smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cc1cccc(NC(=O)/C(C#N)=C/c2cn(CC(=O)O)c3ccccc23)c1	2936075	YMHZBUIQXPEUEO-XNTDXEJSSA-N	359.385	3.580	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)COc2ccccc2C(C)(C)C)cc1	4711924	HDAJKBCWMFSJJP-HYARGMPZSA-N	353.466	3.579	50	40	FHGB	
CCCO[C@](C)(CC)C(=O)Nc1ccc(OCCBr)cc1	225729899	DSQLPYHFIKLILT-MRXNPFEDSA-N	358.276	3.994	50	40	FHGB	
CC(C)COc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccn2)cc1	5130201	HUIYOECSQGQMHV-NGZBARDMSA-N	357.479	3.747	50	40	FHGB	
C#CCOc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2)cc1OCC	6960555	SYXMGCCHKDNNCG-FYJGNVAPSA-N	356.809	3.515	50	40	FHGB	
CCCCCCCC(=O)N/N=C/c1cc([N+](=O)[O-])c(O)c2ncccc12	103745724	CYKJQMZTVHILIQ-UDWIEESQSA-N	358.398	3.659	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cccc(Br)c2)cc1Cl	657701	DSGSAYJSYCOUJF-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
O=C(COc1cccc([N+](=O)[O-])c1)NN=C1c2ccccc2-c2ccccc21	657637	NWPMLURMQDNRAL-UHFFFAOYSA-N	373.368	3.523	50	40	FHGB	
CC[C@H](C)c1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1	1319311	YWHNMSYJZHVUGD-PVGUKEHMSA-N	355.394	3.637	50	40	FHGB	
Cc1ccccc1CSCC(=O)N/N=C/c1ccc(N2CCCCC2)o1	408993663	DXWVDSNHFCIPRR-FYJGNVAPSA-N	371.506	3.962	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2ccc(O)c(Br)c2)cc1	1090988	SCITWEJAVSMZRC-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
C/C(=N\NC(N)=O)c1ccc2c3c(cc(Br)c2c1)CCCC3	4696705	GYWOWRKIDOUFPF-KEBDBYFISA-N	360.255	3.873	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1ccc(-c2ccc(C(=O)O)cc2)o1	4699642	PHOBQCRYFPKHLL-HYARGMPZSA-N	362.385	3.728	50	40	FHGB	
CN1CC2=C(OC(N)=C(C#N)[C@H]2c2ccsc2)/C(=C\c2ccsc2)C1	20814680	JCDPDYKQFWTJNV-JJKQHFEOSA-N	367.499	3.900	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)C[C@@H]2C[C@@H]3CC[C@@H]2C3)c(C)n1-c1ccccc1	103043151	LGPWCQUNYSZTDF-KURKYZTESA-N	365.477	3.681	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)/C(C#N)=C\c1ccccc1OCC(=O)O	211521997	KDFSLNZLSBVYTM-ZROIWOOFSA-N	370.792	3.658	50	40	FHGB	
CCCSC1=C(C#N)[C@@H](c2ccc(Br)cc2)CC(=O)N1	12250097	HHQBIQLRFFAEFE-GFCCVEGCSA-N	351.269	3.931	50	40	FHGB	
N#C/C(=C/c1cn(CC(=O)O)c2ccccc12)c1nc2ccc(F)cc2[nH]1	408569245	MMNMWBCAZSISBT-GHXNOFRVSA-N	360.348	3.805	50	40	FHGB	
O=C(N/N=C/c1cccc2c1OCCO2)c1ccc(Cl)cc1Cl	408856358	GEUSYXMLJHGLQH-DJKKODMXSA-N	351.189	3.529	50	40	FHGB	
N#CC(/N=C/c1cccs1)=C(/C#N)NCc1sc(Cl)nc1Cl	36532979	ITRLGIDQHGOELM-IUYQYPFYSA-N	368.274	3.979	50	40	FHGB	
C[C@H](I)C[C@@](F)(OC(F)(F)F)C(F)(F)F	16159357	MGSMUGDXPQAOBJ-IUYQGCFVSA-N	354.003	3.965	50	40	FHGB	
Cc1onc(-c2ccccc2Cl)c1C(=O)NNC(=O)c1cccc(F)c1	6184377	QGQXUJOCMIBDOI-UHFFFAOYSA-N	373.771	3.517	50	40	FHGB	
N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1c1ccnc2ccccc12	659940	NDSBVIWBVFEZTQ-SFHVURJKSA-N	367.364	3.559	50	40	FHGB	
CCn1c(SCC(=O)N/N=C/c2ccc(C)s2)nc2ccccc21	946807	JWMFDSXQRIZQEI-VCHYOVAHSA-N	358.492	3.669	50	40	FHGB	
O=C(CCn1c2c(c3ccccc31)CCCC2)NN=Cc1cccc(O)c1	12139965	ZYOLWHDNJSQQFR-UHFFFAOYSA-N	361.445	3.766	50	40	FHGB	
COc1cc(N2CCCCC2)ccc1/C=N/NC(=O)c1ccc(F)cc1	409221991	AOFMNEMQMMUGET-HYARGMPZSA-N	355.413	3.589	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)ccc1OC	3242695	HNGWYTBBQXDXFQ-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
O=C(Oc1ccc([N+](=O)[O-])c2cccnc12)c1cc([N+](=O)[O-])ccc1Cl	6189634	DWFRNPQMZBFWPA-UHFFFAOYSA-N	373.708	3.924	50	40	FHGB	
CCOc1ccc(Br)cc1/C=N/NC(=O)Cc1ccccc1	4702549	ACMMINFQHYRBHS-XDHOZWIPSA-N	361.239	3.541	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2ccc(C(=O)O)c(Cl)c2)o1)c1ccco1	409063329	KPPJLHGVGINRFF-OCKHKDLRSA-N	358.737	3.655	50	40	FHGB	
CC(C)Oc1cccc(NC(=O)/C(C#N)=C\c2ccc3c(c2)OCO3)c1	408787059	QFUMEXUZKNCTKL-NVNXTCNLSA-N	350.374	3.748	50	40	FHGB	
N#C/C(=C/c1ccc(OCC(=O)O)cc1)c1ccc(Br)cc1	408526371	BTUIBKOGCDTVEH-ZROIWOOFSA-N	358.191	3.977	50	40	FHGB	
CC(=O)Nc1cccc(C(=O)N/N=C/c2cn(C(C)C)c3ccccc23)c1	6245662	ALEVTLSFXKFHSC-WSDLNYQXSA-N	362.433	3.945	50	40	FHGB	
Cc1ccc(-c2nc(C(Cl)Cl)nc3nc(C(F)(F)F)nn23)cc1	101425448	DCPYTJBLZIHYDV-UHFFFAOYSA-N	362.142	3.990	50	40	FHGB	
O=C(N/N=C/c1cccc(Cl)c1)c1cc(Br)ccc1O	59447290	LZIGJTPIMMJXSO-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
CCN(C(=O)c1ccc(NC(=O)CBr)cc1)c1ccccc1	35605320	YQOMAGAKCNFVIM-UHFFFAOYSA-N	361.239	3.687	50	40	FHGB	
Cc1noc2ncc(C(=O)NN=C(c3ccccc3)c3ccccc3)cc12	58378527	PJMWXVWFDYALRN-UHFFFAOYSA-N	356.385	3.714	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc1OC	409051278	KBTDAGAAHUUBJZ-CIAFOILYSA-N	358.825	3.986	50	40	FHGB	
COc1cccc(/C=N/NC(=O)c2cccc(N3Cc4ccccc4C3)c2)c1	408730744	UXOVUEGGOOSTLN-ZVHZXABRSA-N	371.440	3.979	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NCc2ccco2)cc(Cl)c1OC(C)C	23215127	PDOSKKFMNCUTQV-VGOFMYFVSA-N	374.824	3.952	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc(OC)c(OC)c1	408813468	NHLWVPPSFLYNHK-MDWZMJQESA-N	372.808	3.911	50	40	FHGB	
N#C/C(=C/c1ccc([N+](=O)[O-])o1)C(=O)Nc1cccc(C(F)(F)F)c1	409243688	ZMXYENMDSQNHHR-TWGQIWQCSA-N	351.240	3.752	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@H]1c1ccc(F)cc1	627501	UIGMUIHHUGYMCM-QGZVFWFLSA-N	364.376	3.608	50	40	FHGB	
Cc1ccc(C(=O)N/N=C\c2c(C)nn(-c3ccccc3)c2O)cc1Cl	4474028	VBTJYTGSEVJYTC-NHDPSOOVSA-N	368.824	3.612	50	40	FHGB	
CCCCCCc1cc(C(=O)OC/C(C)=N/NC(N)=O)c2ccccc2n1	5700923	SVQRZKRYUAPAFC-OEAKJJBVSA-N	370.453	3.559	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c(C)n1-c1ccccn1	6545805	WWVYTLXWIVGXIS-ATVHPVEESA-N	358.401	3.740	50	40	FHGB	
CC[C@H](C)Oc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1	7078295	MABOVYBTJHSVSK-BBJIBYMTSA-N	372.494	3.513	50	40	FHGB	
N#CCOc1ccc(/C=N/NC(=O)CSCc2cccc(Cl)c2)cc1	15228418	OTZPLHBBGGKYMH-SRZZPIQSSA-N	373.865	3.626	50	40	FHGB	
N#C/C(=C\c1ccc(C#N)cc1)C(=O)Nc1sc2c(c1C#N)CCCC2	33796948	GUSORSRDMURNHH-OQLLNIDSSA-N	358.426	3.916	50	40	FHGB	
N#C/C(=C/Nc1ccc(F)cc1F)S(=O)(=O)c1ccc(Cl)cc1	102726091	GRFSUOIERQMCQR-LCYFTJDESA-N	354.765	3.869	50	40	FHGB	
CCO[C@@](C)(C(=O)Nc1ccc(OCCBr)cc1)C1CC1	225722996	DLGXWSRTFRMJBP-MRXNPFEDSA-N	356.260	3.604	50	40	FHGB	
C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(Br)o1	408999713	SDWBVJJBYWRGFZ-LBFZPMSMSA-N	367.268	3.814	50	40	FHGB	
CC[C@@H](Br)C(=O)NCCC(=O)Nc1ccc([C@H](C)CC)cc1	8733024	KXZNNHPWYAYLKK-IUODEOHRSA-N	369.303	3.818	50	40	FHGB	
CN(NC(=O)c1cccc(NC(=O)c2cccs2)c1)c1ccccc1	8358580	LXMWVKUYSHUEQT-UHFFFAOYSA-N	351.431	3.782	50	40	FHGB	
CC(C)OC(=O)c1ccc(NC(C#N)=C2C(=O)c3ccccc3C2=O)cc1	959636	YMOJCCHOFFUYPW-UHFFFAOYSA-N	360.369	3.521	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1)c1ccncc1	1059950	FENQCTRCPGFYTN-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)COc2ccc(C)c(C)c2)cc1OCC	13858056	XJPTWFAASNJIQJ-LPYMAVHISA-N	370.449	3.630	50	40	FHGB	
O=C(N/N=C/c1cc2ccc([N+](=O)[O-])cc2nc1Cl)c1ccccc1	408728271	JFVGWLBHQYWSMO-VXLYETTFSA-N	354.753	3.560	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1cn(CCOc2ccc(C)cc2)c2ccccc12	872773	FHBQVTHDWPHZNO-GHRIWEEISA-N	359.429	3.682	50	40	FHGB	
O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1cc(C2CC2)nc2ccccc12	4897878	MQEPXHQVTAUMPJ-CIAFOILYSA-N	360.373	3.784	50	40	FHGB	
C#CCn1c(C)c(/C=N/NC(=O)Cc2ccc(OCC)cc2)c2ccccc21	10315690	GFQZCZOKRWZAFG-LFVJCYFKSA-N	373.456	3.674	50	40	FHGB	
Cc1ccccc1COc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1	646884	KJOVAFYEHXVKPY-FQEVSTJZSA-N	372.428	3.824	50	40	FHGB	
CCOC(=O)c1c(N/C=C2/C(=O)OC(=O)c3ccccc32)sc(C)c1C	101871501	PIPFOOFOCOEGHJ-NTEUORMPSA-N	371.414	3.692	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)Cc2cc(C)ccc2C)cc1[N+](=O)[O-]	409362209	IGEWUILIYIAWJV-RCCKNPSSSA-N	369.421	3.693	50	40	FHGB	
COc1cc(/C=N\NC(=O)c2cc3cc(Cl)ccc3o2)cc(OC)c1O	409022198	ISNSPIOULKPMAC-UKWGHVSLSA-N	374.780	3.573	50	40	FHGB	
O=C(N/N=C(\c1ccc(O)cc1)c1ccc(Cl)cc1)c1ccccn1	257173319	JSJBKCFYRMXJFI-PYCFMQQDSA-N	351.793	3.623	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)c1ccco1	1421495	HKCBSLVVBXZXFK-GIJQJNRQSA-N	359.725	3.865	50	40	FHGB	
CS[C@@H](C)/C(=N\NC(=O)c1ccccc1)C1=C(O)c2ccccc2C1=O	26779708	QXIICHQFOXNAEM-VHJQFCBJSA-N	366.442	3.690	50	40	FHGB	
C=CCn1cc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)c2ccccc21	6186293	CLUIBKNIWLSDMU-LPYMAVHISA-N	360.417	3.550	50	40	FHGB	
Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)Cc2ccccc2)o1	2318725	DZWVJHIANBLEEN-FYJGNVAPSA-N	363.373	3.856	50	40	FHGB	
N#C[C@]1(c2ccccc2)O[C@H](C(=O)c2ccccc2)C[C@H]1Br	4783369	RABTWZKKSGXMPG-LZLYRXPVSA-N	356.219	3.841	50	40	FHGB	
C=CCn1cc(/C=N/NC(=O)c2ccc(OC)cc2OC)c2ccccc21	6714823	PPTBTJBPKQQCHQ-LPYMAVHISA-N	363.417	3.608	50	40	FHGB	
Cn1cc(C(=O)N/N=C/c2ccccc2Br)c2ccccc21	1305091	HEBYFEPVDRTAIG-VXLYETTFSA-N	356.223	3.705	50	40	FHGB	
CCOc1ccccc1/C=C(\C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	408924740	OBBARUWNMVOQFD-GXDHUFHOSA-N	367.361	3.548	50	40	FHGB	
Cc1nn(-c2ccccc2)c(N2CCCC2)c1/C=N/NC(=O)c1ccccc1	6673295	XSUMGXUWISPHLV-XQNSMLJCSA-N	373.460	3.545	50	40	FHGB	
N#C/C(=C/c1ccc(OCc2ccc3ccccc3c2)cc1)C(=O)NC(N)=O	409241893	PDXPYKPUGZFOTR-ODLFYWEKSA-N	371.396	3.521	50	40	FHGB	
N#C/C(=C\c1ccc(OC(=O)c2ccc(Cl)cc2Cl)cc1)C(N)=O	5861537	YOMJRPQLBKEDHN-YRNVUSSQSA-N	361.184	3.605	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)cc1	1215694	CTZAPQALALUVJF-DNTJNYDQSA-N	352.221	3.570	50	40	FHGB	
C[C@@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc2c(c1)OCO2	1081884	WIDNNMMHIRLDAP-LVCXCXRVSA-N	361.401	3.519	50	40	FHGB	
C[C@@H]1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc(OC(F)(F)F)cc1	3135163	CFJHPNILZRCIJV-PSLIRLAXSA-N	364.323	3.646	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccccc1)c1cccc(NC(=O)c2ccco2)c1	5892455	DCPGIABBJDFDCV-HZHRSRAPSA-N	361.401	3.615	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)cc1	20197672	QBDKYCQRYIHYBU-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
COc1ccc([C@@H]2CC(=O)N3CN(C4CCCC4)CSC3=C2C#N)cc1	20347986	PVUMOIWHLMZPSZ-KRWDZBQOSA-N	369.490	3.653	50	40	FHGB	
CN1CC2=C(OC(N)=C(C#N)[C@H]2c2cccs2)/C(=C/c2cccs2)C1	20528773	HICPRZRMTPGVDW-FWVUHSSSSA-N	367.499	3.900	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)CCCOc2ccc(C(C)(C)C)cc2)n1	29066111	OGQUKWDUBYSGAO-UHFFFAOYSA-N	356.470	3.693	50	40	FHGB	
N#C/C(=C/c1cccn1-c1cccc(C(=O)O)c1)C(=O)NC1CCCCC1	35202029	FIMBOBONWZNRMO-SSZFMOIBSA-N	363.417	3.531	50	40	FHGB	
Cc1ccc(OCCC(=O)NNC(=O)c2cc(Cl)ccc2Cl)cc1	36666151	UZQKRNBLOXZCGA-UHFFFAOYSA-N	367.232	3.532	50	40	FHGB	
Cc1cc(Br)cc(C)c1NC(=S)NC(=O)CCCCl	6275780	MKLDRSOEYLHQFO-UHFFFAOYSA-N	363.708	3.898	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/c1cccc(OC(=O)c2ccccc2)c1	4544145	SMAKCUGMVUJLOH-HZHRSRAPSA-N	374.396	3.678	50	40	FHGB	
CCOc1ccc2nc(Sc3ccc(/C=C(\C#N)C(N)=O)o3)sc2c1	408990323	KOHKNKFFSJPVJJ-JXMROGBWSA-N	371.443	3.831	50	40	FHGB	
CCn1c(C)c(/C=N/NC(=O)CNc2ccc(F)cc2)c2ccccc21	409356533	HITWUTUEWKTJML-FSJBWODESA-N	352.413	3.671	50	40	FHGB	
C[C@@H]1C[C@H]2[C@@H]3CC/C(=C(/O)C=O)[C@@]3(C)C[C@@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12	1570003325	XYGYYRSXRDASPZ-LLUYXWKQSA-N	356.462	3.522	50	40	FHGB	
O=C(NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])Nc1cccc2ccccc12	5876429	HPNLKFXFIGWVID-UHFFFAOYSA-N	367.321	3.805	50	40	FHGB	
CCc1cccc(OCC(=O)N/N=C\c2c(OC)ccc3ccccc23)c1	16162243	COMFDULREWSWQD-UCQKPKSFSA-N	362.429	3.940	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccco1	8043702	RUFJCDCPARPIEO-GIJQJNRQSA-N	359.725	3.865	50	40	FHGB	
Cc1cccc(COc2cccc([C@@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)c2)c1	5818498	PLQTWOWHIRTLSV-HXUWFJFHSA-N	372.428	3.824	50	40	FHGB	
COc1ccc(-c2csc(N(C[C@@H]3CCCO3)C(=O)CCl)n2)cc1	929120	IMGYNBGPCLQSQF-AWEZNQCLSA-N	366.870	3.570	50	40	FHGB	
Cc1cccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)c1C	6867908	UEZUKMQJSZUQJB-LPYMAVHISA-N	351.450	3.690	50	40	FHGB	
C/C(=N/NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl)c1ccccn1	694905	KYGKCUYZMPIVIZ-ASKIBSTCSA-N	352.221	3.696	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@@H]2C[C@H]3C=C[C@@H]2C3)cc(OCC)c1OCC	226272274	ZNEHIIAWOIPSAR-ZWBFVZQZSA-N	372.465	3.811	50	40	FHGB	
CCCn1nc(C2CC2)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	253394115	AGMOAZTWHACRDG-GOSISDBHSA-N	366.465	3.621	50	40	FHGB	
C[C@@H]([C@@H](O)c1ccccc1)N(C)P(=O)(c1ccccc1)c1ccccc1	68569530	ICBOYFKPRKHWSC-PGRDOPGGSA-N	365.413	3.969	50	40	FHGB	biogenic
Cc1ccc(-c2nn(-c3ccccc3)cc2/C=N/NC(=O)c2ccncc2)o1	3185945	HLGXKPPXYGDJCF-YDZHTSKRSA-N	371.400	3.600	50	40	FHGB	
O=C(c1ccc(Br)s1)C(Br)Br	2565092	CEOBOSHEFGQTFX-UHFFFAOYSA-N	362.868	3.809	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)CCn2cnc3ccccc32)cc1	1831132	JYLOKDWITLLGPA-HZHRSRAPSA-N	364.449	3.756	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc3ncccc23)c(O)c1	3357949	UIHDEHKDUZKBSS-RVDMUPIBSA-N	359.385	3.885	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C\c1ccc(O)c(Br)c1)c1ccccc1	4544449	SXYVRMOFZHJYDQ-ZENNRRHLSA-N	371.234	3.939	50	40	FHGB	
C/C(=N/NC(=O)CNc1cccc(Cl)c1C)c1ccc([N+](=O)[O-])cc1	12372475	QUGBJYNVMARQHY-NDENLUEZSA-N	360.801	3.509	50	40	FHGB	
COc1ccccc1/C(C)=N/NC(=O)COc1ccc(C(C)(C)C)cc1	23702205	XFXANDQJOZRJRO-PXLXIMEGSA-N	354.450	3.912	50	40	FHGB	
O=C(N/N=C/c1ccc(N2CCCC2)o1)c1ccc(Cl)c(Cl)c1	59138204	GVWVZCIFCBRVKR-VXLYETTFSA-N	352.221	3.951	50	40	FHGB	
COc1cc(OC)c(/C=N\NC(=O)Cc2ccc(C)cc2C)cc1Cl	216047846	QOPLCTOMCQQRCF-NHDPSOOVSA-N	360.841	3.667	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cc(C)cc(C)c2)ccc1OCC#N	408986627	RQRBYVQVRCQFCF-GZTJUZNOSA-N	361.401	3.760	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cccc(C)c1C)OCO2	409106550	MOSNPGZTYYQURJ-LZYBPNLTSA-N	364.401	3.977	50	40	FHGB	
O=C(N/N=C/c1ccc2c(c1)OCO2)c1ccc(OCc2ccccc2)cc1	2321677	FVHVBQBOKCXPEX-YDZHTSKRSA-N	374.396	3.758	50	40	FHGB	
COC(=O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccc(F)cc3)o2)c1	8812136	NEWYUPVDXITEAK-WSDLNYQXSA-N	366.348	3.636	50	40	FHGB	
COc1cc(/C=N/NC(N)=O)cc(Cl)c1OCc1ccc(Cl)cc1	408886326	GESLOOWZCBGDCR-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
CCCOc1ccc(/C=N\NC(=O)c2ccc(OC)c(OCC)c2)cc1	409311978	IVYNTJAZMIXBCB-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)c(C)c2)ccc1OCC#N	7156753	XOCVLRDCPNUQMA-GZTJUZNOSA-N	361.401	3.760	50	40	FHGB	
C/C(=N/NC(=O)CNc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1	5454844	NHFXJCKCETXDIP-HMAPJEAMSA-N	362.389	3.700	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2ccc3c(c2)nc(C)n3CC)cc1	6319805	NGWVWNAAICHCGZ-FYJGNVAPSA-N	350.422	3.527	50	40	FHGB	
CCOc1ccccc1NC(=O)/C(C#N)=C/c1ccc(OC)cc1OC	6951505	ZTYOUHJLHPMWGL-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccccc1Cl)OCO2	409071392	OBNBSMRWGBMENN-WUXMJOGZSA-N	356.765	3.623	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)CCCC(=O)N/N=C/c1ccccc1	409247999	FPJYLYPBTQPKBZ-FYJGNVAPSA-N	357.841	3.908	50	40	FHGB	
