc(OC)ccc1O	155981566	ICUHDZFKYQVJDE-UHFFFAOYSA-N	239.271	1.054	10	20	BDCD