O=C(CCc1ccc(N(CCCl)CCCl)cc1)NC1CCCC1	1727166	AYOJRSRXXQPCID-UHFFFAOYSA-N	357.325	3.962	50	40	FHGB	
C[C@H](Sc1nc2ccccc2s1)C(=O)N/N=C/c1ccccc1O	5527765	FKFIYDPABLHZPY-HPAYWCODSA-N	357.460	3.633	50	40	FHGB	
Cc1ccccc1NC(=O)/C(C#N)=C\c1cc(Br)c(O)cc1O	408742345	ABMAYZMLLZHHMZ-SDQBBNPISA-N	373.206	3.714	50	40	FHGB	
Cc1n[nH]c2c1[C@@H](c1ccc(-c3ccc(Cl)cc3)o1)C(C#N)=C(N)O2	8973354	POCUTTXWTZHJQP-MRXNPFEDSA-N	352.781	3.850	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CCSc2ccc(C)cc2)ccc1O	409128013	DHAVPFSYGYERRG-DEDYPNTBSA-N	358.463	3.732	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)CNc2ccc(F)cc2)c2ccccc21	409347815	QZBWNZDHMSFOLX-ZMOGYAJESA-N	364.424	3.837	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)N/N=C\c1ccc(Cl)cc1)c(C)n2C	33351189	ICHVQFCBGVXEKY-NHDPSOOVSA-N	355.825	3.913	50	40	FHGB	
O=C(CSCc1ccc(Cl)cc1)N/N=C/c1cccc([N+](=O)[O-])c1	1021354	MJDBONPRRVHBTN-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
COc1cc(OC)cc(C(=O)NNc2nc3ccc(Cl)cc3s2)c1	4121415	BPNPGVXWQOULFU-UHFFFAOYSA-N	363.826	3.724	50	40	FHGB	
N#CC1=C(N)N2C(=C(C#N)[C@@H]1c1c(F)cccc1Cl)Nc1ccccc12	2345162	KWXHGCBLWLVPSH-MRXNPFEDSA-N	363.783	3.937	50	40	FHGB	
Cc1ccc([C@H]2C(C#N)=C(N)S[C@@H](c3ccccc3)[C@H]2[N+](=O)[O-])cc1	4625397	KBMHVFMSHPQZFZ-BZSNNMDCSA-N	351.431	3.906	50	40	FHGB	
COc1ccc(/C=C/C(=N/NC(=O)c2ccccc2)[C@@H](C)CN(C)C)cc1	5759808	ZWXRBVGZBVIQPO-SMNYSZNBSA-N	365.477	3.692	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(C)c([N+](=O)[O-])c2)cc1	207855319	VGYQTBBZDDQVQQ-GDNBJRDFSA-N	351.362	3.848	50	40	FHGB	
Cc1ccsc1/C=N/NC(=O)c1ccccc1NC(=O)c1ccco1	408995163	AHVZQTADSPSTDS-YBFXNURJSA-N	353.403	3.666	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)c(Cl)c1)C(=O)Nc1cccc(Cl)c1	4838950	LBHMRXWXUDNKFU-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
C/C(=N\NC(=O)CSCc1cc(C)cc(C)c1)c1cccc([N+](=O)[O-])c1	59473686	UJDSCNRCEIWJKG-HMMYKYKNSA-N	371.462	3.985	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cccc3ncccc23)cc1OC	3312134	GWAVYXUBCZGPJR-RVDMUPIBSA-N	359.385	3.798	50	40	FHGB	
C[C@H]1CCc2sc(C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2C1	3322388	ZTBXZAXWFABUPO-NSHDSACASA-N	362.882	3.530	50	40	FHGB	
CCCC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1	14248995	GHALPMVFBKFMJS-UHFFFAOYSA-N	360.841	3.789	50	40	FHGB	
O=P(C(=S)N[C@@H]1C[C@@H]2C=C[C@H]1C2)(c1ccccc1)c1ccccc1	95677083	FGUUHJBPQVYOOT-JTDSTZFVSA-N	353.427	3.840	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1ccc(OCC(C)C)c2ccccc12	5006543	JLJWYQFVRASKKS-SFQUDFHCSA-N	352.434	3.544	50	40	FHGB	
CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2c[nH]c3ccccc23)cc1	3251287	DUIPOCJWZSEIEE-RVDMUPIBSA-N	359.385	3.890	50	40	FHGB	
CCc1sc(C(=O)NNC(=O)COc2ccc3ccccc3c2)cc1C	7652472	JXUWWSYKPLQGKH-UHFFFAOYSA-N	368.458	3.612	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2OCC)cc1	216068092	MMHYUAZUXOAWJT-DEDYPNTBSA-N	371.393	3.546	50	40	FHGB	
CCOc1ccc(Br)cc1/C=N\NC(=O)c1ccc(F)cc1	30822075	KFZOSEABLYERFM-GRSHGNNSSA-N	365.202	3.751	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl)c1cccnc1	5671387	MYDGKQPJBLSHRL-KKBVUKDESA-N	352.221	3.696	50	40	FHGB	
CCc1cccc(OCC(=O)N/N=C/c2c(OC)ccc3ccccc23)c1	959697	COMFDULREWSWQD-OEAKJJBVSA-N	362.429	3.940	50	40	FHGB	
CC(C)N(Cc1ccc(CN(C(=O)CCl)C(C)C)cc1)C(=O)CCl	1602821	LARPVVIIIJLGEH-UHFFFAOYSA-N	373.324	3.638	50	40	FHGB	
COc1ccc(OCC(=O)NNc2c3ccccc3nc3ccccc23)cc1	4936042	CUSKSQFMQKVELA-UHFFFAOYSA-N	373.412	3.919	50	40	FHGB	
COc1cccc(C(=O)N/N=C(\C)c2ccc(N3CCCCC3)cc2)c1	4619420	YPILKTFCKCFCAP-CJLVFECKSA-N	351.450	3.840	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccc2c(c1)OCO2)c1ccc(C(C)(C)C)cc1	409160687	HXVFZWOJROOLNL-OEAKJJBVSA-N	367.449	3.665	50	40	FHGB	
CC(C)=NNC(=O)c1ccc([C@H]2SCC(=O)N2Cc2ccccc2)cc1	20247279	XOHXPTHAKQCXJK-HXUWFJFHSA-N	367.474	3.586	50	40	FHGB	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)c2ccccn2)cc1	49573539	GAHOXHYLXTWBCR-LGMDPLHJSA-N	355.401	3.932	50	40	FHGB	
COc1ccc2nc(C)cc(SCC(=O)N/N=C/c3ccccc3)c2c1	871114	GYHBLDCEJSGLJL-CIAFOILYSA-N	365.458	3.794	50	40	FHGB	
O=C(Cc1cccc2ccccc12)N/N=C/c1cc2c(cc1Cl)OCO2	1437675	KBMIHJZSNBYSFV-SSDVNMTOSA-N	366.804	3.915	50	40	FHGB	
COC(=O)[C@H](c1ccccc1)[C@](CBr)(OC)c1ccccc1	1593546	MRFSAIICLWMCNZ-FUHWJXTLSA-N	363.251	3.880	50	40	FHGB	
Cc1c(C(=O)CBr)c(C)c([N+](=O)[O-])c(C(C)(C)C)c1[N+](=O)[O-]	2504789	XAYNSGVLKKSRCP-UHFFFAOYSA-N	373.203	3.995	50	40	FHGB	
CC(C)c1ccc(C(=O)NNC(=O)c2ccc(Br)s2)cc1	8421276	RQFZLKCXFLPDDE-UHFFFAOYSA-N	367.268	3.709	50	40	FHGB	
COc1cccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(C)cc4)c32)c1	985594	ZSJSYFYNMARLBB-QGZVFWFLSA-N	358.401	3.612	50	40	FHGB	
Cc1oc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1Br	4502833	YHCLPBCDTVQVOB-DJKKODMXSA-N	373.206	3.973	50	40	FHGB	
O=C(O)CC/C(=N\NC(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1	17075015	VQCYADIAGHFBBO-HMMYKYKNSA-N	365.216	3.992	50	40	FHGB	
Cc1cc(C)cc(-n2c(C)cc(/C=N/NC(=O)CN3CCCCC3)c2C)c1	28216579	CIKJLGWFKMPHLQ-OEAKJJBVSA-N	366.509	3.647	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1[nH]c2ccccc2c1Cl	40143728	CEQDQKAVNLLEBT-UHFFFAOYSA-N	371.868	3.799	50	40	FHGB	
N#C/C(=C\Nc1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccccc1	44842279	DKSJQMJJXIWELY-RVDMUPIBSA-N	352.337	3.956	50	40	FHGB	
Cc1ccc(COc2c(Cl)cc(C(=O)NN)cc2Br)cc1	226340352	IDGLVNWKAVQHRT-UHFFFAOYSA-N	369.646	3.593	50	40	FHGB	
C/C(=N\NC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(C(C)(C)C)cc1	409147864	ZRKXZBYKUAPNQH-UDWIEESQSA-N	355.394	3.752	50	40	FHGB	
COc1ccc2ccc(=O)oc2c1C(C(=O)OC(=O)CC(C)C)=C(C)C	2332243320	DOIWKSPZBBRLJL-UHFFFAOYSA-N	358.390	3.711	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1	58871509	PQMKZSAKZJQEBZ-KGENOOAVSA-N	363.373	3.938	50	40	FHGB	
CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1	704418	BIQFYCQVMDCQNU-LJQANCHMSA-N	365.477	3.984	50	40	FHGB	
C/C(=N\NC(=O)c1cc2c(s1)CCCC2)c1ccc(-n2ccnc2)cc1	17074964	FMBKMFDSNLBALR-HYARGMPZSA-N	364.474	3.967	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)c(O)c1	20248654	ANVZIKNDISFNQI-ZXOFLVKFSA-N	356.447	3.588	50	40	FHGB	
COC(=O)COc1ccc(/C=C(\C#N)Sc2nc3ccccc3[nH]2)cc1	408599585	WVLHQHZCGMHUPB-XNTDXEJSSA-N	365.414	3.771	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)CNC2CCCCC2)c2ccccc21	409376959	CSUGWAWACBQUMJ-OEAKJJBVSA-N	352.482	3.508	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	5927702	BKTMCXLZRYWESN-DEDYPNTBSA-N	354.410	3.513	50	40	FHGB	
CC(C)c1ccc(OCC(=O)N/N=C/C=C/c2cccc([N+](=O)[O-])c2)cc1	13897161	PTQXEHWRMQPPCU-DIULEBGUSA-N	367.405	3.912	50	40	FHGB	
C/C(=N/NC(=O)[C@H](C)Nc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1	4647018	XJTPOFJXVZHWFQ-OEKFUPINSA-N	360.801	3.589	50	40	FHGB	
Cc1cccn2c(=O)c(C=C(C#N)C#N)c(Oc3ccc(Cl)cc3)nc12	5576460	XMBVNXGZZUZTJB-UHFFFAOYSA-N	362.776	3.879	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nc2cccc(C)c2)ccc1OCC#N	408745056	JJEAZBNAXOWYAG-ATVHPVEESA-N	361.401	3.842	50	40	FHGB	
N#C/C(=C\c1c(Oc2nc(Cl)ncc2F)ccc2ccccc12)C(N)=O	409063587	AAVSORCUCFWSRX-YRNVUSSQSA-N	368.755	3.607	50	40	FHGB	
C=C1CC(C(=O)N/N=C/c2ccc(OCc3ccccc3)c(OC)c2)C1	408730930	WIJFMNMKNPBVAY-LPYMAVHISA-N	350.418	3.691	50	40	FHGB	
CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COc1ccccc1-n1ccnc1)C2	104165021	VSFSCLXJWQKZTP-ATQWUDTISA-N	366.465	3.570	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)c1	5720295	GUACONFLFMUION-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
COc1cccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)c1OC	947076	ALXSHYSGJLBONN-LPYMAVHISA-N	370.449	3.530	50	40	FHGB	
O=C(N/N=C/c1cccnc1)c1cn(-c2ccccc2)nc1-c1ccccc1	6286818	PBBDZCAWUYQGOY-BUVRLJJBSA-N	367.412	3.698	50	40	FHGB	
C=C(C)[C@H]1CC=C(C)/C(=N\NC(=O)COc2ccc(C(=O)OCC)cc2)C1	33566370	NMGDDAGGWJRPFF-UBZKEQBWSA-N	370.449	3.647	50	40	FHGB	
CC(C)(C)c1ccc(OCC(=O)N/N=C/c2cc(Cl)ccc2O)cc1	23411041	DQLREDCHYRFPIY-SRZZPIQSSA-N	360.841	3.872	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)c(C)n1Cc1ccccc1	1101289	NBFAYLBLCBDIET-DHRITJCHSA-N	374.419	3.928	50	40	FHGB	
CN(C)c1ccc2c(c1)N1Cc3ccccc3C1=N[P@@]2(=O)c1ccccc1	3198953	YMNAAPWDEUIUCN-HHHXNRCGSA-N	373.396	3.762	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C(\c1ccccc1)c1ccccn1	16134346	KMXJYWKKIUKUTO-HIXSDJFHSA-N	365.820	3.683	50	40	FHGB	
CCOc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)cc([N+](=O)[O-])c1O	36066867	FOPPVNPXOVWATP-KPKJPENVSA-N	350.334	3.640	50	40	FHGB	
O=C(CCc1ccc2c(c1)OCO2)NNc1ccc(Cl)c(Cl)c1	40017290	PDCUXOOEGZENGT-UHFFFAOYSA-N	353.205	3.798	50	40	FHGB	
Cc1ccc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)cc1Br	409378945	SRNYVYFDLTYMEX-NVNXTCNLSA-N	358.239	3.853	50	40	FHGB	
C=CCN1C(=O)/C(=C(\C#N)C(=O)Nc2cc(C)ccc2C)c2ccccc21	409389724	ROJWXUHPRSSQJH-LVZFUZTISA-N	357.413	3.752	50	40	FHGB	
CNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccc(OC)c(C)c1	2671510	BIJIXCQTUFFPBF-ATVHPVEESA-N	372.428	3.509	50	40	FHGB	
Cc1oc(C)c2c(=O)ccc3c(c12)OC(N)=C(C#N)[C@@H]3c1ccccc1F	807682	GSRBRZNWQJFKME-LJQANCHMSA-N	362.360	3.767	50	40	FHGB	
N#C/C(=C/c1ccccc1Br)C(=O)Nc1cccc(C(=O)O)c1	408541233	FJNZDUKDHMRJJZ-JYRVWZFOSA-N	371.190	3.693	50	40	FHGB	
O=C(N/N=C\c1cc(O)ccc1Br)c1ccc(Cl)cc1	30822116	SXRWMIHQBGPUCB-IUXPMGMMSA-N	353.603	3.572	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=N/NC(=O)c3cccc(F)c3)c2c1	409016432	CNFLBUGCNBLOOY-WSDLNYQXSA-N	352.365	3.760	50	40	FHGB	
O=C(COc1ccc(Br)cc1)N/N=C/c1ccc(Cl)s1	11161859	DJLOVJPEPJORLY-FRKPEAEDSA-N	373.659	3.693	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)Cc2cccc3ccccc23)cc1OC	1751290	LUPFBBXIKYGNMG-HZHRSRAPSA-N	362.429	3.940	50	40	FHGB	
CC(C)(C)c1ccc([C@@H]2C[C@H]2C(=O)N/N=C\c2ccc3c(c2)OCO3)cc1	30738476	LGKQQCGYSWJFTD-HEJOERNKSA-N	364.445	3.967	50	40	FHGB	
N#CC1=C(N)Oc2oc3cc(Cl)ccc3c(=O)c2[C@@H]1c1ccccc1	1070242	ZIVLQBGWHQHVTC-OAHLLOKOSA-N	350.761	3.665	50	40	FHGB	biogenic,in-vitro
O=C(Cc1ccccc1)N/N=C1\c2ccccc2-c2nc3ccccc3nc21	1230279	IWAGDAQZDMDWBC-HPNDGRJYSA-N	364.408	3.722	50	40	FHGB	
C/C(=N/NC(=O)c1cc(-c2ccc(Cl)cc2)n[nH]1)c1ccccc1O	101410632	PJFFYFMGZXQRPB-JAIQZWGSSA-N	354.797	3.590	50	40	FHGB	
Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c1C	3430410	LIJQHSZILWQQSS-QDDTUJKSSA-N	363.461	3.605	50	40	FHGB	
COC(=O)N/N=C/c1c(C)n(Cc2ccccc2[N+](=O)[O-])c2ccccc12	4091859	WIGUXHDDHXDBNQ-RGVLZGJSSA-N	366.377	3.596	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc(Cl)cc(Cl)c2O)cc1	4703534	QXUCWFWLUBYBKE-DJKKODMXSA-N	353.205	3.862	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc3ccc([N+](=O)[O-])cc3nc2Cl)cc1	408729265	YUGONQJYRIDDAG-KEBDBYFISA-N	368.780	3.869	50	40	FHGB	
Cc1cc2c(cc1C)CN(CC(=O)N/N=C/c1c(O)ccc3ccccc13)C2	409205586	QVVDNUDQIMLLBG-BHGWPJFGSA-N	373.456	3.628	50	40	FHGB	
COc1ccc(Cl)cc1/C=N/NC(=O)c1ccc(N2CCCC2)cc1	7385578	DWBNSYZSXYOOFG-FYJGNVAPSA-N	357.841	3.713	50	40	FHGB	
CC(C)(C)c1ccc([C@H]2C[C@H]2C(=O)N/N=C\c2ccc(C(=O)O)cc2)cc1	30802743	XYIDJLMIMJSDJT-ZBAGDBNDSA-N	364.445	3.936	50	40	FHGB	
CC/C(=N\NC(=O)c1cc(Br)ccc1OC)c1ccco1	8812976	BOSDPVXEPCNHSK-SFQUDFHCSA-N	351.200	3.595	50	40	FHGB	
CCc1ccc(OCC(=O)N/N=C/c2ccccc2Br)cc1	2756963	BONPBYSYNGNPSL-YBFXNURJSA-N	361.239	3.541	50	40	FHGB	
N#CC(Nc1ccccc1Br)=C1C(=O)c2ccccc2C1=O	954536	IFBUHYHARJTGJS-UHFFFAOYSA-N	353.175	3.718	50	40	FHGB	
CC[C@@H](C)c1ccc(OCC(=O)N/N=C\c2cc(OC)ccc2OC)cc1	4813977	VKNVUSPYOBADSR-VUZLNAKASA-N	370.449	3.746	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)c2cc3cccc(C)c3nc2C)c1	685586	WMANHDWTVICHLF-WSDLNYQXSA-N	363.417	3.633	50	40	FHGB	
CCOc1cc(OC)ccc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	1073607	REGHSYMZMFIYKK-GOSISDBHSA-N	368.433	3.545	50	40	FHGB	
O=C(N/N=C\c1c[nH]c2ccccc12)C(O)(c1ccccc1)c1ccccc1	54281459	XSJDNXSXFZDZMT-XYGWBWBKSA-N	369.424	3.554	50	40	FHGB	
COc1ccc(N/C(C)=C(\C#N)C(=O)CNc2cccc(OC)c2)cc1	102749661	CJJIPCKNTJDAPP-XMHGGMMESA-N	351.406	3.594	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-]	408963045	LWAWGWXOQKEJGX-AWQFTUOYSA-N	351.284	3.686	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)Cc2cc(C)ccc2C)cc(Cl)c1O	409365660	RHNOGSRRMFXKIR-NHDPSOOVSA-N	360.841	3.754	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)Nc2ccccc2OC)cc(OCC)c1O	408807635	DBGRQDZULJVYAD-BKUYFWCQSA-N	369.421	3.684	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cccc(F)c2)o1)c1cccc([N+](=O)[O-])c1	409020288	NNDANFSUMANHJE-RGVLZGJSSA-N	353.309	3.758	50	40	FHGB	
Cc1noc2nc(-c3ccco3)cc(C(=O)N/N=C/c3ccc(F)s3)c12	252491033	LIWLWRLDDZDITM-UFWORHAWSA-N	370.365	3.756	50	40	FHGB	
COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccccc2)sc2c1CCCC2	942680	NORSTCVAJHLVDJ-SDNWHVSQSA-N	366.442	3.959	50	40	FHGB	
CCN(C(=O)C(O)(c1ccccc1)c1ccccc1)N(C)c1ccccc1	1235550	FJSCEWMNYASHCA-UHFFFAOYSA-N	360.457	3.822	50	40	FHGB	
CCOP(=O)(CC(=O)N/N=C/c1c(Cl)cccc1Cl)OCC	2211161	HPWUFWPAISYEOM-LZYBPNLTSA-N	367.169	3.710	50	40	FHGB	
CCOC(=O)c1sc(NC(=O)CCCCl)nc1-c1ccccc1	28047853	OGTPQSSXYPWSDK-UHFFFAOYSA-N	352.843	3.944	50	40	FHGB	
CC(C)(C)c1ccc(OCCCOc2cccc(/C=N/NC(N)=O)c2)cc1	6615635	OLBUDPQFWNVHAG-HZHRSRAPSA-N	369.465	3.834	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)cc(Cl)c1OC	111689763	ZVYQFOYYPALHTG-NVNXTCNLSA-N	356.809	3.581	50	40	FHGB	
COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)c1nc2ccc(F)cc2[nH]1	408567463	NNEZOKUTXZDXLO-WZUFQYTHSA-N	368.324	3.692	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C/c2cc(Cl)ccc2OCC(=O)O)c1	409052845	AXPLCEMFYZUCRW-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)c2ccccc2O)c(OCCC)c1	3279059	DSNVYFKCCDVNRY-KGENOOAVSA-N	356.422	3.734	50	40	FHGB	
Cc1ccc(C(C)C)c(OCCOc2ccccc2/C=C(\C#N)C(N)=O)c1	4508543	AZMMUAXKTABILJ-QGOAFFKASA-N	364.445	3.969	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)ccc1OC(C)=O	59116966	DCWPQBYIRKJCJX-ZROIWOOFSA-N	370.792	3.820	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)cc2)o1)[C@H](O)c1ccccc1	1299320	YKOSGJAHVYYIMQ-AGKWGAAGSA-N	354.793	3.784	50	40	FHGB	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1ccc(F)cc1	8218838	PJIFUDHYQYSKTH-ZDUSSCGKSA-N	367.380	3.599	50	40	FHGB	
C=CCOc1ccc(/C=N\NC(=O)c2ccc(OCC=C)c(OC)c2)cc1	409317144	PEWRYGVMVDEEQE-JCMHNJIXSA-N	366.417	3.589	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)ccc1OC(C)C	33743845	OAVFSLILCBHEIL-XNTDXEJSSA-N	352.390	3.734	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2Cl)cc1	863652	UILHXRFBPHJZLB-CIAFOILYSA-N	368.824	3.607	50	40	FHGB	
CCOC(=O)/C(C#N)=C1/Nc2ccc(Cl)cc2[C@H](c2ccccc2)N1	6463274	BERXTRQWLVGNPF-LXMVLSBBSA-N	353.809	3.743	50	40	FHGB	
COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1ccccc1Cl	4953273	XBIUDANXJZJAPP-UHFFFAOYSA-N	367.792	3.797	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)NC2CC2)ccc1OCc1ccccc1	7164101	OHZHYQQKYMQHCF-LDADJPATSA-N	362.429	3.850	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)c(O)c1	20248651	ANVZIKNDISFNQI-GNUZOCDUSA-N	356.447	3.588	50	40	FHGB	
CCCN1CCC(=NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1	20986272	QPGRQNUKRNQUHC-UHFFFAOYSA-N	352.482	3.686	50	40	FHGB	
O=C(N/N=C\c1ccccc1Cl)C(O)(c1ccccc1)c1ccccc1	33301364	IQXHJQNJEJGIIO-HAHDFKILSA-N	364.832	3.726	50	40	FHGB	
O=C(NN=C1CCCCC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	59444753	WOSXXTQVNHKHMH-UHFFFAOYSA-N	365.433	3.640	50	40	FHGB	
N#C/C(=C/c1c(O)ccc2ccccc12)C(=O)Nc1cccc([N+](=O)[O-])c1	408727299	ZOBNMIUPJBSKNW-UVTDQMKNSA-N	359.341	3.999	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1	408768301	VVDCNTWMUMCOCU-BOPFTXTBSA-N	365.389	3.605	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1	408785072	FTYGKZRFZWBRBG-DEDYPNTBSA-N	354.410	3.513	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2c(C)cccc2C)cc1C(=O)O	408785547	HEZBBZHIGJDYIZ-DHDCSXOGSA-N	350.374	3.556	50	40	FHGB	
C[C@]12CCCC[C@H]1[C@H]2C(=O)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1	408869868	ULOGQHROLVIHKQ-IYRPKICHSA-N	366.417	3.921	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)CCSc2ccc(C)cc2)c1	409119908	UWRCRUYXNUUAOD-PXLXIMEGSA-N	369.490	3.976	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C\c2cccc(OC)c2)cc1OCC	409323799	QSALXQOPLBZUIK-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)c2ccc3c(c2)OCO3)c2ccccc21	409358173	KPDDKOGVFQNKSK-WSDLNYQXSA-N	361.401	3.628	50	40	FHGB	
CCOC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@H]2c1cccc(F)c1	1428057	ALBGBMKHAWPSJI-CQSZACIVSA-N	358.394	3.591	50	40	FHGB	
COc1ccccc1C(=O)N/N=C(\CC(=O)c1cccs1)C(F)(F)F	100289143	QONLABMPXXRWRL-XSFVSMFZSA-N	370.352	3.678	50	40	FHGB	
C/C(CCc1ccccc1)=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1	20248456	BBHWDVAPAVQKQZ-HMMYKYKNSA-N	371.462	3.953	50	40	FHGB	
C=CCOc1c(Cl)cc(/C=C(\C#N)C(=O)N2CCCC2)cc1OCC	409368471	XGXWBPSIBPZTRX-XNTDXEJSSA-N	360.841	3.833	50	40	FHGB	
Cc1cccc(-n2c(C)cc(/C=N/NC(=O)CNc3ccccc3)c2C)c1	7782061	WKQVFFNPIVEGAI-ZVHZXABRSA-N	360.461	3.965	50	40	FHGB	
Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)C)cc2)cc1Cl	3072827	FIYHUTAXUGQJNV-SRZZPIQSSA-N	357.841	3.861	50	40	FHGB	
C=CCc1cccc(/C=N/NC(=O)c2cccc(Br)c2)c1O	830889	GFJUWYRCCNNDLV-YBFXNURJSA-N	359.223	3.647	50	40	FHGB	
C=CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)cc1OC	5917283	MMTVJQXKNNZIIZ-VBKFSLOCSA-N	364.401	3.814	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N\NC(=O)c1ccc(Cl)cc1	15018573	NKQBBZALAVFDTN-NDENLUEZSA-N	374.828	3.858	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc(Cl)c([N+](=O)[O-])c1	705801	UYMOXCHMLNMVAS-OAHLLOKOSA-N	373.796	3.699	50	40	FHGB	
Cc1ccccc1COc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1	646883	KJOVAFYEHXVKPY-HXUWFJFHSA-N	372.428	3.824	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(OC)cc3C)cc2c1	409186424	BWOMVOYBPSCZKZ-MTJSOVHGSA-N	352.390	3.912	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(CC)cc2)cc1OC	408795063	KWVNTCUUAIMALR-QGOAFFKASA-N	360.413	3.815	50	40	FHGB	
CCCCN1C(=O)C(C#N)=C(C)/C(=N/c2ccc(N(CC)CC)cc2)C1=O	16638805	CCWBQQSPFRMJQQ-NMWGTECJSA-N	366.465	3.614	50	40	FHGB	
COc1cc(OC)cc(C(=O)N/N=C/c2cc(C(C)C)c(OC)cc2C)c1	6825484	NXQQBVXAKOWRLL-WSDLNYQXSA-N	370.449	3.908	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)c2c[nH]c3ccccc23)cc1OC	2758561	HSGKVPNBNRZSEX-WSDLNYQXSA-N	351.406	3.729	50	40	FHGB	
CCCn1ccnc1SCC(=O)/C(C#N)=C1/Nc2ccccc2S1	104488749	NRXZAYJXDJZXDE-VBKFSLOCSA-N	356.476	3.907	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2ccc(Cl)cc2Cl)sc(N)c1C#N	1191959	IDMVZRAIIAIXCU-KPSZGOFPSA-N	353.234	3.581	50	40	FHGB	
O=C(NN(c1ccccc1)c1ccccc1)[C@@H]1CCCN(c2cnccn2)C1	45262729	GIJZLBJXHXIWCS-GOSISDBHSA-N	373.460	3.563	50	40	FHGB	
Cc1ccccc1/C=N\NC(=O)[C@@H]1COc2ccc(C(C)(C)C)cc2O1	4523679	SYUOTTUFRSULQS-ZIHVZMLCSA-N	352.434	3.583	50	40	FHGB	
O=c1c2ccccc2n2c(CCl)nnc2n1-c1ccc(Cl)c(F)c1	408712873	YHHMSKRLMZUPJM-UHFFFAOYSA-N	363.179	3.565	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccc(C(C)(C)C)cc1)c1cccc([N+](=O)[O-])c1	408568610	VNLQQEYQDFDWBU-KGENOOAVSA-N	353.422	3.975	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	408784611	VVYPKMFKJOYXMI-YBFXNURJSA-N	361.785	3.801	50	40	FHGB	
Cc1nc2ccccc2n1CCC(=O)N/N=C/c1c(O)ccc2ccccc12	1104324	SOPYTFSYTUAGFR-OEAKJJBVSA-N	372.428	3.744	50	40	FHGB	
C/C(=N\NC(=O)COc1ccccc1-c1ccccc1)c1ccccc1O	6261766	HJWXJGKVANJTGB-XQNSMLJCSA-N	360.413	3.978	50	40	FHGB	
COc1ccc(C(=O)N/N=C\c2c(Cl)cccc2Cl)cc1OC	5514174	RBDUJTLZSQLBNW-OCKHKDLRSA-N	353.205	3.775	50	40	FHGB	
CC(C)(C)c1n[nH]c2c1[C@@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2	5051888	MEMSJZLIRKDKMV-LBPRGKRZSA-N	362.355	3.944	50	40	FHGB	
O=C(N/N=C/c1cc([N+](=O)[O-])ccc1Cl)c1ccccc1-n1cccc1	7889797	BOVSXNGMHJMNPP-UDWIEESQSA-N	368.780	3.803	50	40	FHGB	
Cc1ccc2nc(C)cc(SCC(=O)N/N=C\c3ccccc3O)c2c1	57481174	XCYRIALZJHAVMP-NHDPSOOVSA-N	365.458	3.800	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N/NC(=O)COc3ccccc3)c2C)cc1	58926868	VGDVGVLSOFPTFG-OEAKJJBVSA-N	361.445	3.932	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)cc([N+](=O)[O-])c1O	408847274	SSSAMFIFHIEMBP-RIYZIHGNSA-N	367.361	3.553	50	40	FHGB	
N#C/C(=C/c1c[nH]nc1-c1ccc(F)cc1)C(=O)NC1CCCCCC1	5728916	AGKAIGZUUFLTFK-PTNGSMBKSA-N	352.413	3.962	50	40	FHGB	
C/C(=N\NC(=O)c1cc2c(s1)CCCC2)c1ccc2c(c1)OCCO2	5937741	PVXJWCCDCPFJFG-UDWIEESQSA-N	356.447	3.552	50	40	FHGB	
N#C/C(=C\c1ccc(Sc2ccccn2)o1)C(=O)NCc1ccco1	408991084	MQNXMCQZNJMRTO-JLHYYAGUSA-N	351.387	3.642	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C\c2cc(OC)c(OC)cc2C)c1	35387100	SXQMBAUMXCPVRC-YBEGLDIGSA-N	366.417	3.957	50	40	FHGB	
C[C@H](Oc1ccc2ccccc2c1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	1085484	DLAHYGFQJHVIJY-HADWXUJASA-N	363.373	3.666	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)NCc1cccs1)CCCC2	781411	RTGICWIYVXIUKL-LICLKQGHSA-N	352.459	3.859	50	40	FHGB	
O=C(N/N=C/c1ccccc1OCc1ccccc1)c1ccc2c(c1)OCO2	3576545	AFDJEDDRPWAANQ-YDZHTSKRSA-N	374.396	3.758	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)cc1	1434136	ZKRDKIXUOKEURI-HZHRSRAPSA-N	373.412	3.711	50	40	FHGB	
C/C(=N/NC(=O)c1cccnc1)c1cccc(NC(=O)C2CCCCC2)c1	5620744	JNNPZRHNPJVGMZ-IWIPYMOSSA-N	364.449	3.754	50	40	FHGB	
O=C(NNC(=O)c1ccccc1F)c1ccc(-c2ccc(Cl)cc2)o1	12985287	NAUVNDMOAMNBKV-UHFFFAOYSA-N	358.756	3.814	50	40	FHGB	
C[C@@H](Sc1ccccn1)C(=O)N/N=C/c1c(O)ccc2ccccc12	1099836	DZWDGOXPFSIQSY-LNOXHEFASA-N	351.431	3.571	50	40	FHGB	
CCCOc1cccc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)c1	6942772	JMIBGTUSQLEUAH-FYJGNVAPSA-N	352.390	3.994	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	58915695	MIEKGCQBNJDOGD-XDHOZWIPSA-N	361.398	3.508	50	40	FHGB	
Cc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc(F)c2)cc1	994548	FSIDBHVQYGMTHD-LJQANCHMSA-N	360.392	3.846	50	40	FHGB	
CN(NC(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccccc1	8358559	TYOUHLCYEUOJTR-UHFFFAOYSA-N	351.431	3.782	50	40	FHGB	
O=C(N/N=C/c1cc(Br)cc(Cl)c1O)c1ccccc1	4784696	RVANILSOVZZXJM-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
CC[C@@H](C)c1ccc(OCC(=O)N/N=C\c2ccc(OC)cc2OC)cc1	4815580	OYVWTRCIOHCTBR-VUZLNAKASA-N	370.449	3.746	50	40	FHGB	
C/C(=N\NC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1	5282541	MCFQERHAHHLFFX-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1cccc2ccccc12	2165721	YNFSFLRGXXVQNG-WSDLNYQXSA-N	365.820	3.890	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)c(C)n1-c1cccnc1	4688052	HSJZSEGLHHXSEC-SSDVNMTOSA-N	352.825	3.906	50	40	FHGB	
O=C(N/N=C/c1cc(Cl)ccc1O)c1ccccc1Br	4740786	JPRKZUOLLPBRCW-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
N#C/C(=C/c1cccs1)S(=O)(=O)c1ccc(Br)cc1	96889911	XCVRHTZYVIXXCR-JYRVWZFOSA-N	354.250	3.849	50	40	FHGB	
CCS(=O)(=O)[C@H](Br)C(=O)c1ccc(-c2ccccc2)cc1	96517869	SADVSQOOQONZET-INIZCTEOSA-N	367.264	3.692	50	40	FHGB	
C/C(=N\NC(=O)c1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1	12362512	JXTAUBBHRUZSLZ-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
N#C/C(C(=O)Nc1ccccc1Cl)=C1/SCC(=O)N1c1ccccc1	2344424	WPNJGNLTCZGTSZ-AQTBWJFISA-N	369.833	3.794	50	40	FHGB	
N#CC1=C(Nc2ccccc2Cl)S[C@H](c2ccccc2O)NC1=O	1590864	QWPLHAQEFMZNBK-MRXNPFEDSA-N	357.822	3.754	50	40	FHGB	
C=CCc1ccccc1OCC(=O)N/N=C/c1ccc([N+](=O)[O-])c(Cl)c1	2752938	RQVRVTLEFJKKIU-RGVLZGJSSA-N	373.796	3.506	50	40	FHGB	
O=C(C/C(=N\NC(=O)c1ccccc1F)C(F)(F)F)c1cccs1	100409577	GGZDXPIKRIQBGS-DEDYPNTBSA-N	358.316	3.808	50	40	FHGB	
O=C(CCSc1ccc(Cl)cc1)N/N=C/c1ccc([N+](=O)[O-])cc1	20248100	BIQXGIIKTHXTQR-WOJGMQOQSA-N	363.826	3.881	50	40	FHGB	
COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1	4646517	CJWUQRQWXKFRGT-HXUWFJFHSA-N	372.428	3.716	50	40	FHGB	
N#C/C(=C\c1cnn(Cc2ccccc2)c1)c1nc(N)c2ccccc2n1	36834918	QFULURRKNWSUOB-LICLKQGHSA-N	352.401	3.521	50	40	FHGB	
Cc1[nH]c2ccccc2c1/C=N\NC(=O)COc1cccc2cccnc12	96483875	CIICWINFOUPYCL-FMCGGJTJSA-N	358.401	3.554	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccc(Cl)cc1	59334229	BABOVPFHMZAWBU-YBEGLDIGSA-N	370.836	3.923	50	40	FHGB	
CCCC(O)(CCC)C(=O)NN(C(=O)/C=C/c1ccco1)c1ccccc1	2271994	SPHJISVZKQUQRU-OUKQBFOZSA-N	370.449	3.689	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CC#N)ccc1OCc1cccc(Cl)c1	408719733	KZQZBFCFPKEJAI-WSDLNYQXSA-N	371.824	3.681	50	40	FHGB	
C/C(CC(=O)Nc1ccc(C)c(Cl)c1)=N\NC(=O)Cc1cccs1	4599786	UUIKTQRMMBKHFF-UDWIEESQSA-N	363.870	3.773	50	40	FHGB	
COc1cc(/C=N/NC(=O)Cc2ccccc2)ccc1OCc1ccccc1	4702546	HBNCNKOLWWRVIE-LFVJCYFKSA-N	374.440	3.967	50	40	FHGB	
C=CCc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)cc(OCC)c1O	408993050	BQHGRRJZFIKEET-UNOMPAQXSA-N	362.429	3.743	50	40	FHGB	
O=C(N/N=c1/sc2ccccc2n1C(=O)c1ccccc1)c1ccccc1	1105397	AEMKROOECYIMMW-XTQSDGFTSA-N	373.437	3.637	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N\NC(=O)c1cccc(Cl)c1	15018570	NZXYESASOCLBQD-NDENLUEZSA-N	374.828	3.858	50	40	FHGB	
NNC(=O)c1cn(C(=O)c2cccc3c(Cl)cccc23)c2ccccc12	226366107	YHBVLIAPYLVBAF-UHFFFAOYSA-N	363.804	3.740	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@@H]2C[C@H]3C[C@@H](CBr)[C@H]2C3)cc1	256575744	SSOHWXRVPHYKLJ-DDHJSBNISA-N	359.285	3.510	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)c(C)n1C[C@H]1CCCO1	7608864	LRSHQDLJKRBHEI-FVIRYLMMSA-N	363.461	3.507	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C\c2cc(Cl)cc(OC)c2O)c1	408743497	AQRRRBRMSVXTTF-QPEQYQDCSA-N	372.808	3.999	50	40	FHGB	
Cc1ccc(C)n1-c1ccc(C(=O)N/N=C/c2ccccc2C(=O)O)cc1	13337863	ANQYSMOUVHWLDZ-LPYMAVHISA-N	361.401	3.556	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cc3ccccc3o2)c(C)n1-c1cccnc1	4106938	AOBWVZGSECJWKZ-FSJBWODESA-N	358.401	3.999	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)COc1ccc(C(C)(C)C)cc1	5466879	WSAFCGGOJKFAML-HYARGMPZSA-N	354.450	3.912	50	40	FHGB	
COc1cc(/C=N/NC(=O)[C@@H](C)Nc2ccc3ccccc3c2)ccc1O	1095709	UKDNSXLVUNCBGL-CYGNYLSHSA-N	363.417	3.505	50	40	FHGB	
O=C(Cc1ccccc1)Nc1ccc(C(=O)N/N=C/c2ccccc2)cc1	6222905	SPOPGYWVMYIAAL-XQNSMLJCSA-N	357.413	3.632	50	40	FHGB	
C=CCOc1ccc(Cl)cc1/C=N\NC(=O)c1ccc(OC)c(OC)c1	6441698	LBHOGHPKEJBDQQ-MTJSOVHGSA-N	374.824	3.686	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CSCc2cc(C)cc(C)c2)c(OC)c1	1022932	OYPPGFYNBJFFKG-SRZZPIQSSA-N	372.490	3.704	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=C(\C#N)C(=O)n1nc(C)cc1C	408809519	GZALODGYGPFDFQ-QGOAFFKASA-N	355.397	3.913	50	40	FHGB	
COc1cccc(-c2n[nH]c3c2[C@@H](c2ccc(C)cc2)C(C#N)=C(N)O3)c1	5248718	XEEHLNHJAXEKKS-KRWDZBQOSA-N	358.401	3.612	50	40	FHGB	
CCCOC(=O)c1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2)c1	1766590	KBYWHUBHLYURAL-SFQUDFHCSA-N	364.401	3.808	50	40	FHGB	
COc1cc(C(=O)N/N=C(\C)c2ccc(Cl)cc2)cc(OC)c1OC	4964633	JRCXNRLTMSRMJV-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
C/C(=N/NC(=O)[C@H]1C[C@@H]1c1ccccc1)c1cccc(NC(=O)C2CC2)c1	17074416	KDHORHKPXUVVTA-JMVLLECOSA-N	361.445	3.679	50	40	FHGB	
C/C(=N\NC(=O)c1cc2c(s1)CC[C@H](C)C2)c1ccc([N+](=O)[O-])cc1	6052010	NMQNOVKMKQEHDR-QMDUKARKSA-N	357.435	3.935	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(C)c2C)cc1	409142555	LVJMURBTCLWMPI-HYARGMPZSA-N	367.449	3.571	50	40	FHGB	
CCOC(=O)[C@H]1CCC/C1=N\NC(=O)CCSc1ccc(Cl)cc1	408719410	DORWPBAQSPIUFY-PTJLRZKYSA-N	368.886	3.658	50	40	FHGB	
COc1cc(C=C(C#N)C#N)ccc1OCc1nc2ccccc2nc1C	16265406	MCTFBBZZZFGMAO-UHFFFAOYSA-N	356.385	3.956	50	40	FHGB	
Cc1c(C(=O)NNC(=O)c2ccccc2)oc2ccc(Br)cc12	2620997	ULYOHRJSXURTAF-UHFFFAOYSA-N	373.206	3.579	50	40	FHGB	
N#CC(C(=O)COC(=O)CCC1CCCCC1)=C1Nc2ccccc2N1	3252474	NQFJQOZASVWSDJ-UHFFFAOYSA-N	353.422	3.732	50	40	FHGB	
NC(=O)N/N=C/c1cc(Br)c(Sc2ccc(Cl)cc2)o1	4508997	GGSQRTPEHQCSSN-OMCISZLKSA-N	374.647	3.849	50	40	FHGB	
CC(=O)N/N=C/c1ccc(OCc2ccc(F)cc2)c(Br)c1	409015052	ABINEMBDLNLZFF-DJKKODMXSA-N	365.202	3.637	50	40	FHGB	
CCn1c(C)c(/C=N/NC(=O)c2ccc(OC)cc2OC)c2ccccc21	33757074	JJTFWLIYWLEWQO-LPYMAVHISA-N	365.433	3.751	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CCC[C@@H]2C)[C@@H]1c1ccccc1	221956497	BECKUTVKDLBRRL-DVXDUOKCSA-N	361.445	3.710	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1)N/N=C/c1ccc(Br)cc1	14003016	OJSVQZYAEWHRHW-VCHYOVAHSA-N	351.631	3.795	50	40	FHGB	
C/C(CC(=O)Nc1cc(C)cc(C)c1)=N\NC(=O)c1cc(Cl)ccc1O	5361812	RVYNQONUIFASSH-LPYMAVHISA-N	373.840	3.797	50	40	FHGB	
C[C@H](Oc1ccc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)cc1)C(=O)O	59248087	KCOXLNYEHPNSTK-GVIGZQTCSA-N	370.792	3.738	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)c(OC)c1	1410904	DJZRRRRHNQEPGY-FOWTUZBSSA-N	365.433	3.793	50	40	FHGB	
O=C(N/N=C/c1cccc([N+](=O)[O-])c1)C1c2ccccc2-c2ccccc21	1433663	BZAVAHGXFGYZFJ-LPYMAVHISA-N	357.369	3.857	50	40	FHGB	
CCC1=C(C(=O)OC)[C@H](c2ccc(Cl)c(Cl)c2)C(C#N)=C(N)O1	8382603	HQDUAFBJLGQLSF-CYBMUJFWSA-N	353.205	3.638	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)Nc2nnc(C(C)C)s2)cc1OC	13597272	BPTNAGACLKQKQR-JYRVWZFOSA-N	372.450	3.614	50	40	FHGB	
Cc1ccc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c(Cl)c1	408712652	FHWNTRQOGKEARA-UHFFFAOYSA-N	359.216	3.734	50	40	FHGB	
O=C(Cc1ccc(F)cc1)N/N=C\c1c[nH]c2ccc(Br)cc12	409228364	XVUKJXVXGZAGQJ-FBHDLOMBSA-N	374.213	3.762	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2cccs2)c(C)n1-c1cccc([N+](=O)[O-])c1	408779812	LCEZPIXQVDKZLR-ODLFYWEKSA-N	368.418	3.828	50	40	FHGB	
Cc1ccc(SCC(=O)N/N=C/c2cc(Br)c(C)o2)cc1	408872863	KIOUHWVELFGCPS-CAOOACKPSA-N	367.268	3.901	50	40	FHGB	
O=C(N/N=C\c1ccc(O)cc1)c1ccc2c(c1)CN(c1ccccc1)C2	83331209	GGTFDBQOWQCKAP-QRVIBDJDSA-N	357.413	3.676	50	40	FHGB	
CC[C@@H](C)n1nc(C)c(Cl)c1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2	253401022	MGXQOFHRCFNDRF-YMTOWFKASA-N	360.845	3.631	50	40	FHGB	
CCc1ccc(/C=N/NC(=O)CNc2cccc(Br)c2)cc1	695381	YWLKVJZTXMDTQT-RGVLZGJSSA-N	360.255	3.574	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2cc(Cl)c(O)c(OC)c2)cc1	207855744	ZKXDNQAZMYUAST-JYRVWZFOSA-N	372.808	3.999	50	40	FHGB	
CC(=O)N(N=O)c1c(Cl)cc(Br)cc1Br	4975080	KPVXQQPJQGJRBN-UHFFFAOYSA-N	356.401	3.899	50	40	FHGB	
N#C/C(=C\c1cc(Br)ccc1OCC(=O)O)c1ccccc1	409043962	GBPWAPMPRVLEBR-RIYZIHGNSA-N	358.191	3.977	50	40	FHGB	
O=C(CNC1CCCCC1)N/N=C/c1ccc(OCc2ccccc2)cc1	409388875	WYQNXUGFJBUQDC-BUVRLJJBSA-N	365.477	3.638	50	40	FHGB	
O=C(CCSc1ccccc1Cl)NNC(=O)c1ccccc1Cl	28771740	PXBYUYPXMIPJDH-UHFFFAOYSA-N	369.273	3.937	50	40	FHGB	
O=C(NNC(=O)c1ccc2ccccc2c1)c1ccc(Br)cc1	2022298	DCXRENHIZJEHJZ-UHFFFAOYSA-N	369.218	3.677	50	40	FHGB	
O=C(CCCSc1nc2ccccc2s1)NNC(=O)c1ccccc1	3360771	LXJXNBQLHOVAPL-UHFFFAOYSA-N	371.487	3.630	50	40	FHGB	
C=CCOc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC	6900995	NSNTTZOJRZGMTM-YFCLQTKISA-N	354.450	3.862	50	40	FHGB	
C=CCOc1ccc(Cl)cc1/C=N/NC(=O)c1cc(OC)cc(OC)c1	8811098	GSGYDKWYBJTIAU-CIAFOILYSA-N	374.824	3.686	50	40	FHGB	
COc1ccc2c(Cl)c(C(=O)NNC(=O)C3CCCCC3)sc2c1	674918	XVNFZRUDIVUZHB-UHFFFAOYSA-N	366.870	3.905	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2OC)c(O)c1	811286	FDEZVFVGMMDVNX-LPYMAVHISA-N	364.401	3.717	50	40	FHGB	
N#C/C(=C/c1ccccc1I)C(=O)Nc1ccccc1	69008398	OPXPUNBWGGVXQA-RAXLEYEMSA-N	374.181	3.837	50	40	FHGB	
CCOC(=O)c1c(C)noc1CP(=O)(c1ccccc1)c1ccccc1	3308430	KQZAQDOLNRMKAT-UHFFFAOYSA-N	369.357	3.674	50	40	FHGB	
CCc1ccc(NC(=O)/C(C#N)=C/c2cn(CC(=O)O)c3ccccc23)cc1	4711207	LYJMOHHMYYMADW-LFIBNONCSA-N	373.412	3.834	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2ccccc2)cc1Br	408742750	SNMYXOKZBDSAOY-XDHOZWIPSA-N	359.223	3.778	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1	5721169	AALRAPPYEBNFGR-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
COc1ccc([C@@H]2CC(=O)NC(SCc3ccccc3)=C2C#N)cc1	2502296	IITYCOFFWBOQOQ-KRWDZBQOSA-N	350.443	3.967	50	40	FHGB	
COc1cc(/C=C(/C#N)c2cccc([N+](=O)[O-])c2)c([N+](=O)[O-])cc1OC	107889781	UHSXVPGAKDFZAN-MLPAPPSSSA-N	355.306	3.584	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)sc2ncnc(N)c12	408973425	MUCPVSXKBZNPAA-NUGSKGIGSA-N	367.478	3.643	50	40	FHGB	
Cc1ccc(C(=O)OCC(=O)Nc2c(C)cc(SC#N)cc2C)cc1O	9315290	LZCNMGMOXOIUSY-UHFFFAOYSA-N	370.430	3.686	50	40	FHGB	
Cc1c(Cl)cccc1NS(=O)(=O)c1ccc(NC(=O)CCl)cc1	408907828	SWGSKRRJFNRCBP-UHFFFAOYSA-N	373.261	3.627	50	40	FHGB	
Cc1n[nH]c2c1[C@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2	18136750	ZKTHCAUSYMRRLA-LJQANCHMSA-N	358.401	3.515	50	40	FHGB	
O=C(N/N=C/c1ccccc1)c1cccc(NC(=O)c2ccccc2F)c1	1429122	LBTSSLPOHNZTIL-OEAKJJBVSA-N	361.376	3.842	50	40	FHGB	
N#Cc1ccccc1COc1ccc(/C=N/NC(=O)c2cccs2)cc1	59197652	KWRZGXKIVFVIGW-LPYMAVHISA-N	361.426	3.963	50	40	FHGB	
O=C(CCn1c2c(c3ccccc31)CCCC2)N/N=C\c1ccccc1O	28466845	FTSNSDIWTRIMLI-HAHDFKILSA-N	361.445	3.766	50	40	FHGB	
O=C1Nc2ccccc2/C1=N/NC(=O)c1ccccc1Nc1ccccc1	27232313	YQQTXRHYUYFPGA-UHFFFAOYSA-N	356.385	3.516	50	40	FHGB	
C/C(=N\NC(=O)c1cc2c(s1)CCCCC2)c1ccc2c(c1)CC(=O)N2	98042598	YELNRVTZLKPALD-WSDLNYQXSA-N	367.474	3.666	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cccc(Cl)c2)cc1Br	6182161	FATNKSWTRCPVSX-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
CNC(=O)/C(C#N)=C\c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1	6426969	KEJAQWLBOKVVNI-ZROIWOOFSA-N	353.403	3.707	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1ccc(Cl)cc1)c1ccco1	1424942	VKTPYAPWWRBYED-CIAFOILYSA-N	367.792	3.949	50	40	FHGB	
O=C(NNc1cccc(Cl)c1)c1cnn(Cc2ccccc2Cl)c1	30614525	ZRVHMSRFHSEYIP-UHFFFAOYSA-N	361.232	3.995	50	40	FHGB	
COc1ccc(/C=C(\C#N)c2nc3sc4c(c3c(=O)[nH]2)CCCC4)cc1	5070438	VGFODAMZWJNZQJ-JLHYYAGUSA-N	363.442	3.936	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1	14003044	YPTXMDQIQDZZFX-GIJQJNRQSA-N	352.177	3.594	50	40	FHGB	
FC(F)(F)c1nnc2sc(-c3cccc(CBr)c3)nn12	73634543	QZEBDWSUDUPDOT-UHFFFAOYSA-N	363.162	3.767	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)cc1OC	15219794	BRDOZTVJGLZCGL-PTNGSMBKSA-N	352.390	3.648	50	40	FHGB	
CCOC(=O)N/N=C\c1cccc(OC)c1OC/C=C/c1ccccc1	15934394	ULEYHDTWKHZRPS-HDGFSFRLSA-N	354.406	3.867	50	40	FHGB	
Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1	989058	IVFOSTAVTWMVPY-IBGZPJMESA-N	360.392	3.846	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c(C)n1C1CCCC1	3184951	MPXPEUXYAYAVJV-UDWIEESQSA-N	354.410	3.892	50	40	FHGB	
O=C(CNc1cccc2ccccc12)N/N=C/C=C/c1ccc([N+](=O)[O-])cc1	3202244	QTDATBBELHIGLJ-XJLXESQPSA-N	374.400	3.975	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)Cc2ccc(C)cc2C)cc1[N+](=O)[O-]	20195462	IXGWCPWJUHWVGK-FYJGNVAPSA-N	369.421	3.693	50	40	FHGB	
O=C(N/N=C/C=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1Br	4827376	NSSALKKIMQUSLB-DKABEWEPSA-N	374.194	3.786	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(NC(=O)[C@]2(C)CC2(Cl)Cl)cc1	98002315	YOTHTVWHFJHBEZ-LJEUOOAZSA-N	367.232	3.679	50	40	FHGB	
COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccc(C)c([N+](=O)[O-])c1	408804891	BZTCFHBRJNQRPN-OQLLNIDSSA-N	351.362	3.766	50	40	FHGB	
CCOc1cc(/C=C(/C#N)c2nc3ccccc3o2)ccc1OCC(=O)O	409049404	WPJZEMREPHTFQH-ZROIWOOFSA-N	364.357	3.754	50	40	FHGB	
Cc1ccc2sc(NNC(=O)c3coc4ccccc4c3=O)nc2c1C	4121434	ZYWNZROYEFICCQ-UHFFFAOYSA-N	365.414	3.776	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)CSCCc2ccccc2)cc1	408725412	FYBLXXOPRZQTOQ-LTGZKZEYSA-N	356.491	3.901	50	40	FHGB	
Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2ccccc2F)c1Cl	18276747	GUJCPLNIILDZQS-PTXOJBNSSA-N	361.591	3.527	50	40	FHGB	
O=C(N/N=C\c1cccn1-c1ccc(O)cc1)c1cccc(-n2cccc2)c1	409024104	VKFIZVPPMPSSHT-KQWNVCNZSA-N	370.412	3.738	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1ccc2ccccc2c1O	409342389	BUOWVNIGWXMEBN-CIAFOILYSA-N	350.443	3.929	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OC(C)C)cc2)cc1	193342570	USKNSSIYCBUVTM-PDGQHHTCSA-N	350.418	3.706	50	40	FHGB	
CCO[Si](CCO[C@@H](CC)O[C@@H]1CCCS1)(OCC)OCC	299888442	JUOVIGBDJWCFHQ-CABCVRRESA-N	352.569	3.657	50	40	FHGB	
N#CC1=C(NC(=O)c2cc3ccccc3oc2=O)S[C@H]2CCCC[C@H]12	100026347	WDMRXEGZHCJKGY-WBMJQRKESA-N	352.415	3.564	50	40	FHGB	
O=C(N/N=C/c1cccs1)C(=O)Nc1ccc(Oc2ccccc2)cc1	58884738	JVDKGYZOICWEHK-DEDYPNTBSA-N	365.414	3.629	50	40	FHGB	
COc1cccc(-c2nc(C(=O)NN(C)c3ccccc3)cs2)c1OC	44009620	AQVZPVVVYJPRFI-UHFFFAOYSA-N	369.446	3.609	50	40	FHGB	
CCOCCCNC(=O)/C(C#N)=C/c1cccc(OCc2ccccc2)c1	3261439	UENWRTLHQTVZAK-XSFVSMFZSA-N	364.445	3.715	50	40	FHGB	
CC1=C(C#N)C(=O)NC(=O)/C1=C\c1ccc(-c2cccc(C(F)(F)F)c2)o1	12629923	PLXZFVJUICPAQE-ZSOIEALJSA-N	372.302	3.845	50	40	FHGB	
C=CCOc1ccccc1CN(C(=O)CCl)c1ccc2c(c1)OCCO2	3333299	BTZNEGIMRJNWTM-UHFFFAOYSA-N	373.836	3.795	50	40	FHGB	
COc1ccc(NC(=O)c2ccccc2C[C@H](Br)C#N)cc1	5235375	ADXBMOJJYZEEJO-ZDUSSCGKSA-N	359.223	3.777	50	40	FHGB	
O=C(Cc1ccc(Br)cc1)N/N=C/c1c(F)cccc1Cl	4735353	OSTFXOAZRZIMBK-DJKKODMXSA-N	369.621	3.934	50	40	FHGB	
CC(C)Oc1ccc2ccccc2c1/C=N/NC(=O)[C@H](O)c1ccccc1	409268001	XQTVHDZAEWZGMR-KURUZVKSSA-N	362.429	3.811	50	40	FHGB	
COc1cccc(/C=N/NC(N)=O)c1OCc1ccc(Cl)c(Cl)c1	408899825	QXNCAPXGVIIBBM-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
O=C(NNC(=O)c1[nH]c2ccc(F)cc2c1Cl)c1cccc(Cl)c1	40143817	YTHHTNQRCIBWJY-UHFFFAOYSA-N	366.179	3.689	50	40	FHGB	
Cc1cc(N2CCCC2)ccc1/C=N\NC(=O)COc1cccc(Cl)c1	408959572	BEGIPBWGXRUEOM-XKZIYDEJSA-N	371.868	3.778	50	40	FHGB	
Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)NC1CCCCC1	4511012	NDQJIBKEVFOCLV-UDWIEESQSA-N	359.861	3.800	50	40	FHGB	
Cc1ccc(C)c(NC(=O)/C(C#N)=C2\C(=O)Nc3ccc(Cl)cc32)c1	39556011	KZWZUIHRCGPXFV-VKAVYKQESA-N	351.793	3.825	50	40	FHGB	
O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1cccc(Cl)c1	3275178	QJUNAGYMNAJQFS-LSFURLLWSA-N	355.747	3.921	50	40	FHGB	
O=C(Cc1cccs1)N/N=C/c1c[nH]c2ccc(Br)cc12	8446653	QEPYNYLJNNSGRT-GIJQJNRQSA-N	362.252	3.685	50	40	FHGB	
COc1ccc(OCC(=O)N/N=C(\C)c2ccc(C(C)(C)C)cc2)cc1	6684589	XHBDUEAWGXNMJO-PXLXIMEGSA-N	354.450	3.912	50	40	FHGB	
CC1=C(C#N)C(=O)N(C)C(=O)/C1=C/c1ccc(-c2cccc(Cl)c2)o1	101139953	XVVSMFINBIPKAC-OQLLNIDSSA-N	352.777	3.822	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21	408599384	TZUZQVQFNRPYQQ-FYJGNVAPSA-N	362.389	3.808	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Nc1nccs1	3617187	ISNMZKKSTUGLBM-FMIVXFBMSA-N	366.358	3.857	50	40	FHGB	
COc1ccc(CCCC(=O)N/N=C/c2ccc(C)c(OC)c2)c(C)c1	408909908	IWHAEXAPLKEGTQ-HYARGMPZSA-N	354.450	3.794	50	40	FHGB	
COc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	40866012	JXWXNTJNWFMDDI-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
C/C(CC(=O)Nc1cccc2c1CCCC2)=N\NC(=O)C1CCCCC1	13562691	JNQBBTMHZFIVRF-HZHRSRAPSA-N	355.482	3.966	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)c(OC)c1OC	15012578	WZCOEBJBMNUHFY-PTNGSMBKSA-N	352.390	3.567	50	40	FHGB	
CCc1cc(C)cc(OCC(=O)N/N=C\c2cccn2-c2ccccc2)c1	408820674	XZHOJYJQOQBXES-HAHDFKILSA-N	361.445	3.877	50	40	FHGB	
N#C/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	4953673	JDXTXBRCJPCWJA-IZZDOVSWSA-N	372.724	3.702	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)cc(Cl)c1O	409048794	UCXINMPUEWYJKW-BHUQIAQOSA-N	350.846	3.721	50	40	FHGB	
CC(C)Oc1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1	408810621	MLOYCQVARUECCY-XNTDXEJSSA-N	351.362	3.928	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)c2ccccc21	33795404	RBFCCOAIBSXIOK-OEAKJJBVSA-N	374.444	3.858	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccc(Br)cc2Cl)o1)C(N)=O	252479849	BNWUCIIEMHTMHO-YVMONPNESA-N	351.587	3.755	50	40	FHGB	
COc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1OCc1ccc(C)cc1	3255581	IRUXXXKFRSXPDA-VIZOYTHASA-N	356.809	3.628	50	40	FHGB	
C[C@@H]1[C@H](c2ccc3c(c2)OCO3)C[C@H](Cl)C[C@@]12C=C1OCOC1=CC2=O	5664281	IDIAWFXBAIWWNZ-JGECGHQCSA-N	374.820	3.877	50	40	FHGB	
Cc1ccc(NC(=O)CCC(=O)N/N=C/c2c[nH]c3ccccc23)cc1C	6215623	NYOMBVVPNKGQKR-YDZHTSKRSA-N	362.433	3.654	50	40	FHGB	
Cc1csc(/C(C#N)=C/c2ccc(OCCO)cc2Br)n1	11294841	ACLUVKSUHWXNSI-WUXMJOGZSA-N	365.252	3.649	50	40	FHGB	
CC/C(=N\NC(=O)[C@H](C)Sc1ccccc1)c1ccc2c(c1)OCCO2	4714627	WAQVSYGAJNXVPI-HGNXGAGXSA-N	370.474	3.869	50	40	FHGB	
CN1CC2=C(OC(N)=C(C#N)[C@H]2c2ccccc2)/C(=C/c2ccccc2)C1	20528757	YDNZYUCDIMZCCF-MUPHDSPYSA-N	355.441	3.777	50	40	FHGB	
COc1cccc(/C=N/NC(C)=O)c1OCCCOc1cccc(C)c1C	4675761	UVMDWPMHYWENDZ-HYARGMPZSA-N	370.449	3.630	50	40	FHGB	
Cc1cc(/C=N\NC(=O)Cc2cccc(C(F)(F)F)c2)cc(C)c1O	110435163	SYOYXZMTKNWLFZ-YVNNLAQVSA-N	350.340	3.721	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2ccccc2)c(C)n1-c1cccc(C(=O)O)c1	408994423	FYDSWAZJXVZLJH-XKZIYDEJSA-N	361.401	3.556	50	40	FHGB	
N#C/C(=C\c1cn(Cc2ccccc2C#N)c2ccccc12)C(=O)NC1CC1	409195552	QULHLVNDMRXNIT-WOJGMQOQSA-N	366.424	3.747	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccccc3OCC)cc2c1	409187488	RCECGBZCWAWUOJ-BKUYFWCQSA-N	352.390	3.994	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C\c2ccc(N3CCCCC3)o2)c1	38704599	VCXATLFLNVMLHS-QINSGFPZSA-N	351.406	3.824	50	40	FHGB	
CC(C)(C)c1ccc([C@@H]2C[C@@H]2C(=O)N/N=C\c2ccc3c(c2)OCO3)cc1	30738469	LGKQQCGYSWJFTD-WWNXGUCMSA-N	364.445	3.967	50	40	FHGB	
COc1ccc(N2C=C(C#N)S(=O)(=O)c3ccc(F)cc32)cc1Cl	44167173	DAYIZCDEPWKMQV-UHFFFAOYSA-N	364.785	3.778	50	40	FHGB	
O=C(OCCCCCl)[C@@H]1CC=CC[C@H]1C(=O)OCCCCCl	5373399	LBTPPVFWGKEQJP-ZIAGYGMSSA-N	351.270	3.693	50	40	FHGB	
O=C(N/N=C/c1ccccc1O)c1ccc(NC(=O)C2CCCCC2)cc1	674540	DXAWSAUNIUJCDA-HYARGMPZSA-N	365.433	3.675	50	40	FHGB	
O=C(CCNC(=O)c1ccccc1)NN(c1ccccc1)c1ccccc1	12806140	AIZAWVKLRFTFRF-UHFFFAOYSA-N	359.429	3.676	50	40	FHGB	
COc1cc(C)ccc1C(=O)N/N=C/c1ccc(N2CCCC2)cc1C	408961353	RWDLHPZJLJVBFV-HYARGMPZSA-N	351.450	3.676	50	40	FHGB	
O=C(COc1ccccc1)N/N=C/c1c(O)ccc2oc3c(c12)CCCC3	3212426	NFZQDPCDPPEWTI-WSDLNYQXSA-N	364.401	3.546	50	40	FHGB	
CCCCOc1ccccc1[C@H]1C(C#N)=C(N)OC(C)=C1C(=O)OCC	4129571	WGEJNQDNYBCQTG-SFHVURJKSA-N	356.422	3.510	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccccn1	6049095	KLKLLTFJEXWZTL-BUVRLJJBSA-N	363.392	3.954	50	40	FHGB	
COc1cccc(-c2n[nH]c3c2[C@H](c2ccc(C)cc2)C(C#N)=C(N)O3)c1	5248720	XEEHLNHJAXEKKS-QGZVFWFLSA-N	358.401	3.612	50	40	FHGB	
Cn1ccnc1Sc1ccc(/C=C(\C#N)c2ccccn2)cc1[N+](=O)[O-]	7738595	VRUUTYLQZCPCQN-GXDHUFHOSA-N	363.402	3.939	50	40	FHGB	
Cc1ccc(COc2cccc(/C=N/NC(=O)c3ccccc3N)c2)cc1	6331833	KZFGRWLRJBRGLQ-ZVHZXABRSA-N	359.429	3.920	50	40	FHGB	
CCOc1cc(NC(=O)c2ccco2)c(OCC)cc1NC(=O)CCl	1223636	JAHVNOQCMKBHLP-UHFFFAOYSA-N	366.801	3.507	50	40	FHGB	
C[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3F)[C@@H]2C1	4730524	QBQKOQFOCNSULL-POHZPAGDSA-N	350.372	3.804	50	40	FHGB	
Cc1nc(COc2cccc(C(=O)NN(C)c3ccccc3)c2)cs1	32842937	KLOCXWMBFVBEQY-UHFFFAOYSA-N	353.447	3.812	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)c1	59433148	WZRMOQWCOHJVQR-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
CC(C)/C(=N\NC(=O)c1cc(Br)ccc1O)c1ccccc1	408587876	HPPOATVLGHRAHZ-KNTRCKAVSA-N	361.239	3.945	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)COc1ccccc1C#N	1021333	KKOKHGHGMFEMSM-ZVHZXABRSA-N	373.412	3.639	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1F)c1ccc(NC(=O)c2ccco2)cc1	5382056	AFIDPIRNFZZWKA-YDZHTSKRSA-N	365.364	3.825	50	40	FHGB	
Cc1[nH]c2ccccc2c1/C=N/NC(=O)c1[nH]nc(-c2ccccc2)c1C	9353615	ZPPKPGFSKQQDCF-WSDLNYQXSA-N	357.417	3.939	50	40	FHGB	
Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)c2ccc(F)cc2)o1	408959648	CNLKCHKFDZAYIK-SSDVNMTOSA-N	366.348	3.856	50	40	FHGB	
CCOc1ccc(O)c(/C=N/NC(=O)CNc2cccc3ccccc23)c1	1435087	SHPUHXGKTRZUOL-YDZHTSKRSA-N	363.417	3.506	50	40	FHGB	
CC1=C(C(=O)OCc2ccccc2)OC(N)=C(C#N)[C@H]1c1ccc(F)cc1	1073879	RBSQARLWUSGUBX-GOSISDBHSA-N	364.376	3.651	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1ccccc1Br	58915513	LBZVIPWXWRQAKV-VCHYOVAHSA-N	363.280	3.833	50	40	FHGB	
Cc1n[nH]c2c1[C@H](c1ccccc1OCc1ccccc1)C(C#N)=C(N)O2	857443	ZGYRYSRQEIBTRQ-LJQANCHMSA-N	358.401	3.515	50	40	FHGB	
C#CCOc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1OCC	408851001	UDGGYXZDXIIFNX-HMAPJEAMSA-N	362.385	3.607	50	40	FHGB	
O=C(Cc1coc2ccc3ccccc3c12)NNC(=O)c1ccc(F)cc1	5558064	SETFNVNBWFQCBJ-UHFFFAOYSA-N	362.360	3.729	50	40	FHGB	
CCCCCCC(/C=C\c1ccc(Cl)c(Cl)c1)=N\NC(=O)C(N)=O	31761236	KNMKBQAECHDPAT-HEFXARFJSA-N	370.280	3.935	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)COc2ccc(C(C)(C)C)cc2)ccc1O	31776161	OJQPHECJQXZWNS-XKZIYDEJSA-N	370.449	3.618	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CC[C@@H](C)C2)[C@@H]1c1ccccc1	35193551	SPSUTBNAUGSSCK-LNHNDHHWSA-N	361.445	3.710	50	40	FHGB	
Cc1cc(C)c([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)c2cccnc2)o1	809298	PZKFZQQBDJSDPD-SRZZPIQSSA-N	364.361	3.631	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)cc1OC	5653892	ZSHOCDDKGCTJKV-GYZOOYGHSA-N	350.418	3.878	50	40	FHGB	
Fc1c(F)c(F)c(OCCN(CCCl)CCCl)c(F)c1F	1581194	PMSJQLHONHLIQO-UHFFFAOYSA-N	352.130	3.541	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)c1O	6964958	BMWRCMLXVQFBJY-VXLYETTFSA-N	364.854	3.687	50	40	FHGB	
CC[C@@H](C)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	22411444	YSYYNNIUZCAKNH-CYBMUJFWSA-N	360.841	3.726	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)c(OCC)c1	408798822	XIHDTGUYRDPNFR-RVDMUPIBSA-N	352.390	3.735	50	40	FHGB	
CCS(=O)(=O)[C@@H](Br)[C@@H](O)c1ccc(-c2ccccc2)cc1	96519083	APQWIEYFZHXVEA-JKSUJKDBSA-N	369.280	3.543	50	40	FHGB	
N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3)ccc2[C@H]1c1ccncc1	1775977010	VIIJPNKZLDVKPE-HXUWFJFHSA-N	369.380	3.519	50	40	FHGB	
O=C(CSCc1cccc(Cl)c1)N/N=C/c1ccccc1[N+](=O)[O-]	59473660	MKNYRGPGEHRBAI-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)cc1OC	1083894	BRDOZTVJGLZCGL-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
C/C(=N/NC(=O)COc1ccccc1C)c1ccccc1Br	408955361	OOCXRXLEJLJFKJ-UYRXBGFRSA-N	361.239	3.677	50	40	FHGB	
COCCCNC(=O)c1ccc(/C(C#N)=C/c2ccc(Cl)cc2)n1C	4039717	PCFWXTCWFFLUSC-NTCAYCPXSA-N	357.841	3.509	50	40	FHGB	
N#C/C(=C\c1ccc(OC(=O)c2ccco2)cc1)c1nnc2n1CCCCC2	5524739	VQNHGILUGOBTEQ-DTQAZKPQSA-N	374.400	3.881	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccccc1CC)OCO2	409095533	BKGKLDINXQQFAT-CXUHLZMHSA-N	364.401	3.922	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1ccc(C)c(C)c1	408822805	MGLJIFKYCGDKQI-GZTJUZNOSA-N	364.401	3.946	50	40	FHGB	
Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3ccccc3Cl)c2)n1	6189279	ZBGGOUBGWRPOAF-WSDLNYQXSA-N	366.852	3.966	50	40	FHGB	
CCOc1cc(/C=C(/C#N)c2nc3ccc(C)cc3[nH]2)cc([N+](=O)[O-])c1O	51074526	HGUJAWUUTXUDTM-QPEQYQDCSA-N	364.361	3.948	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Nc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1	662755	XJTPOFJXVZHWFQ-DQAKUKQTSA-N	360.801	3.589	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1	59447335	DAXJESYXLUKMAL-DEDYPNTBSA-N	355.394	3.846	50	40	FHGB	
Cc1ccc(C(C)C)c(OCCOc2ccccc2/C=C(/C#N)C(N)=O)c1	23402386	AZMMUAXKTABILJ-AQTBWJFISA-N	364.445	3.969	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)NCc1ccccc1	2269319	ONYQGLJUPAGKNL-LDADJPATSA-N	372.380	3.868	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc(OC)c1O	408816442	YUCGOIOCQMJLLR-RUFAVTIMSA-N	354.450	3.731	50	40	FHGB	
N#C/C(=C\c1ccccc1OCCOc1ccccc1)C(=O)N1CCCC1	409368954	UNGSDEZEQAFPNB-KNTRCKAVSA-N	362.429	3.674	50	40	FHGB	
O=C(N/N=C\c1ccc(Cl)cc1)c1ccc2c(c1)OCC1(CC1)CO2	225369348	LBPUVHGBHZQEGD-FBHDLOMBSA-N	356.809	3.655	50	40	FHGB	
C/C(=N\NC(=O)[C@@H]1Oc2ccccc2O[C@H]1c1ccccc1)c1ccncc1	95532835	GXMPUDGJNOMCAZ-TUIRCERESA-N	373.412	3.503	50	40	FHGB	
COc1cc(C=C(C#N)C#N)ccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	5512885	HFRMMPNOMCERPH-UHFFFAOYSA-N	366.289	3.734	50	40	FHGB	
Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/C=C/c3ccccc3)c2)n1	6189241	YWIHNGSKIHXGHW-QVQOGBIZSA-N	358.445	3.977	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)[C@@H](C)SCc2ccccc2)c1	5370448	IGPMGBPDLKEJMD-QQHUYRGFSA-N	369.490	3.807	50	40	FHGB	
COCCCNC(=O)/C(C#N)=C/c1cn(Cc2ccccc2)c2ccccc12	4994044	GDFIANGBLGUTKG-XMHGGMMESA-N	373.456	3.749	50	40	FHGB	
Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)c1ccc(F)cc1	4702484	LNYFDGFBESWFSU-SRZZPIQSSA-N	356.788	3.737	50	40	FHGB	
CCOc1cc(/C=C(\C#N)c2ccc(OC)c(OC)c2)cc([N+](=O)[O-])c1O	408581634	YCKVMLQIXMNXBJ-VGOFMYFVSA-N	370.361	3.780	50	40	FHGB	
O=C(COc1cccc(Cl)c1)N/N=C\c1ccc(N2CCCCC2)cc1	408961990	WPOYAFFYQNRRSY-HMAPJEAMSA-N	371.868	3.859	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)CNc1ccc(F)cc1	409352364	ZSEFDZNXYZQNQY-ZMOGYAJESA-N	365.408	3.940	50	40	FHGB	
C[C@]12CC[C@@H]3[C@@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@H]1CC[C@]2(O)C#N	70673133	VRSHJJXUDZAQKD-SQDPYLFBSA-N	357.494	3.947	50	40	FHGB	biogenic
N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1Br	4471752	QDSYRXAQZBQEIB-GHXNOFRVSA-N	371.190	3.723	50	40	FHGB	
CCOC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)cc1	4501916	FZFSHHGKSMBBCM-UDWIEESQSA-N	368.414	3.949	50	40	FHGB	
C[C@@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3F)[C@H]2C1	4730525	QBQKOQFOCNSULL-PSZVPEGOSA-N	350.372	3.804	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=N\NC(=O)c3ccc(C)cc3)o2)cc1	408881978	LESSNPOWQNLCRD-XKZIYDEJSA-N	362.385	3.806	50	40	FHGB	
N#CCOc1ccc(/C=N\NC(=O)c2cc3cc(Cl)ccc3o2)cc1	34794093	GSCRDPAYEAADEN-NHDPSOOVSA-N	353.765	3.752	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1ccc(-c2cc(Cl)ccc2Cl)o1	5006594	YOHRYUXMUOVIJA-DHZHZOJOSA-N	365.216	3.923	50	40	FHGB	
C/C(=N\NC(=O)c1ccccn1)c1ccc(NC(=O)c2cccs2)cc1	5895710	AWEBUWVPCWKEGM-LPYMAVHISA-N	364.430	3.549	50	40	FHGB	
CCCCCOc1ccc(O[C@H](C)C(=O)N/N=C/c2ccccc2O)cc1	3167088	SWGSKQIYCSMBHZ-QFNCUCFLSA-N	370.449	3.879	50	40	FHGB	
CCN1CC=C2[C@@H](C1)[C@@H](c1ccc(C(C)C)cc1)C(C#N)=C(N)C2(C#N)C#N	19853251	YAPQBNGFTOKIEC-CTNGQTDRSA-N	371.488	3.555	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)[C@H](C)SCc2ccccc2)c1	5362321	IGPMGBPDLKEJMD-WXUSHSQQSA-N	369.490	3.807	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)Cc2ccc(Br)cc2)cc1	100062713	LZAIACIPLDFZQI-UNOMPAQXSA-N	361.239	3.541	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(O)O2	107738331	FTFRMJBDNRUHCV-GOSISDBHSA-N	374.356	3.906	50	40	FHGB	
CCOC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@H]2c1cccc(F)c1	1428058	ALBGBMKHAWPSJI-AWEZNQCLSA-N	358.394	3.591	50	40	FHGB	
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=N/NC(=O)c1ccncc1	6790852	ZTSASZBGCKGBJW-UFFVCSGVSA-N	374.231	3.646	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OCC(C)C	7157067	RZPVLCHKJFDBEI-CXUHLZMHSA-N	354.406	3.546	50	40	FHGB	
COc1cc(C(=O)N/N=C/c2ccc3c(c2)c2ccccc2n3C)ccc1O	15934456	DXALHXWALPBIPE-YDZHTSKRSA-N	373.412	3.810	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2ccc(OCC)cc2OCC)cc1	20764101	YQNKGFLDIASOSG-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
COc1cc(/C=C(/C#N)c2ccc(C(=O)O)cc2)cc(Br)c1O	6380670	SYAWEWXCQNRKJJ-MLPAPPSSSA-N	374.190	3.926	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1	5531583	SJYUSIYVAKXUTP-VDCVXVNISA-N	363.826	3.879	50	40	FHGB	
O=C(N[C@H](CSc1ccccc1)[C@H](O)CCl)OCc1ccccc1	86860383	YMCLVAZUQJPLTE-IAGOWNOFSA-N	365.882	3.673	50	40	FHGB	in-vitro
O=C(N/N=C/c1cccc(Oc2ccccc2)c1)[C@@H]1COc2ccccc2O1	3206643	YPIXHKPTAWXCTJ-VSIOZEBNSA-N	374.396	3.769	50	40	FHGB	
O=C(NNC(=O)c1ccc[nH]c1=S)c1cc2c(s1)CCCCCC2	10289635	BXDWIRBYPXDDEL-UHFFFAOYSA-N	361.492	3.539	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=N/NC(=O)c2cccc(Cl)c2)cc1	4106612	MSRUEBPWMGUTEE-HYARGMPZSA-N	366.852	3.961	50	40	FHGB	
COC(=O)N/N=C/c1ccc(OCCCOc2cccc(C)c2C)cc1	4591178	YGLBQVOMLCAHAG-KGENOOAVSA-N	356.422	3.841	50	40	FHGB	
COc1ccc(/C=C2\C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)cc1OC	18272099	OFMRGGKESHAUHM-VGOFMYFVSA-N	358.401	3.712	50	40	FHGB	
CCc1ccc(NC(=O)/C(C#N)=C/c2cc3c(cc2OC)OCO3)cc1	409100038	PJHFAGOAGCHIDV-OVCLIPMQSA-N	350.374	3.532	50	40	FHGB	
CCOc1cc(C(=O)NN)cc(Cl)c1OCc1ccc(F)cc1Cl	216836638	RQTKQELQMKCVFU-UHFFFAOYSA-N	373.211	3.714	50	40	FHGB	
O=C(N/N=C(/N=C/c1ccc2c(c1)OCO2)c1ccccc1)c1ccccc1	38822823	BLWWQVKIODBUEE-LGLHSBMDSA-N	371.396	3.626	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C\c1cc(Cl)cc([N+](=O)[O-])c1O)c1ccccc1	97994051	KUQLXLLTNAYQOM-ODYDIQAQSA-N	371.780	3.738	50	40	FHGB	
CC(=O)[C@@]1(O)[C@H](Cl)C[C@@H]2[C@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C	1772492808	FCNFDODVDQKBAV-LYNJUAAJSA-N	368.945	3.927	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)c(C)n1-c1ccccc1	105872899	LGPWCQUNYSZTDF-OKZBNKHCSA-N	365.477	3.681	50	40	FHGB	
CC1(C)[C@]2(C(=O)Nc3ccccc3)CC[C@@]1(C)C(=O)[C@H]2Br	4185829	JLKGVIGPYYRFHH-OAUYIBNBSA-N	350.256	3.784	50	40	FHGB	
C/C(=N\NC(=O)CNc1cccc2ccccc12)c1cc([N+](=O)[O-])cs1	4687643	SWIVFHXCJJLGAX-UDWIEESQSA-N	368.418	3.762	50	40	FHGB	
C[C@@H]1CCCCN1C(=S)SCC(=O)C(C#N)=C1Nc2ccccc2N1	5690821	YZWVAGHMJUVBKH-GFCCVEGCSA-N	372.519	3.721	50	40	FHGB	
CC[C@@H]1CCC2=C(C1)[C@H](c1ccccc1)[C@@](C#N)(C(=O)OC)C(N)=C2C#N	16636819	YQRJFHQSMAWMSZ-YFYZNPQRSA-N	361.445	3.710	50	40	FHGB	
CCc1ccc2nc(Cl)c([C@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)cc2c1	1223583	YDGZUWRJBWCJAY-INIZCTEOSA-N	365.824	3.700	50	40	FHGB	
O=C(O)[C@@H](Br)C12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2	3866295	PKGVWUJFDWNKFJ-RORBGTHESA-N	352.066	3.568	50	40	FHGB	
C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OC2CSC2)cc1	2308935	GCDMSRBWADEPLU-HXJASHHUSA-N	372.515	3.812	50	40	FHGB	
CCc1nc2ccccc2n1CC(=O)NNc1ccccc1C(F)(F)F	39976083	UIYZOTWQAVVCAK-UHFFFAOYSA-N	362.355	3.761	50	40	FHGB	
CCOc1cc(C)c([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1C(C)C	5444421	TUSYUHZLFPFCEY-SFHVURJKSA-N	352.438	3.767	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(Cl)c1	4704900	URAVBKVVQKCFAQ-VBKFSLOCSA-N	367.836	3.722	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(O[C@H](C)C(=O)O)cc2)c(C)c1	408845324	MBGYUHZFLCXAHT-QJISPJEISA-N	364.401	3.701	50	40	FHGB	
Cc1cc(C)cc(CSCC(=O)N/N=C/c2ccc(N(C)C)cc2)c1	6235997	AGYSOGGOIMBULU-CIAFOILYSA-N	355.507	3.753	50	40	FHGB	
Cc1ccc(-c2ccc(C(=O)N/N=C3/C(=O)Nc4ccccc43)s2)s1	5602445	MLAAQUOTQDQAKZ-UHFFFAOYSA-N	367.455	3.871	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccc(C)cc1	59334233	BLVLHSCCSAOXHO-WQRHYEAKSA-N	350.418	3.578	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1OCC	408846378	NBQAVQWFSXFKFP-BKUYFWCQSA-N	352.390	3.994	50	40	FHGB	
C/C(=N\NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)s1	5381866	WCWKTABAISEMHE-OVCLIPMQSA-N	368.212	3.573	50	40	FHGB	
C=CCOc1ccc(/C=C(\C#N)C(=O)N[C@H](C)CC)cc1Br	408801450	TUFGJIDTWUHGEL-ZMTLZGASSA-N	363.255	3.836	50	40	FHGB	
CC(C)(C)OC(=O)N/N=C/c1cccc(OC(=O)/C=C\c2ccco2)c1	85884009	GWYPAWZQJIFVDB-UKKFYFCDSA-N	356.378	3.757	50	40	FHGB	
O=C(N/N=C\c1ccccc1Cl)c1ccc2c(c1)OCC1(CC1)CO2	225368828	WPBGKEVQCAZEIG-FBHDLOMBSA-N	356.809	3.655	50	40	FHGB	
CC1(C)OB(c2cnc(CO[Si](C)(C)C(C)(C)C)s2)OC1(C)C	170024056	PWVURJPJSOHOIY-UHFFFAOYSA-N	355.385	3.964	50	40	FHGB	
CCOc1ccc(OCc2ccc(C(=O)N/N=C/c3ccc[nH]3)cc2)cc1	3284711	MCAAVPPQIPYHLA-OEAKJJBVSA-N	363.417	3.756	50	40	FHGB	
COc1cccc(/C=N\NC(=O)c2cc3ccccc3o2)c1OC(C)C	408933294	AJKDJFQLSVJSKP-MTJSOVHGSA-N	352.390	3.993	50	40	FHGB	
C[C@@H]1C[C@@H]([P+](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)O1	1775964771	BRGBURGZSZDDIA-XMSQKQJNSA-N	361.401	3.685	50	40	FHGB	
CC(=C/c1ccccc1)/C=N/NC(=O)CSc1nc2ccccc2n1C	12378716	HJXGNIACHXDAQF-IALJSVHUSA-N	364.474	3.871	50	40	FHGB	
Cc1onc(-c2ccccc2Cl)c1C(=O)NNC(=O)c1ccccc1F	879635	DEQCTZGLWOYFMW-UHFFFAOYSA-N	373.771	3.517	50	40	FHGB	
C/C(=N\NC(=O)Cc1nc(-c2ccccc2)cs1)c1cc(C)ccc1O	7766657	NECRQLKFINZDKR-HYARGMPZSA-N	365.458	3.907	50	40	FHGB	
N#CC1=C(N)Oc2c(oc(=O)c3ccccc23)[C@@H]1c1ccc(Cl)cc1	4592814	IPYWNAQDCYFCQO-OAHLLOKOSA-N	350.761	3.665	50	40	FHGB	
CCN(NC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2)c1ccc(C)cc1	14941242	VFHCUQMRJDCJQS-CYBMUJFWSA-N	355.463	3.599	50	40	FHGB	
O=C(CCCc1c[nH]c2ccccc12)NNC(=O)c1cccc(Cl)c1	9377074	LJHUFWDNYROJKT-UHFFFAOYSA-N	355.825	3.605	50	40	FHGB	
CCCCOc1ccc(/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	33760678	OCJZCMUIVOZXKT-MOSHPQCFSA-N	371.393	3.546	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc1	9204304	VVKXDHAWFIXUKM-DEDYPNTBSA-N	373.250	3.707	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccn2)c(C)n1-c1ccc2ncccc2c1	635495	XTEIJLHYTIVVFW-AFUMVMLFSA-N	369.428	3.801	50	40	FHGB	
C=CCc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccccc1C#N	59334772	XGKLOQUEEAAHGZ-BKUYFWCQSA-N	371.440	3.861	50	40	FHGB	
CC(C)Oc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1	803903	ZXNQTBDYPSWINW-SFHVURJKSA-N	374.396	3.798	50	40	FHGB	
O=C(/N=c1/nc(-c2ccccc2)n(-c2ccccc2)s1)C(Cl)Cl	102431447	CQHDMTXXIDIOKO-SILNSSARSA-N	364.257	3.832	50	40	FHGB	
COc1ccc(/C=C/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1	408967852	XOMRFYYYMZCYKB-VXCFCLNRSA-N	365.345	3.779	50	40	FHGB	
C/C(CC(=O)Nc1ccc(C)cc1)=N\NC(=O)Cc1ccc(Cl)cc1	4549829	JZIFBEAMGBVAPW-HYARGMPZSA-N	357.841	3.712	50	40	FHGB	
CCn1c(C)cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1C	408965670	LIBRQNFRUBSIIW-VXLYETTFSA-N	354.366	3.543	50	40	FHGB	
Cc1cc(/C=N/NC(=O)CNc2ccccc2)c(C)n1-c1ccc(F)cc1	409383643	YUSRUAYASVVRLB-ZMOGYAJESA-N	364.424	3.795	50	40	FHGB	
O=C(N/N=C/c1ccccc1OC(F)F)c1cc2ccccc2cc1O	3276251	LZTIVAAWBPWMQZ-SSDVNMTOSA-N	356.328	3.911	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2ccc(OC(F)F)cc2)cc1OC	35684641	GSRIIQGJNOXTAS-LCYFTJDESA-N	374.343	3.851	50	40	FHGB	
O=C(N/N=C/c1nn(-c2ccccc2)cc1-c1ccccc1)c1ccncc1	642437	PGJOPDJMHVTOPJ-BUVRLJJBSA-N	367.412	3.698	50	40	FHGB	
COc1ccc(NC(=O)[C@H](Br)CCCCCl)cc1OC	2322730	QWHVWTDPJYTUNP-LLVKDONJSA-N	364.667	3.815	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc3ccccc3c2)c1C	4087319	HDYXTAIHHSGXSI-FYJGNVAPSA-N	373.456	3.917	50	40	FHGB	
O=C(NNc1nc2c(F)cc(F)cc2s1)c1nc2ccccc2s1	4121492	NPUJWQRGOFSGRF-UHFFFAOYSA-N	362.386	3.941	50	40	FHGB	
Cc1nc2sccn2c1C(=O)N/N=C/c1ccc(Cl)cc1Cl	59459677	ZPTZRPDZUMPSLI-REZTVBANSA-N	353.234	3.775	50	40	FHGB	
CCOC(=O)CC[PH](c1ccccc1)(c1ccccc1)c1ccccc1	104119724	QMPQZGSXGPUAIE-UHFFFAOYSA-N	364.425	3.666	50	40	FHGB	
CCO/C=N/C1=C(C#N)[C@H](c2ccccc2)C(C(=O)OCC)=C(CCl)O1	226762249	VAEGZCAOSHVGRO-BFTVFPACSA-N	374.824	3.656	50	40	FHGB	
C=CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(F)cc1	408845518	KBWYIPFJFOTVEC-RVDMUPIBSA-N	352.365	3.945	50	40	FHGB	
O=C(N/N=C/c1c(F)cccc1Cl)c1cc2cc([N+](=O)[O-])ccc2o1	408966115	ZBEQTJSUFWOGNU-UFWORHAWSA-N	361.716	3.897	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2Cl)cc1C(=O)O	409155050	PLCXCHVOMVDGJS-UKTHLTGXSA-N	370.792	3.983	50	40	FHGB	
N#C/C(=C/c1ccc(I)o1)c1ccc([N+](=O)[O-])cc1	409356797	HMOIAWNDPOOVPL-YFHOEESVSA-N	366.114	3.857	50	40	FHGB	
CCOc1cc(OC)ccc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	1073606	REGHSYMZMFIYKK-SFHVURJKSA-N	368.433	3.545	50	40	FHGB	
CCCSC1=C(C#N)[C@H](c2ccc(Br)cc2)CC(=O)N1	12250098	HHQBIQLRFFAEFE-LBPRGKRZSA-N	351.269	3.931	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)O[C@@H](c1ccc(Br)cc1)C(C#N)=C2N	5727687	JPMXUVCVQIIJKI-KRWDZBQOSA-N	373.250	3.900	50	40	FHGB	
COCCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C)c2C)c1C	408815439	QGCZFXINCQXDED-DEDYPNTBSA-N	365.477	3.771	50	40	FHGB	
O=C(CCn1c2c(c3ccccc31)CCCC2)N/N=C\c1cccc(O)c1	30735426	ZYOLWHDNJSQQFR-HAHDFKILSA-N	361.445	3.766	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@H]2C[C@@H]3C=C[C@@H]2C3)cc(OCC)c1OCC	226272268	ZNEHIIAWOIPSAR-JNYJRHOVSA-N	372.465	3.811	50	40	FHGB	
COc1cc(/C=C2\C(=O)c3ccccc3C2=C(C#N)C#N)cc(OC)c1OC	226760312	ORTCATQVRCIKSB-IUXPMGMMSA-N	372.380	3.793	50	40	FHGB	
O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1cc(C2CC2)nc2ccccc12	1085708	CALKIQFWZCUJEF-CIAFOILYSA-N	360.373	3.784	50	40	FHGB	
COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1ccc(C)c(C)c1	844038	FNRSPKZKHBXXGC-UHFFFAOYSA-N	361.401	3.760	50	40	FHGB	
COc1c(Cl)cc(Cl)cc1C(=O)NNC(=O)c1ccc(Cl)cc1	6453527	IUYBURXTHZCGJR-UHFFFAOYSA-N	373.623	3.730	50	40	FHGB	
O=C(Cc1ccc(F)cc1)NNC(=O)c1ccccc1Nc1ccccc1	24302552	MYGJFATUCPDMKG-UHFFFAOYSA-N	363.392	3.573	50	40	FHGB	
CCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)N(CC)CC)o2)cc1	1515491	QQNIAMJDNWTUJV-GHRIWEEISA-N	366.417	3.899	50	40	FHGB	
O=C(CC[C@H](O)c1ccccc1)N/N=C/c1cccn1-c1ccc(F)cc1	408753505	AIHSTHBXPFINBI-VRMLFSPKSA-N	365.408	3.580	50	40	FHGB	
O=C(N/N=C/c1ccc(N2CCCC2)cc1)c1ccccc1Br	408959854	GYQIRPSKSXZUFC-DEDYPNTBSA-N	372.266	3.813	50	40	FHGB	
CCN(CC)c1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1	408544914	YOVFIFBZNWOPHQ-ATVHPVEESA-N	363.417	3.777	50	40	FHGB	
Cc1cc(N2CCCCC2)ccc1/C=N\NC(=O)Cc1ccc(F)cc1	409229521	QKMMZQLQTVZYJZ-HAHDFKILSA-N	353.441	3.817	50	40	FHGB	
C=C(C)[C@@H](O)C#CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C	195758761	YPTSXSAEYLNTBE-QFIPXVFZSA-N	364.561	3.503	50	40	FHGB	
CCOc1ccc2ccc(OCC)c(/C=N/NC(=O)c3ccncc3)c2c1	1093242	UHXFABJLMOZNEV-OEAKJJBVSA-N	363.417	3.796	50	40	FHGB	
O=C(N/N=C/c1c(O)ccc2ccccc12)c1ccc(Cl)c([N+](=O)[O-])c1	3211497	XTBMVLUQIKQWFN-KEBDBYFISA-N	369.764	3.871	50	40	FHGB	
C/C(=N/NC(=O)CCCNc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1	5007276	BINBHGARNNJASQ-BKUYFWCQSA-N	374.828	3.981	50	40	FHGB	
COc1ccc(Br)cc1/C=N/NC(=O)c1ccc(Cl)cc1	3573712	AKAFHWSJNUWAIJ-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
OB(O)c1cccc2c1-c1ccccc1C21c2ccccc2-c2ccccc21	205116480	NOTKALFQBCUAKB-UHFFFAOYSA-N	360.221	3.710	50	40	FHGB	
N#CCCn1cc(C=C(C#N)C#N)c(-c2ccc(Br)cc2)n1	4076720	LBEJJWXDTVHWHT-UHFFFAOYSA-N	352.195	3.657	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)CSCc2ccccc2C)c1	5549118	PXZZAZSCJOBROO-FYJGNVAPSA-N	354.475	3.943	50	40	FHGB	
O=C(CCC(=O)NC1CCCCC1)N/N=C/c1c(Cl)cccc1Cl	5567296	VYATYVBXWMSJBY-RGVLZGJSSA-N	370.280	3.673	50	40	FHGB	
CO[C@@H](C(=O)N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccccc1	3071493	MWMLLFWMZNUJON-VTNJTDAWSA-N	353.205	3.537	50	40	FHGB	
C=CCc1cccc(/C=N/NC(=O)COc2ccc(C(C)C)cc2)c1O	2756973	DHOXIRIFQWNZIR-LPYMAVHISA-N	352.434	3.773	50	40	FHGB	
CCOC(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12	12798015	FRPVRFWKDOEQGY-UHFFFAOYSA-N	369.808	3.946	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1	5602975	RQZBTCLMUVYWKI-KGENOOAVSA-N	363.373	3.938	50	40	FHGB	
N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)Nc1cccc(C(F)(F)F)c1	96446208	RAXDPDNUNUTFSK-SDQBBNPISA-N	360.291	3.980	50	40	FHGB	
CCN1C(=O)/C(=C(\C#N)C(=O)Nc2ccc(Cl)cc2)c2ccccc21	409146824	UUBBCNKVWZGFNX-BMRADRMJSA-N	351.793	3.622	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(O)c(Cl)c3)cc2c1	409187524	RMWXELPDLGTYBN-JMIUGGIZSA-N	358.781	3.954	50	40	FHGB	
O=C(CCCl)Nc1ccccc1C(=O)Nc1nnc(-c2ccccc2)o1	39750429	ZDMSNMYLRDJOPL-UHFFFAOYSA-N	370.796	3.556	50	40	FHGB	
C=C1C(C)(C)[C@H]2CC[C@]1(C(=O)NNC(=O)[C@]13CC[C@@H](C1)C(C)(C)C3=C)C2	100261570	HFZJKRKZPFNURH-WWLNLUSPSA-N	356.510	3.899	50	40	FHGB	
O=C(N/N=C/c1cccc2ccccc12)c1cccc(Cn2cccn2)c1	1081736	JOFISIPFIJJYMK-HZHRSRAPSA-N	354.413	3.849	50	40	FHGB	
Cc1cc([C@H]2C(C#N)=C(N)N(N(C)C)C3=C2C(=O)CC(C)(C)C3)c(C)s1	1444542	JHMAJDUSFWQSAB-KRWDZBQOSA-N	370.522	3.578	50	40	FHGB	
O=C(CCl)Nc1c(Br)c(C2CC2)nn1-c1ccccc1	2149179	ZOTDROBCNDCHBX-UHFFFAOYSA-N	354.635	3.690	50	40	FHGB	
CCn1c(C)nc2cc(C(=O)NNC(=O)c3cccc4ccccc34)ccc21	3293142	STJATNNGXLBFRG-UHFFFAOYSA-N	372.428	3.593	50	40	FHGB	
COc1ccc(C(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1	3431102	RWJLUFMCQNMWHK-UHFFFAOYSA-N	360.822	3.638	50	40	FHGB	
Cc1cccc(COc2ccc(Br)cc2/C=C(\C#N)C(N)=O)c1	408877127	SWTARELRNLJDLG-OVCLIPMQSA-N	371.234	3.729	50	40	FHGB	
CCOc1cc(Cl)c(/C=N\NC(=O)Cc2ccc(F)cc2)cc1OC	409239670	DAHJKUUKPRCJCJ-NHDPSOOVSA-N	364.804	3.579	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)COc2ccc([C@H](C)CC)cc2)ccc1O	1319666	OKNDKMYAEXFGMN-IKMPRTQCSA-N	370.449	3.834	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)COc2ccc([C@H](C)CC)cc2)c(O)c1	1320223	CGPHWSUNWCMSOT-IKMPRTQCSA-N	370.449	3.834	50	40	FHGB	
Cc1cc(Cl)ccc1NC(=O)C(=O)N/N=C\c1c(F)cccc1Cl	59444776	CGXSIBHSPIYYJA-ZBKNUEDVSA-N	368.195	3.530	50	40	FHGB	
N#C/C(=C/c1ccc(O)c(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	59104736	XEZSXTMLQMCJMW-DHDCSXOGSA-N	365.820	3.793	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2cc3ccc(OC)cc3nc2Cl)c1	408864810	ZSZQWVLCFCKVBT-SRZZPIQSSA-N	369.808	3.669	50	40	FHGB	
COc1cc(C)c(/C=N\NC(=O)c2ccc(-n3cccc3)cc2)cc1OC	408548685	LEQMSSRGIDSGMR-HMAPJEAMSA-N	363.417	3.567	50	40	FHGB	
COc1cc(Cl)cc(/C=C(/C#N)C(=O)N[C@@H](C)c2ccccc2)c1O	409235635	COLGIQMLVQCNEH-IYVNWDGISA-N	356.809	3.839	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2cccc(Cl)c2)c([N+](=O)[O-])c1	408891043	KHKTWFHEKIEXRN-KPKJPENVSA-N	357.753	3.802	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1	408827739	MAEDMCZJZALNAP-LFIBNONCSA-N	350.374	3.638	50	40	FHGB	
NNC(=O)c1cc(Cl)c2[nH]c(-c3ccc(Cl)c(Cl)c3)nc2c1	226344806	GZMBTWWRDAUUHR-UHFFFAOYSA-N	355.612	3.794	50	40	FHGB	
N#C/C(=C\c1ccc(Sc2ccccc2)o1)C(=O)NC[C@@H]1CCCO1	1052807	XLFGSUOYEJLNOT-UKYUDJEDSA-N	354.431	3.633	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CNc2ccc3ccccc3c2)cc1O	1095715	DFOVXHIDWKGXRZ-YDZHTSKRSA-N	363.417	3.506	50	40	FHGB	
C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1Cl	2502647	UJRPALJQDCUDDK-GOSISDBHSA-N	354.793	3.829	50	40	FHGB	
COc1ccc(CSCC(=O)N/N=C/c2c(F)cccc2Cl)cc1	58915583	WIBAQMDRFKPWRP-AWQFTUOYSA-N	366.845	3.871	50	40	FHGB	
CO[C@@H](C(=O)N/N=C/c1cc(C)n(-c2ccccc2)c1C)c1ccccc1	58927106	QGGUKDADWWAMLH-CPOKCXMASA-N	361.445	3.932	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1cccc(OCc2ccc([N+](=O)[O-])cc2)c1	408727509	SIKQSZCGOTUWRS-MHWRWJLKSA-N	352.346	3.644	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)NC1CCCCC1)[C@@H](Br)C2=O	2348740	VKMWSCRLAWWBDN-VUCTXSBTSA-N	356.304	3.594	50	40	FHGB	
CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2C)cc1	408796451	YEGHXFXABLVMRC-SFQUDFHCSA-N	364.401	3.726	50	40	FHGB	
Cc1ccc(C)n1-c1ccc(C(=O)N/N=C/c2cccnc2)c(Cl)c1	408740170	JCWCUOCNOJZCFW-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccccc2C(=O)O)o1)C(=O)Nc1ccc(O)cc1	408794783	JFPVHOXECKDQJA-ACCUITESSA-N	374.352	3.896	50	40	FHGB	
COc1ccc(CCCC(=O)N/N=C/c2ccc(N(C)C)cc2)c(C)c1	44068972	BSVWIOCIHGWTMT-PXLXIMEGSA-N	353.466	3.543	50	40	FHGB	
CCS(=O)(=O)[C@H](Br)[C@@H](O)c1ccc(-c2ccccc2)cc1	96519082	APQWIEYFZHXVEA-HOTGVXAUSA-N	369.280	3.543	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)c1O	903870	RJRSTGXFMREYJP-LPYMAVHISA-N	370.449	3.618	50	40	FHGB	
Cc1cc(NC(=O)CCl)ccc1N1C(=O)c2cccc(Cl)c2C1=O	5793080	NCVRKPWPQUHYTR-UHFFFAOYSA-N	363.200	3.626	50	40	FHGB	
C[C@H](Oc1ccc2ccccc2c1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]	1054405	RHUZTHYXCVNDBQ-HADWXUJASA-N	363.373	3.666	50	40	FHGB	
Cc1ccccc1OCC(=O)N/N=C/c1cc(C)n(-c2ccccc2)c1C	28216257	IVWNDTIYCOXKJB-OEAKJJBVSA-N	361.445	3.932	50	40	FHGB	
O=C(NNC(=S)NC1CCCCC1)c1sc2ccccc2c1Cl	3261344	YPWYSWNEUPTTHB-UHFFFAOYSA-N	367.927	3.996	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)c(C)c2)cc1OC	408796661	PMZNDNJSIFUBHD-LDADJPATSA-N	360.413	3.870	50	40	FHGB	
COc1ccccc1/C=C/C=N/NC(=O)c1n[nH]c2c1CCc1ccccc1-2	4135604	QDTASYORGISOLK-SKRBABGKSA-N	372.428	3.613	50	40	FHGB	
Cc1cccc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c1Cl	408712891	ZWWNDRDWVBFAPM-UHFFFAOYSA-N	359.216	3.734	50	40	FHGB	
CCN(CC)c1ccc(C=NNC(=O)[C@H](C)Oc2ccc(C)cc2)cc1	23397224	SEVMINYPAMYNSN-KRWDZBQOSA-N	353.466	3.759	50	40	FHGB	
CCc1cc(C)cc(OCC(=O)N/N=C\c2ccc(N3CCCC3)cc2)c1	408961366	SERYMMGGCVEEKO-HAHDFKILSA-N	365.477	3.687	50	40	FHGB	
O=C(N/N=C\c1cc([N+](=O)[O-])ccc1Cl)c1ccc(-n2cccc2)cc1	409105828	KZTKJVDBPQOMII-NDENLUEZSA-N	368.780	3.803	50	40	FHGB	
CS[C@H](C)/C(=N\NC(=O)c1ccccc1)C1=C(O)c2ccccc2C1=O	26779709	QXIICHQFOXNAEM-SCGHJSMSSA-N	366.442	3.690	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2cc(Cl)ccc2O)cc1OCC	409331428	FMSQPKQEBJCHRT-MTJSOVHGSA-N	374.824	3.773	50	40	FHGB	
CCOc1ccccc1/C=N\NC(=O)Cc1ccc(Br)cc1	36144844	NGBZYYYGBJVFKN-UNOMPAQXSA-N	361.239	3.541	50	40	FHGB	
Cc1ccc2c(c1)C(=O)[C@H](Br)[C@H](C)N2C(=O)c1ccccc1	4592926	IBOKEPCJSUHPMN-BLLLJJGKSA-N	358.235	3.990	50	40	FHGB	
N#C/C(=C/c1cc2c(cc1Cl)OCO2)C(=O)NCCCc1ccccc1	409238038	JZCAQOLDJDEXPI-SXGWCWSVSA-N	368.820	3.725	50	40	FHGB	
CCCOc1ccc(/C=N\NC(=O)c2ccc(OCC)c(OC)c2)cc1	409311300	ZEEQAOWZHWXXBP-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1cccc(Cl)c1	408801957	XHPZHQOGYBYMKK-XNTDXEJSSA-N	366.804	3.906	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2ccc(-c3ccc(F)cc3)o2)cc1	409147280	YCRFBSKXEAWYJD-LPYMAVHISA-N	352.365	3.787	50	40	FHGB	
C[C@@H](C(=O)NNc1ccc(Cl)c(Cl)c1)n1c(=O)oc2ccccc21	32901563	OJTVDRVPSJTRSN-VIFPVBQESA-N	366.204	3.606	50	40	FHGB	
Cn1ncc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c1-c1ccccc1	253399202	INSOTJLBXCVVIX-GOSISDBHSA-N	374.444	3.538	50	40	FHGB	
C[C@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc2c(c1)OCO2	1081882	WIDNNMMHIRLDAP-OFJBCHTGSA-N	361.401	3.519	50	40	FHGB	
Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3c[nH]c4ccccc34)c2)n1	6189244	VIVXLUQJTPVNEM-ZMOGYAJESA-N	371.444	3.793	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OC	15222554	QEBGCNHRJGDSJO-ZROIWOOFSA-N	367.361	3.548	50	40	FHGB	
O=[N+]([O-])c1cccc([C@H](O)P(=O)(c2ccccc2)c2ccccc2)c1	2168895	QLXOWXFKQSJWCJ-LJQANCHMSA-N	353.314	3.600	50	40	FHGB	
CC(C)Cc1ccc(-c2cc(NC(=O)CCl)c(C(N)=O)s2)cc1	2380490	OWHJXDLFXNGAEJ-UHFFFAOYSA-N	350.871	3.890	50	40	FHGB	
CSc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc1	59444360	XLCZEIRWKNVFQV-UDWIEESQSA-N	355.463	3.621	50	40	FHGB	
CC(=O)Nc1ccc(/C=N/NC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1	6286364	CTVCVJLLUCLEMQ-OEAKJJBVSA-N	374.444	3.816	50	40	FHGB	
C/C(C=O)=C\c1ccc(/C=C(C)/C=C/c2nc(O)nc(O)c2[N+](=O)[O-])cc1	409391369	YIWUHYGNMHIYAC-RFNOUREQSA-N	367.361	3.515	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1C(C)C	1052768	PVHGPBIPBIRYHN-FOKLQQMPSA-N	353.397	3.902	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C/c1ccc(Br)s1	5674920	GHJUJMXQBHCYCM-FRKPEAEDSA-N	373.659	3.693	50	40	FHGB	
N#C/C(=C/c1ccc(Cl)s1)C(=O)N1CCN(c2ccccc2)CC1	15227483	SVEUVWYUJDLSIZ-OWBHPGMISA-N	357.866	3.657	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)/C(C#N)=C\c1ccc(OCC(=O)O)cc1	33304216	PAERTQBLQOCYPK-ZROIWOOFSA-N	370.792	3.658	50	40	FHGB	
CCCCCCCC(=O)NNS(=O)(=O)c1cc(Cl)ccc1Cl	59609137	BMAXQDPFYHFZGF-UHFFFAOYSA-N	367.298	3.663	50	40	FHGB	
CC(C)COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)cc1	4551397	AJOXHHREXQCZSK-LFIBNONCSA-N	364.401	3.965	50	40	FHGB	
O=C(NNC(=O)C1c2ccccc2Oc2ccccc21)c1ccccc1F	7406566	WAHUETYGJODQOV-UHFFFAOYSA-N	362.360	3.525	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc(C(=O)O)cc1	408810832	MYRBKRNKKRKPMK-MDWZMJQESA-N	356.765	3.592	50	40	FHGB	
CCN(CC)c1ccc(/C=N\NC(=O)[C@@H](C)Oc2ccc(C)cc2)cc1	32675366	SEVMINYPAMYNSN-JVDNRXPZSA-N	353.466	3.759	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C/c1sccc1C	408994630	IFLMGSHZWNXMAA-LZYBPNLTSA-N	353.241	3.592	50	40	FHGB	
CC(C)c1[nH]nc2c1[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2	5633520	HKZCMLVDYXMLNQ-GFCCVEGCSA-N	359.227	3.514	50	40	FHGB	
COc1ccc(-n2c(C)cc(/C=N\NC(=O)Cc3ccccc3)c2C)cc1	408995311	LZOLZFSFMRYELU-HAHDFKILSA-N	361.445	3.796	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)N(C)C)c(C)n1-c1ccc(Br)cc1	96476249	OZHVHWRKFNRYBA-GDNBJRDFSA-N	372.266	3.852	50	40	FHGB	
COc1cccc(/C=N/NC(=O)[C@H](C)Sc2ccc(Cl)cc2)c1O	5515471	YVMWYZVJDTVFGF-VSMYLPJWSA-N	364.854	3.685	50	40	FHGB	
N#C/C(=C(/O)CSC(=S)N1CCCCC1)c1nc2ccccc2[nH]1	104148669	ZZXLWMOUGDYNCS-QINSGFPZSA-N	358.492	3.860	50	40	FHGB	
N#CC1=C(N)n2c(nc3ccccc32)N[C@@H]1c1ccccc1Br	20086171	DFZVCFMQYJQWHW-OAHLLOKOSA-N	366.222	3.616	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1c(O)ccc2ccccc12	59153353	ICMYFLKMBSVSRB-CIAFOILYSA-N	350.443	3.929	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(Br)c2)cc1O	408752998	KLWFPHWURIUELT-GHXNOFRVSA-N	373.206	3.709	50	40	FHGB	
C=CCN1C(=O)/C(=C(\C#N)C(=O)Nc2ccc(Cl)cc2)c2ccccc21	409388655	NBMVEEYYSGWCOB-FBMGVBCBSA-N	363.804	3.788	50	40	FHGB	
CC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1	408813410	QIHMPRIFYDSTLM-PCRWRXJSSA-N	353.378	3.985	50	40	FHGB	
C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(Br)o1	409002211	ZCWOPNIIJRNGSJ-VCBXAZPMSA-N	353.241	3.673	50	40	FHGB	
COc1ccc(N(Cc2ccccn2)C(=O)CCl)cc1C(F)(F)F	199755248	ZAVSOIPXFGEDAV-UHFFFAOYSA-N	358.747	3.881	50	40	FHGB	
C=CCc1cc(/C=C(/C#N)C(=O)Nc2ccccc2OC)cc(OC)c1O	8169270	PAMKCBAWZFCDDP-WJDWOHSUSA-N	364.401	3.684	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccccn1	17138443	ZAHWDWWPIMKTJK-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
C/C(CC(=O)Nc1ccccc1-c1ccccc1)=N\NC(=O)c1cccnc1	100527445	JVTQUCCRRANNLN-PCLIKHOPSA-N	372.428	3.883	50	40	FHGB	
CC(C)=NNC(=O)c1ccc([C@@H]2SCC(=O)N2Cc2ccccc2)cc1	20247277	XOHXPTHAKQCXJK-FQEVSTJZSA-N	367.474	3.586	50	40	FHGB	
O=C(N/N=C\C=C\c1ccc2c(c1)OCO2)c1ccccc1-n1cccc1	5799677	BFAYFVGAJPAMAE-UVFAEQFJSA-N	359.385	3.635	50	40	FHGB	
CC1(C)Cc2cc(/C=N\NC(=O)c3ccc(Br)cc3)ccc2O1	408710797	LDGFYSAEOBMNFU-JAIQZWGSSA-N	373.250	3.927	50	40	FHGB	
CN(C)c1cccc(C(=O)N/N=C\c2cccn2-c2ccc(Cl)cc2)c1	32189259	OWNYMNXHJZPYQJ-HMAPJEAMSA-N	366.852	3.961	50	40	FHGB	
C/C(=N\NC(=O)CNc1cccc(C)c1)c1cccc(Br)c1	1445285	XVNXFTRXTMLLLR-DEDYPNTBSA-N	360.255	3.710	50	40	FHGB	
CCOC(=O)C1=C(C)OC(n2cccc2)=C(C#N)[C@@H]1c1cccc(OC)c1	4751325	NXVHRNMDTGBVJL-IBGZPJMESA-N	364.401	3.840	50	40	FHGB	
O=C(N/N=C/c1ccc(OC(=O)c2ccco2)cc1)c1cccc(Cl)c1	59445276	GOTYHHWRUOCMHP-CIAFOILYSA-N	368.776	3.916	50	40	FHGB	
CCCCSC1=C(C#N)[C@H](c2ccc(OCC)c(OC)c2)CC(=O)N1	12276367	GBZWJCOHXNPFGA-AWEZNQCLSA-N	360.479	3.966	50	40	FHGB	
CCCCCCCC(=O)N/N=C/c1cc([N+](=O)[O-])c2cccnc2c1O	103745609	NWBLMTFPWQJDCR-UDWIEESQSA-N	358.398	3.659	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)c(OC)c1	3140439	PYGMXAJRSMMWTK-LPYMAVHISA-N	370.449	3.530	50	40	FHGB	
C=CCOc1ccc([C@@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1Cl	409132800	RLUGVJMCSKOAJC-GOSISDBHSA-N	369.852	3.635	50	40	FHGB	
CCOC(=O)[C@@H](CC)/C(C)=N/NC(=O)C(c1ccccc1)c1ccccc1	5909081	ULRIZCNZAPMIEO-LKZQPVPRSA-N	366.461	3.900	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-]	408830741	SRTDIDVMBYSVOW-AWQFTUOYSA-N	351.284	3.686	50	40	FHGB	
CC[C@H](C)NC(=O)/C(C#N)=C/c1c[nH]nc1-c1ccc(Br)cc1	96311089	MVURYBPRLJHGPW-ZWSXMNCCSA-N	373.254	3.661	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C\c2cn(C)c3ccccc23)ccc1Cl	32581088	VSAOCWNSCPKWAK-FBHDLOMBSA-N	355.825	3.669	50	40	FHGB	
Cc1cc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)ccc1N1CCOCC1	408570405	UOKAZTHXQUFKQL-WJDWOHSUSA-N	362.408	3.911	50	40	FHGB	
O=C(/C=C/c1ccccc1)Nc1ccc(C(=O)N/N=C/c2ccco2)cc1	408840522	ZCQDOUGEUJFOOL-MAXPBVDLSA-N	359.385	3.695	50	40	FHGB	
Cc1cc(C)c(C#N)c(SC[C@H](Br)CBr)n1	4188624	IMMNMLZEVOZHOV-SECBINFHSA-N	364.106	3.821	50	40	FHGB	
COc1c(Cl)cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl	2727017	UBQSKCCZBOPHLB-QGMBQPNBSA-N	368.176	3.674	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1cccc(C)c1	59333710	LXCZBCAQCLRUHP-UNOMPAQXSA-N	364.445	3.968	50	40	FHGB	
CCCCC(O)(CCCC)C(=O)NNc1c(F)c(F)c(F)c(F)c1F	2308878	OJUBBBJVEFLDLZ-UHFFFAOYSA-N	368.346	3.937	50	40	FHGB	
Cc1cc(C)n(CC(=O)N/N=C2/C[C@H](c3ccccc3)Oc3ccccc32)n1	84102134	OCJWFFHFZSVALN-GKYQZKGUSA-N	374.444	3.544	50	40	FHGB	
Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(-c3cccc(C(=O)O)c3)o2)n1	409381781	WHXYVFZTMBJMEI-MHWRWJLKSA-N	361.357	3.706	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2cccn2-c2ccc(Cl)cc2)cc1	1046433	FTRQKLYFXILJFN-FYJGNVAPSA-N	353.809	3.903	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)COc2ccc(Cl)cc2Cl)cc1	5479975	QBKDMCBXUMAGGN-RGVLZGJSSA-N	367.232	3.921	50	40	FHGB	
N#CC1=C2SC[C@](O)(c3ccco3)N2C(=O)C[C@H]1c1ccc(Cl)cc1	12274960	HTPUSOGNMGTVSA-UGSOOPFHSA-N	372.833	3.576	50	40	FHGB	
Cc1noc(C)c1COc1cccc(C(=O)NN(C)c2ccccc2)c1	8358184	HAOIXXYPKAIPLK-UHFFFAOYSA-N	351.406	3.652	50	40	FHGB	
O=P(C[P@](=O)(O)c1ccccc1)(c1ccccc1)c1ccccc1	2321211	FPLMEYCQLBPAJM-UHFFFAOYSA-N	356.298	3.554	50	40	FHGB	
C#CCn1cc(/C=N/NC(=O)c2ccc(OCCC)cc2)c2ccccc21	20197552	LNRAZBBTDMRQDL-HZHRSRAPSA-N	359.429	3.827	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(Cl)cc1	408800775	PIHVZPDXGXBRRO-RVDMUPIBSA-N	366.804	3.906	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1ccc(OCc2ccccc2Cl)cc1	40007440	PWBYWOVWPGASAR-SFQUDFHCSA-N	370.836	3.589	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1cn(CCOc2ccccc2F)c2ccccc12	872777	HKFYQCRTSNIBPK-NTCAYCPXSA-N	363.392	3.512	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=C(/C#N)C(=O)Nc2ccc(O)cc2)cc1	6226676	MGUQKSPRPVLFJB-PEZBUJJGSA-N	372.428	3.795	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C)c1	6425084	YNTXGWDTSADJPQ-VXLYETTFSA-N	369.402	3.890	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@@H]1c1cc(F)ccc1F	987173	SYEGWBLVXAVHPX-CYBMUJFWSA-N	356.357	3.635	50	40	FHGB	
Cc1ccc(C(=O)Nc2cccc(C(=O)N/N=C/c3ccc(O)cc3)c2)cc1	1054477	VCEAYRWXYRKCEW-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
N#C/C(=C\c1ccc(OCC(=O)O)c(Cl)c1)c1nc2ccccc2[nH]1	4116353	TWDCZCDEONUPMA-KPKJPENVSA-N	353.765	3.744	50	40	FHGB	
N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1	4953721	IJRNOXCMBAOWCX-FMIVXFBMSA-N	372.178	3.903	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2cccc(C(F)(F)F)c2)o1)c1cnccn1	67194098	JTWPRDCYHWKXAZ-AQHIEDMUSA-N	360.295	3.519	50	40	FHGB	
COc1cccc(/C=N/NC(=O)CCSc2ccc(Cl)cc2)c1O	20249074	WTJJZKYLNPVZNK-YBFXNURJSA-N	364.854	3.687	50	40	FHGB	
C/C(CC(C)(C)c1ccccc1)=N\NC(=O)[C@H]1COc2ccccc2O1	33601743	RVLKDOCVGNZZMB-QTCOBDOFSA-N	352.434	3.686	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1ccco1)c1ccc(Cl)cc1	1507225	QLTLQGOFEDVXSJ-CIAFOILYSA-N	367.792	3.949	50	40	FHGB	
CC(/C=N/NC(=O)CSc1nc2ccccc2[nH]1)=C\c1ccccc1	16661214	KJSVTCUSILHPSB-SVRYVPOOSA-N	350.447	3.861	50	40	FHGB	
Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)n1	409382231	MCYFQUAKIVJJMX-GXDHUFHOSA-N	362.345	3.916	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1	5515460	SJYUSIYVAKXUTP-HPAYWCODSA-N	363.826	3.879	50	40	FHGB	
O=C(N/N=C\c1cccn1-c1ccc(O)cc1)c1ccc(-n2cccc2)cc1	409021333	BWKGDWIFTVCLCJ-KQWNVCNZSA-N	370.412	3.738	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)cc1	408856410	GWHGEOBBJSIUEG-PXLXIMEGSA-N	370.449	3.576	50	40	FHGB	
O=P(C(=S)N[C@@H]1C[C@H]2C=C[C@H]1C2)(c1ccccc1)c1ccccc1	100013616	FGUUHJBPQVYOOT-TXPKVOOTSA-N	353.427	3.840	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Nc1cccc(Br)c1)c1ccccc1	662773	IHFAPEZNXXGKAT-HMHKGCENSA-N	360.255	3.790	50	40	FHGB	
COC(=O)Cn1cc(/C=C(/C#N)C(=O)Nc2cccc(C)c2)c2ccccc21	15223237	MPMSHSOKAKDOTN-WJDWOHSUSA-N	373.412	3.668	50	40	FHGB	
N#C/C(=C\c1cn(Cc2ccc(F)cc2)c2ccccc12)[C@@H](N)C(C#N)C#N	22288902	BYWAOVBNIPHRFD-KYIYGJGQSA-N	369.403	3.726	50	40	FHGB	
CCNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc(C)cc1	26967674	DKGJFGXKKBIBNT-QGOAFFKASA-N	356.429	3.891	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl)c1cccc(N)c1	4045937	HBNCQSYTJQYWEY-OHBSIKEHSA-N	366.248	3.883	50	40	FHGB	
C/C(=N\NC(=O)C(=O)Nc1cccc(Cl)c1)c1ccc(Cl)s1	5219350	SDKWZEYTEBSPMI-QGMBQPNBSA-N	356.234	3.534	50	40	FHGB	
COC(=O)c1cc(-c2ccc(/C=N/NC(=O)c3ccco3)o2)ccc1Cl	408865070	BJUYDGWWWIAZGR-KEBDBYFISA-N	372.764	3.744	50	40	FHGB	
COc1ccc(NC(=O)N/N=C\c2cccn2-c2ccc(OC)cc2)cc1	408955553	XPTUCDPGQZSQCZ-STZFKDTASA-N	364.405	3.650	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CCSc2ccc(C)cc2)cc1OC	409130635	IOXVMLDBCWRQFM-DEDYPNTBSA-N	358.463	3.645	50	40	FHGB	
CCN(NC(=O)C[C@H]1c2ccccc2C=CN1C(C)=O)c1ccc(C)cc1	52551404	SDUZCBNLYXMTNM-NRFANRHFSA-N	363.461	3.817	50	40	FHGB	
COc1ccc(SSc2ccc(OC)cc2C(=O)O)c(C(=O)O)c1	1588809	ZJLOCZITRJGCBN-UHFFFAOYSA-N	366.416	3.900	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc(Cl)c2)o1)C(=O)NC[C@H]1CCCO1	26967843	QQMZHIQDXGNFQZ-IDKBZEPQSA-N	356.809	3.802	50	40	FHGB	
COc1ccc(/C=C2\C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)c(OC)c1	18272106	WTMBXRSWDAQTND-VIZOYTHASA-N	358.401	3.712	50	40	FHGB	
CC(C)n1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	4712062	GNCQRSXPNBPOLG-RGVLZGJSSA-N	350.378	3.894	50	40	FHGB	
CCn1c(C)cc(/C=N\NC(=O)Cc2cccc(C(F)(F)F)c2)c1C	409068305	IMCNCCSAQOEKLA-JJFYIABZSA-N	351.372	3.836	50	40	FHGB	
N#C/C(=C/c1cccn1-c1ccc(C(=O)O)cc1)c1ccc(C(=O)O)cc1	408545155	ZJUNZOZOARNESW-ATVHPVEESA-N	358.353	3.938	50	40	FHGB	
CCOC(=O)C1=C(N)OC(c2ccccc2)=C(C#N)[C@H]1c1ccc(C)cc1	5460817	VQQOUYSIDIGHJX-GOSISDBHSA-N	360.413	3.777	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)COc2ccc(-c3ccccc3)cc2)cc1	5794086	IEKCYSIUNAALQB-UHFFFAOYSA-N	360.413	3.502	50	40	FHGB	
CC[C@@H]1CCC2=C(C1)[C@@H](c1ccccc1)[C@@](C#N)(C(=O)OC)C(N)=C2C#N	16636813	YQRJFHQSMAWMSZ-JSVDNDDVSA-N	361.445	3.710	50	40	FHGB	
Cc1cccc(N2C(=N)/C(=C/c3ccc(Cl)cc3)C(N)=C(C#N)C2=O)c1	22079669	YZHHOPTZPXYTSC-QEEMYTIHSA-N	362.820	3.792	50	40	FHGB	
Cc1cc(C)cc(OCC(=O)N/N=C/c2ccc(Br)cc2)c1	3033834	LWAXJGUSZBWVJD-VXLYETTFSA-N	361.239	3.595	50	40	FHGB	
CCCOc1c(Br)cc(/C=C(/C#N)C(N)=S)cc1OCC	408544253	UNKZVNOQQWRYPI-WDZFZDKYSA-N	369.284	3.830	50	40	FHGB	
C/C(=N\NC(=O)[C@@H]1Oc2ccccc2O[C@@H]1c1ccccc1)c1ccncc1	33533985	GXMPUDGJNOMCAZ-ZZPIQZKYSA-N	373.412	3.503	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(OC)c(OC)c2)cc1	5907165	PFJOAQMOGMUUFC-PTNGSMBKSA-N	352.390	3.648	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)c1ccncc1	12428578	XPRCMJQIRWVJJA-JMIUGGIZSA-N	370.752	3.667	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(OCc2ccc(F)cc2)c(OC)c1	7143999	JMMFWDBNHUNGGF-MHWRWJLKSA-N	355.365	3.883	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2c[nH]c3ccccc23)c([N+](=O)[O-])c1	4508771	BTTGTJIIVTTXJI-XYOKQWHBSA-N	362.345	3.630	50	40	FHGB	
O=C1OC(=O)[C@]23Cc4ccccc4C[C@@]12C[C@@H]1Cc2ccccc2C[C@@H]1C3	100971982	IQIBRSZRBYIBNJ-WNXIRNOKSA-N	358.437	3.666	50	40	FHGB	
Cc1cc(Cl)ccc1NC(=O)/C(C#N)=C/c1cccc(OCC(=O)O)c1	408806055	ALGXYDUYENKGND-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccc(Cl)cc1	6429069	XSCJGITXXGXTLT-UHFFFAOYSA-N	371.849	3.847	50	40	FHGB	
O=C(NNC(=S)Nc1ccc(Cl)cc1)c1ccccc1OC(F)F	8855175	PVXFDMFLZZZFCR-UHFFFAOYSA-N	371.796	3.573	50	40	FHGB	
C#CCOC1(c2ccccc2)[C@@H]2CCC[C@H]1C2I	13590662	FMFHAGCYRDGRHL-PJPHBNEVSA-N	352.215	3.765	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)[C@H]2[C@@H]3CCCC[C@@]32C)cc1[N+](=O)[O-]	17074117	DGXSHMSRISYRIG-GESKFVNJSA-N	359.426	3.660	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)cc1	5576944	PAERTQBLQOCYPK-NTEUORMPSA-N	370.792	3.658	50	40	FHGB	
Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(Cl)cc2)cc1C	2147602	PCMDMAQPNHBIQJ-CIAFOILYSA-N	357.841	3.826	50	40	FHGB	
CC(C)(C)OC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1cccnc1	3189903	XGONKKIMJJKGCT-LPYMAVHISA-N	363.421	3.793	50	40	FHGB	
COc1ccc2nc(/C(C#N)=C\c3cc([N+](=O)[O-])ccc3OC)[nH]c2c1	409393688	ZAGGTGLCOXNSQB-GHXNOFRVSA-N	350.334	3.552	50	40	FHGB	
O=C(CC(=O)Nc1ccc(Cl)c(Cl)c1)N/N=C/c1cccs1	1087353	FNFRYVFDQUOYAD-CAOOACKPSA-N	356.234	3.534	50	40	FHGB	
O=C(O)/C=C/C(=O)Nc1ccc2c(c1)[C@@H](Br)c1ccccc1-2	1681539	JTIYJRIPYLNEHT-OZSKJFCKSA-N	358.191	3.731	50	40	FHGB	
COc1cc(Cl)c(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)cc1OC	9972390	NQLLFUZQAHZPEH-GHXNOFRVSA-N	358.781	3.608	50	40	FHGB	
COc1cc2ccccc2cc1C(=O)N/N=C/c1ccc(Br)o1	6230012	LHCBIGFYOCBGLG-VXLYETTFSA-N	373.206	3.968	50	40	FHGB	
C[C@H](Oc1ccccc1Br)C(=O)N/N=C/c1cccc(F)c1	1085446	MDHVVNYVILULEH-VSMYLPJWSA-N	365.202	3.506	50	40	FHGB	
COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1Cl	804205	LWVYTNRWIWRGSA-MRXNPFEDSA-N	358.825	3.799	50	40	FHGB	
COc1ccccc1/C=N/NC(=O)c1ccc(NC(=O)c2ccccc2)cc1	1295874	JFBAQSMDFZYRRH-HZHRSRAPSA-N	373.412	3.711	50	40	FHGB	
N#Cc1ccccc1COc1ccc(/C=N/NC(=O)c2ccccc2)cc1	408740304	FKBLMNPQMDRBIC-BUVRLJJBSA-N	355.397	3.901	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)c(Cl)c2)cc1	408791712	BGPGNNHGBQTDNG-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
CC(C)N(C[C@@H]1CCCCN1C(=O)OCc1ccccc1)C(=O)CCl	79392721	PUGGKFNANFVDKO-KRWDZBQOSA-N	366.889	3.654	50	40	FHGB	
Cc1cccc(C(O)(C(=O)NN(C)c2ccccc2)c2cccc(C)c2)c1	824848	CPGUAMKVOPCADF-UHFFFAOYSA-N	360.457	3.707	50	40	FHGB	
O=C(COc1ccc(Cl)cc1Br)N/N=C/c1cccs1	1434813	CPODHBWMXZDQBS-FRKPEAEDSA-N	373.659	3.693	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccc(OC(F)F)cc2OC(F)F)c(C)o1	3356644	HSKMBBUKAUYBSP-QPSGOUHRSA-N	374.290	3.863	50	40	FHGB	
CC(C)c1ccc(NC(=S)NNC(=O)c2c[nH]c3ccccc23)cc1	6514333	HXVYQEMPHWOWJD-UHFFFAOYSA-N	352.463	3.923	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)C2c3ccccc3Oc3ccccc32)cc1	6790203	ODUHCBIANPEZJB-UHFFFAOYSA-N	358.397	3.694	50	40	FHGB	
CN(C)c1ccc([N+](=O)[O-])cc1/C=C(\C#N)C(=O)Nc1ccc(Cl)cc1	409002077	SIMVFHRHRAYOHC-UKTHLTGXSA-N	370.796	3.860	50	40	FHGB	
Cc1cc(NC(=O)/C(C#N)=C/c2cccn2-c2cccc(Cl)c2)no1	61717912	YRVFMMVKWGKHBV-UKTHLTGXSA-N	352.781	3.973	50	40	FHGB	
O=C(CSCc1ccccc1)NN=C1CCN(Cc2ccccc2)CC1	409342459	FEMZUHUGFVMDQJ-UHFFFAOYSA-N	367.518	3.688	50	40	FHGB	
O=C(N/N=C1/C[C@@H]2CC=C[C@H]12)c1cc(-c2ccccn2)nc2ccccc12	32706031	XWJIEOOWGPKFTR-YMLCRBPVSA-N	354.413	3.979	50	40	FHGB	
N#CC1=C(N)N(c2ccccc2C#N)C2=C(C(=O)CCC2)[C@@H]1c1ccsc1	707188	BIGUCKFIBBSIFQ-LJQANCHMSA-N	372.453	3.925	50	40	FHGB	
COc1ccc(Cl)cc1N1C=C(C#N)S(=O)(=O)c2ccc(F)cc21	44167178	UDZCFLZEHNQLIM-UHFFFAOYSA-N	364.785	3.778	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)cc(Cl)c1O	409377545	IGISSTKDPQMHFV-AUWJEWJLSA-N	359.813	3.540	50	40	FHGB	
Cc1oc(-n2c(C)cc(/C=N/NC(=O)c3ccco3)c2C)c(C#N)c1C	409373738	ZRLJMTWKYHHPSQ-UFFVCSGVSA-N	350.378	3.533	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2ccccc2OCCC)cc1OC	6324719	TXTYTHCCRLOJNW-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@H]2C[C@H]3C[C@H](CBr)[C@H]2C3)cc1	256575747	SSOHWXRVPHYKLJ-MXYBEHONSA-N	359.285	3.510	50	40	FHGB	
Cc1ccc(C(=O)Nc2ccccc2C(=O)N/N=C/c2ccccc2O)cc1	58871301	BKEDYTGSENTJCW-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2ccc(N(CC)CC)cc2)cc1OC	3213196	JNPVXZQKYZCENV-PXLXIMEGSA-N	369.465	3.704	50	40	FHGB	
Cc1ccc(N2C[C@@H](C(=O)N/N=C\c3cccc4ccccc34)CC2=O)cc1	409165429	YEDNNLZNQXLZDC-QCYAWUEASA-N	371.440	3.651	50	40	FHGB	
CCc1ccc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1	21555145	XNLUQFXJOVZESB-IFRROFPPSA-N	371.655	3.950	50	40	FHGB	
CC(C)[C@H](Br)C(=O)Nc1nc2ccc(N(C)C)cc2s1	20133502	BFTHXVGTYFSOHB-LBPRGKRZSA-N	356.289	3.720	50	40	FHGB	
C/C(=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc(C)s1	15938415	KYYRXKRGIWLKLU-JWGURIENSA-N	364.470	3.833	50	40	FHGB	
O=C(N/N=C\c1ccccc1O)c1cc2cc(Br)ccc2o1	37501388	SAWNGNVIBFTRQT-NVMNQCDNSA-N	359.179	3.665	50	40	FHGB	
C/C(=N\NC(=O)NCC(F)(F)F)c1ccc(N2CCCCCC2)cc1	98055030	CKECCKLLUYPAOD-LPYMAVHISA-N	356.392	3.653	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cc3ccccc3o2)c(C)n1-c1ccccn1	1103929	PDXYTCAQLVAPHI-YDZHTSKRSA-N	358.401	3.999	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CCC[C@H]2C)[C@@H]1c1ccccc1	35193582	BECKUTVKDLBRRL-LNHNDHHWSA-N	361.445	3.710	50	40	FHGB	
Cc1ccc(C(=O)N/N=C2/C(=O)N(Cc3ccccc3)c3ccccc32)cc1	6404497	POTYNIHKDDVRHP-DARPEHSRSA-N	369.424	3.676	50	40	FHGB	
O=C(Cl)c1cc(Br)c(Br)cc1C(=O)Cl	118483316	CLBYHEINQDKWJN-UHFFFAOYSA-N	360.816	3.970	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)s1)C(=O)N1CCCC1	27056185	ZWOVKRNUHNBIQT-SDNWHVSQSA-N	353.403	3.853	50	40	FHGB	
CC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(OCc2ccccc2C#N)cc1	408815448	WUWGQMCENPNXDK-DORSJAEJSA-N	359.429	3.959	50	40	FHGB	
CC(=O)Oc1ccc([C@@H]2C(C#N)=C(C)NC3=C2C(=O)CC(C)(C)C3)cc1	19805759	ARGWLNOMPXYPQN-LJQANCHMSA-N	350.418	3.739	50	40	FHGB	
O=C(CCSc1ccccc1)N/N=C/c1ccc(N2CCCCC2)o1	409001193	VHLIXKORJHVZQP-HMMYKYKNSA-N	357.479	3.902	50	40	FHGB	
COc1cc(C)ccc1C(=O)N/N=C/c1cc(F)c(N2CCCC2)cc1C	33659585	HZRIYGCJKAKVSU-YDZHTSKRSA-N	369.440	3.815	50	40	FHGB	
O=C/C(=C/Nc1ccc([N+](=O)[O-])cc1O)c1nc2cc(Cl)ccc2o1	5338034	XZJSDUAMZZATGD-CLFYSBASSA-N	359.725	3.747	50	40	FHGB	
Cc1ccc([C@H]2C(C#N)=C(N)S[C@@H](c3ccccc3)[C@@H]2[N+](=O)[O-])cc1	4625401	KBMHVFMSHPQZFZ-KSZLIROESA-N	351.431	3.906	50	40	FHGB	
CO[C@H](c1cc2c(cc1Br)OCO2)[C@@H](C)Br	1602876	CXJZDLJNUKOMEA-KBUNVGBDSA-N	352.022	3.649	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@H]1c1c(F)cccc1F	6813960	AYVLMJGLWYPTDI-CQSZACIVSA-N	350.328	3.573	50	40	FHGB	
COc1ccc(Br)cc1/C=N/NC(=O)c1ccccc1Cl	3167230	DBQFIUPPFYVKMH-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
COc1cc(/C=C(\C#N)c2nc(C)cs2)cc(Br)c1O	8079403	TUYNBQQLXKDUHE-XCVCLJGOSA-N	351.225	3.992	50	40	FHGB	
C[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3F)[C@@H]2C1	13739054	QBQKOQFOCNSULL-BKGUAONASA-N	350.372	3.804	50	40	FHGB	
O=C(CN1CCCc2ccccc21)N/N=C/c1c(Cl)cccc1Cl	8124871	LUAIJEABNXOBAU-SRZZPIQSSA-N	362.260	3.896	50	40	FHGB	
C=CCN1C(=O)/C(=N/NC(=O)c2ccc(Cl)cc2Cl)c2ccccc21	18100329	ILPDGUQJDAXRSH-LTGZKZEYSA-N	374.227	3.660	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OC(F)F	6209460	BOOKJHJIEWHGNL-OQLLNIDSSA-N	358.344	3.520	50	40	FHGB	
Cc1cc(N2CCCC2)c(F)cc1/C=N/NC(=O)c1cccc(N(C)C)c1	6571364	VHECJRGQNDPMRK-OEAKJJBVSA-N	368.456	3.564	50	40	FHGB	
CCC1=C(C(=O)OC)[C@@H](c2c(Cl)cccc2Cl)C(C#N)=C(N)O1	4652917	SFRVUXHENOVFPH-GFCCVEGCSA-N	353.205	3.638	50	40	FHGB	
CCSC1=C(C#N)[C@@H](c2ccc(Cl)cc2)[C@H](C(=O)OC)C(O)=N1	9089484	WKEUIGQOEPOIBX-OLZOCXBDSA-N	350.827	3.671	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1)C(=O)N1CCCC1	9235571	HZOYFRUOEXCJFV-UKTHLTGXSA-N	370.792	3.828	50	40	FHGB	
COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2cc(Cl)ccc2OC)cc1	408815547	RQNWUBRUTCLKQC-NTEUORMPSA-N	370.792	3.681	50	40	FHGB	
COc1cc(OC)c(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1Cl	408586384	BPGKRVSTMKSLQV-KEBDBYFISA-N	367.232	3.703	50	40	FHGB	
C=CCOc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1OC	408856286	QAFFSUGCRIWXGK-BKUYFWCQSA-N	350.374	3.770	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)cc1Cl	6033630	FEPKLWHWWBHSDK-FBCYGCLPSA-N	351.189	3.794	50	40	FHGB	
CCOc1ccccc1[C@H]1C(C#N)=C(N)Nc2oc(-c3ccccc3)nc21	12412467	YYOLERIXFUQUHP-KRWDZBQOSA-N	358.401	3.992	50	40	FHGB	
O=C1Nc2ccccc2/C1=N\NC(=O)c1ccc(-c2cccs2)s1	18205711	UJORYLSYDYWTOW-UHFFFAOYSA-N	353.428	3.563	50	40	FHGB	
CO[C@@H](C(=O)N/N=C(\C)CC(=O)Nc1ccc(Cl)cc1)c1ccccc1	100923050	KNPUDCMVFUKPQM-MNOULKQQSA-N	373.840	3.548	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1cccc(C)c1	59333709	WZZFSKWSTREIMX-WQRHYEAKSA-N	350.418	3.578	50	40	FHGB	
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N/N=C/c1ccc(N(C)C)cc1	1458033	DYPLQNPFLFZIDU-OMBDHMDGSA-N	359.857	3.632	50	40	FHGB	
CN1CCC(=NNC(=O)c2ccc(CSc3ccccc3)cc2)CC1	58189436	SHNLKOMNFRERDH-UHFFFAOYSA-N	353.491	3.790	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)NNC(=S)Nc1ccccc1	2562209	CPPVLWAKCMWANE-LLVKDONJSA-N	365.911	3.838	50	40	FHGB	
CCOC(=O)c1cccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)c1	4682189	HZVDICUWPFFQON-UDWIEESQSA-N	368.414	3.949	50	40	FHGB	
CC(C)(C)CC(=O)N1CCC(=NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	60419135	VYBPBOBSKVCVSE-UHFFFAOYSA-N	373.541	3.734	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N/NC(=O)Cc3ccccc3)o2)cc1C(=O)O	408854610	JFXRRANYRKUXJE-LPYMAVHISA-N	362.385	3.646	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2ccccc2OCC(=O)O)cc1Cl	408991638	QTUZCVRDTBKOHC-ZSOIEALJSA-N	370.792	3.658	50	40	FHGB	
CC(C)N(C(=O)CCl)[C@@H]1CCCC[C@H]1NC(=O)OCc1ccccc1	79392739	ZCWLYRNUEUDMNZ-IAGOWNOFSA-N	366.889	3.700	50	40	FHGB	
FC(F)(F)c1nnc2sc(-c3ccc(CBr)cc3)nn12	73634510	CSEGUQXRZJTTRV-UHFFFAOYSA-N	363.162	3.767	50	40	FHGB	
CN(C)/C(=N/[C@H](NC(=O)c1ccccc1)C(Cl)Cl)c1ccccc1	3124283	JXZYFJPHAPENAS-WFOVFMPGSA-N	364.276	3.555	50	40	FHGB	
COc1cc(C)c(C=NNC(=O)c2ccc(NC(C)=O)cc2)cc1C(C)C	1531373866	DVDMMDQURSEUTC-UHFFFAOYSA-N	367.449	3.849	50	40	FHGB	
Cc1cccc(C(=O)N/N=C2\C(=O)N(Cc3ccccc3)c3ccccc32)c1	5519693	FNSRKRRNSQRMIP-FLFQWRMESA-N	369.424	3.676	50	40	FHGB	
CCOC(=O)[C@H]1C[C@@H](Cl)[C@H](Sc2ccccc2)C[C@@H]1C(=O)OCC	36550941	AUTVLJMYUKTMEB-CAOSSQGBSA-N	370.898	3.907	50	40	FHGB	
CCN(CC)C(=O)[C@@H](Br)[C@@H](Br)c1ccccc1	1690347	ZNLSNPVEZHLCGQ-RYUDHWBXSA-N	363.093	3.755	50	40	FHGB	
C#C/C=C\C[C@@H](OC(C)=O)[C@H]1C/C=C/C[C@@H](Br)[C@@H](CC)O1	101043578	ZFYWONYUPVGTQJ-SYKIFSCYSA-N	355.272	3.775	50	40	FHGB	
COc1ccc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C(C)C)c32)c2ccccc12	8382693	QNKVSTPZQSCMQG-QGZVFWFLSA-N	360.417	3.913	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccccc1C)OCO2	409105392	NCRNGDLPCAEKLK-OVCLIPMQSA-N	350.374	3.668	50	40	FHGB	
Cc1cccc(C)c1OCC(=O)N/N=C/c1cc(Cl)cc(Cl)c1O	4616574	CWZQDPCRHOHJLD-DNTJNYDQSA-N	367.232	3.845	50	40	FHGB	
COc1cc(OC)c(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc1Cl	408799439	ZHEKJGHJUAMKJC-KPKJPENVSA-N	358.781	3.608	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C\c2cc(OC)c(OC)cc2C)c1	78326117	WTULBGYPHNANEP-DHDCSXOGSA-N	352.390	3.567	50	40	FHGB	
N#C/C(=C/c1c[nH]c2ccccc12)C(=O)NCCc1c[nH]c2ccccc12	96540764	GTAUCQQATUYSFF-WJDWOHSUSA-N	354.413	3.915	50	40	FHGB	
C[C@]12CC[C@@H]3[C@H](CC[C@H]4CCCC[C@@]43C)[C@@H]1CC/C2=N\NC(=O)C(=O)O	253497813	CTISYMLRZAHCNS-XULWAFLCSA-N	360.498	3.976	50	40	FHGB	
COc1ccc(-c2nc3cc(NC(=O)CSC#N)ccc3o2)cc1OC	226328087	QUOFEXNOJBXMIE-UHFFFAOYSA-N	369.402	3.665	50	40	FHGB	
N#C/C(=C\c1ccccc1Sc1ccc(Cl)cc1)C(=O)NC(N)=O	409232397	OSDFVQPRYDZYBL-FMIVXFBMSA-N	357.822	3.593	50	40	FHGB	
CC[C@]1(C)Cc2c(sc(NC(=O)[C@H](C)Br)c2C#N)CO1	4311719	TXVLOHFDOKENJV-RMLUDKJBSA-N	357.273	3.583	50	40	FHGB	
O=C(CCSc1ccc(Cl)cc1)N/N=C/c1ccccc1[N+](=O)[O-]	5205614	PSHRZTODPILUIP-WOJGMQOQSA-N	363.826	3.881	50	40	FHGB	
O=C(CCn1c2c(c3ccccc31)CCCC2)N/N=C\c1ccc(O)cc1	32559979	INZUMENFTOXRJQ-HAHDFKILSA-N	361.445	3.766	50	40	FHGB	
N#C/C(=C\c1ccc(Sc2ccccc2)o1)C(=O)NC[C@H]1CCCO1	1052804	XLFGSUOYEJLNOT-WSYSLRRZSA-N	354.431	3.633	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)CSc2nc3ccccc3[nH]2)cc1	59417033	KTCLWHNCOGCPQP-LPYMAVHISA-N	368.462	3.594	50	40	FHGB	
N#C/C(=C\c1cccn1-c1cccc(C(=O)O)c1)C(=O)Nc1ccccc1	4675635	FTRWFSVVETZJKP-DTQAZKPQSA-N	357.369	3.721	50	40	FHGB	
CCN1c2ccc(/C=N/NC(=O)c3cccnc3)cc2[C@@H](C)CC1(C)C	223528678	DJEWPXQAMUKCGH-LUILSVGHSA-N	350.466	3.958	50	40	FHGB	
O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1cccs1)c1ccncc1	1035392	PWDGBFZGNFZPBM-LPYMAVHISA-N	373.441	3.760	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=N/NC(=O)c2cccs2)cc1OCC	14134814	MAJPCHPJQHJTPY-YBFXNURJSA-N	362.838	3.576	50	40	FHGB	
O=C(NNC(=O)c1ccncc1)Nc1ccc(/N=N/c2ccccc2)cc1	17301348	YYLHEUPZZJYOAG-GHVJWSGMSA-N	360.377	3.964	50	40	FHGB	
O=C(N/N=C\c1c(F)cccc1Cl)c1cc(-c2ccc(F)cc2)n[nH]1	13923907	HOIMNAFTXNXNLK-NKVSQWTQSA-N	360.751	3.772	50	40	FHGB	
CCOc1ccc(-c2csc(NNC(=O)c3ccc(OC)cc3)n2)cc1	1415045	XCSJJIJMBAWQTH-UHFFFAOYSA-N	369.446	3.974	50	40	FHGB	
C[C@@]1(Br)C[P@@](=O)(c2ccccc2)C[C@@H]1Br	4777441	WLMNWAODWCNVJT-FIXISWKDSA-N	352.006	3.606	50	40	FHGB	
CCN(NC(=O)c1cc(C(C)C)nc2c1c(C)nn2C)c1ccc(C)cc1	58380579	IWKZOZACKLBWBB-UHFFFAOYSA-N	365.481	3.880	50	40	FHGB	
COc1cc(Cl)cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)c1O	408962067	GGYFACKHMTXLRM-ODCIPOBUSA-N	372.730	3.837	50	40	FHGB	
C=CCOc1c(CC=C)cc(/C=C(/C#N)C(=O)NC(C)C)cc1OCC	408787338	YBRLXASHBZTBHP-PDGQHHTCSA-N	354.450	3.810	50	40	FHGB	
Cc1cc(C)cc(Oc2nc3c(C)cccn3c(=O)c2C=C(C#N)C#N)c1	5563034	HFRBUJCLZBCAIR-UHFFFAOYSA-N	356.385	3.843	50	40	FHGB	
O=C(N/N=C\c1cccc(Cl)c1)c1n[nH]c2c1CCc1ccccc1-2	33402711	BVMZLZFBCCNLDS-NHDPSOOVSA-N	350.809	3.593	50	40	FHGB	
O=C(N/N=C\c1cccn1-c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1	32220693	LEZGUXHXKOUQGZ-NDENLUEZSA-N	368.780	3.803	50	40	FHGB	
CCCCn1nc(C)c(NC(=O)c2ccccc2NC(=O)CCl)c1C	14405605	ZAAQGUPRWBHMMJ-UHFFFAOYSA-N	362.861	3.730	50	40	FHGB	
COc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cccc2ccccc12	5512846	MCZXNVSZGZULLG-WOJGMQOQSA-N	358.397	3.820	50	40	FHGB	
COc1ccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C#N)cc1[N+](=O)[O-]	3188079	IKLQZWNKEBJMTG-UHFFFAOYSA-N	371.356	3.887	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)o1)c1cccc(Br)c1	9668307	UXHYILHJHZZFDI-VIZOYTHASA-N	372.016	3.569	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1	408719701	KFTDTZSDWIFABL-XMHGGMMESA-N	357.435	3.677	50	40	FHGB	
CCc1ccccc1NC(=O)/C(C#N)=C\c1ccc(O[C@@H](C)C(=O)O)cc1	408854465	GGJDPYDXHCRKQC-VMOJBDSFSA-N	364.401	3.647	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)c1O	408965193	ULKWIZXHLVABRG-UFFVCSGVSA-N	352.312	3.574	50	40	FHGB	
C[C@@H]1CC(C)(C)N(C)c2ccc(/C=N/NC(=O)c3ccc(O)cc3)cc21	208207678	MYBJIYOHWRWHQL-CYGNYLSHSA-N	351.450	3.878	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)C(=O)NCc1ccco1	2441848	UZKPQDRDOCZCHH-JLHYYAGUSA-N	363.329	3.671	50	40	FHGB	
C=CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)cc1OC	59116767	XIHWBFLPTPQHNT-PTNGSMBKSA-N	352.365	3.945	50	40	FHGB	
O=C(N/N=C/c1cccnc1)c1cc(-c2ccc(Cl)c(Cl)c2)[nH]n1	18129168	TZIMIEKJSYWUBB-AWQFTUOYSA-N	360.204	3.542	50	40	FHGB	
COc1ccc(/N=C(/NNC(=O)Nc2ccccc2)C(F)(F)F)cc1	4808626	JVIOVCWAQSGIPB-UHFFFAOYSA-N	352.316	3.614	50	40	FHGB	
N#C/C(=C\c1cc(Cl)ccc1OCC(=O)O)c1ccc([N+](=O)[O-])cc1	409040676	HMJDSMOPBIQUMG-NTUHNPAUSA-N	358.737	3.776	50	40	FHGB	
O=C(N/N=C\c1cccc(OC(=O)c2cccs2)c1)c1ccc(F)cc1	30822028	QMYOLYOGYUZGCG-MTJSOVHGSA-N	368.389	3.870	50	40	FHGB	
C/C(CC(=O)NCC(C)C)=N\NC(=O)Cc1ccc(-c2ccccc2)cc1	4402128	UEEMBWMBLUXASZ-JJIBRWJFSA-N	365.477	3.551	50	40	FHGB	
ClCCN(CCCl)c1ccc(/C=N/Nc2cc(Cl)ncn2)cc1	104385404	KHJAYJGGBGZHOZ-UFFVCSGVSA-N	372.687	3.860	50	40	FHGB	
CCCCOc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1OC	4548505	CZYUEOGOVRDEBS-IBGZPJMESA-N	368.433	3.689	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)c(O)c1	5736200	FOFVUIIGFAUJLW-RVDMUPIBSA-N	353.397	3.923	50	40	FHGB	
CC(C)c1ccc(-c2nc(C(=O)NNC(=O)c3ccco3)cs2)cc1	12917420	ZWCUKYBAMSQFMR-UHFFFAOYSA-N	355.419	3.601	50	40	FHGB	
CCN(Cc1ccccc1)c1ccc(/C=N/NC(=O)c2ccccn2)cc1	6318680	VEUPECYLLLOUFE-LFVJCYFKSA-N	358.445	3.872	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2c[nH]nc2-c2cccc(OC)c2)cc1	40146083	CBCKHTZUHSZTHS-XNTDXEJSSA-N	374.400	3.640	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)c(OC)c2)cc1	1079108	PFJOAQMOGMUUFC-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COC(=O)c1ccc(Cl)cc1)C2	35511001	PDRWFLPJHGZQSH-RUIXMYMFSA-N	362.857	3.815	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1C	13546464	YHAWTDJGRMZMQD-LDADJPATSA-N	359.429	3.751	50	40	FHGB	
O=C(N[C@H](CSc1ccccc1)[C@@H](O)CCl)OCc1ccccc1	78134153	YMCLVAZUQJPLTE-SJORKVTESA-N	365.882	3.673	50	40	FHGB	in-vitro
COc1cccc(NC(=O)/C(C#N)=C/c2ccc(O)c(Br)c2)c1	23723702	UXZXWSOJIWGEND-KPKJPENVSA-N	373.206	3.709	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=N/NC(=O)c3ccccc3OC)c2c1	409018146	XSOATEPYZBNPHY-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
COc1ccc(-n2cccc2/C=N/NC(=O)c2cccc(Cl)c2)cc1	408949673	BSWACVXCXVMXSP-FYJGNVAPSA-N	353.809	3.903	50	40	FHGB	
CCN(NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2)c1ccc(C)cc1	14941241	VFHCUQMRJDCJQS-ZDUSSCGKSA-N	355.463	3.599	50	40	FHGB	
O=c1nc2n(nc1-c1ccccc1)[C@H](C(Cl)Cl)Nc1ccccc1-2	1775971526	RZRSDWMPVAEHCP-MRXNPFEDSA-N	359.216	3.700	50	40	FHGB	
O=C(CC(=O)Nc1ccc(Cl)c(Cl)c1)N/N=C/c1ccccc1F	3093581	DCSRIPXNGXUABG-AWQFTUOYSA-N	368.195	3.611	50	40	FHGB	
CC[C@H]1CCC2=C(C1)[C@H](c1ccccc1)[C@@](C#N)(C(=O)OC)C(N)=C2C#N	16636821	YQRJFHQSMAWMSZ-OSGPJOMKSA-N	361.445	3.710	50	40	FHGB	
Cc1ccc(-c2nnc(NC(=O)[C@@H](Br)C(C)C)s2)cc1	4070337	OAJKBTVBEVAEST-NSHDSACASA-N	354.273	3.872	50	40	FHGB	
O=C(Cc1ccc(Cl)c(Cl)c1)NNC(=O)c1ccccc1Cl	2653773	CYXVQHPZAAACML-UHFFFAOYSA-N	357.624	3.651	50	40	FHGB	
O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccc(Cl)cc1	107545586	YAUKDZMDAMISFA-SSDVNMTOSA-N	363.804	3.604	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)c([N+](=O)[O-])c2)c1	408740262	FFCIATQBMJMQAY-NTEUORMPSA-N	367.361	3.548	50	40	FHGB	
C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1ccc(Cl)cc1Cl	5164230	CJAIZEIBHRLHRM-OVEPSTSESA-N	365.216	3.674	50	40	FHGB	
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CCl)cc1OC	72413341	GZBIFDCOYSBXDA-INIZCTEOSA-N	358.825	3.620	50	40	FHGB	
COc1ccc(Br)cc1/C=N\NC(=O)c1cc2ccccc2o1	83319759	ANQIGNPSHIFDHH-GRSHGNNSSA-N	373.206	3.968	50	40	FHGB	
N#C/C(=C\c1cn(CCOc2ccccc2)c2ccccc12)C(=O)NC1CC1	872842	IGSQHFHSYWNDQZ-SAPNQHFASA-N	371.440	3.906	50	40	FHGB	
O=C(NNc1nc2c(Cl)cccc2s1)c1coc2ccccc2c1=O	4121367	FLDWXDYKPGZLJH-UHFFFAOYSA-N	371.805	3.813	50	40	FHGB	
CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C\c1cccc(Cl)c1)CO2	28616219	DUPDWHNSDQHQSM-DSDJNCIMSA-N	372.852	3.928	50	40	FHGB	
CCOc1ccc(-c2n[nH]c3c2[C@@H](c2ccc(C)o2)C(C#N)=C(N)O3)cc1	4453081	NMLIDKOFHYILBY-MRXNPFEDSA-N	362.389	3.595	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C\C=C\c2ccc(Br)cc2)cc1	4893920	ORHAJJFSDXVZCS-WKBWTQNVSA-N	372.266	3.985	50	40	FHGB	
CCOc1ccc(/C=C/C(=C(\C#N)C(N)=C(C#N)C#N)C2CC2)c(OCC)c1	104050002	IGSRPWQBWLSJJF-RXYHETPMSA-N	374.444	3.987	50	40	FHGB	
O=C(CSc1nc2ccccc2o1)N/N=C/c1c(F)cccc1Cl	1478005	LAGYFDONCHMQMH-UFWORHAWSA-N	363.801	3.863	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(C)cc1)c1ccc(Br)s1	4598930	NHGYATPWKKEZPD-GZTJUZNOSA-N	367.268	3.738	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2cccc(C)c2)ccc1OC(C)=O	408765917	RQXAVAVHSYIEKR-GZTJUZNOSA-N	364.401	3.865	50	40	FHGB	
C[C@H]1[C@@H](c2ccc3c(c2)OCO3)C[C@H](Cl)C[C@@]12C=C1OCOC1=CC2=O	5664288	IDIAWFXBAIWWNZ-VMLLCUDRSA-N	374.820	3.877	50	40	FHGB	
O=N[C@@H]1[C@H](Cl)[C@H]2C[C@@H]1[C@@H]1[C@H]2C[C@H](Br)[C@@H]1Br	4726388	RTOAGUKGFNBCKI-LDTLVHTGSA-N	357.473	3.542	50	40	FHGB	
CCOC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccc(C)o3)o2)cc1	408727137	XMPYTPBQYIJYOT-CIAFOILYSA-N	366.373	3.789	50	40	FHGB	
CCOC(=O)NNC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12	12765059	UJUJLSWAWXTCMN-UHFFFAOYSA-N	369.808	3.946	50	40	FHGB	
O=C(N/N=C/C=C/c1ccccc1[N+](=O)[O-])c1cccc(Br)c1	9668348	MSRTVNLOCYKXKC-UOMISXDJSA-N	374.194	3.786	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccccc1[N+](=O)[O-]	408599352	SXJJKOOQWRPLSS-FYJGNVAPSA-N	363.373	3.911	50	40	FHGB	
O=C(O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccc(F)cc3)o2)c1	36046902	LZZCJXBDKZMILZ-SRZZPIQSSA-N	352.321	3.548	50	40	FHGB	
O=C(CCl)Nc1cc2c(cc1C(=O)c1ccccc1Cl)OCCO2	1438286	OHKIFOCHRMWMJZ-UHFFFAOYSA-N	366.200	3.520	50	40	FHGB	
CCOC(=O)c1sc(NC(=O)/C(C#N)=C/c2ccccc2)c(C#N)c1C	1965071	NMIBHQZOHFWPHU-NTEUORMPSA-N	365.414	3.651	50	40	FHGB	
O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1ccco1)c1cccs1	1016671	LRFYSESMFLZXNV-UDWIEESQSA-N	362.414	3.958	50	40	FHGB	
C=C1C(C)(C)[C@H]2CC[C@]1(C(=O)NNC(=O)[C@@]13CC[C@H](C1)C(C)(C)C3=C)C2	100261574	HFZJKRKZPFNURH-KFVVBQDRSA-N	356.510	3.899	50	40	FHGB	
C/C(=N\NC(=O)CN[C@H](C)c1ccccc1)c1ccc2ccccc2c1O	38333553	KUDLKJUFPYSPQD-DSDXLYQOSA-N	361.445	3.736	50	40	FHGB	
O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1c(F)cccc1F	6286744	QIPKBKXFFJVDEY-LIMNOBDPSA-N	357.282	3.546	50	40	FHGB	
CCOc1ccccc1OCC(=O)N/N=C/c1ccc(Cl)c(Cl)c1	5467304	MRKGHVQRDMJFES-KEBDBYFISA-N	367.232	3.921	50	40	FHGB	
Cc1c(/C=N\NC(=O)COc2cccc3cccnc23)c2ccccc2n1C	408856676	JOYSVFQGTVCLMU-CFRMEGHHSA-N	372.428	3.564	50	40	FHGB	
N#C/C(=C/c1cc(Cl)c(O)c(Br)c1)C(=O)NC1CCCC1	409189776	IPSNFNOTOIROJU-YHYXMXQVSA-N	369.646	3.774	50	40	FHGB	
O=C(N/N=C\c1cn(Cc2ccccc2F)c2ccccc12)c1ccncc1	33350136	OCPMTXZOGPSSBD-MXAYSNPKSA-N	372.403	3.988	50	40	FHGB	
Cc1cc(-c2ccc(C=NNC(=O)c3ccncc3)o2)c([N+](=O)[O-])cc1C	254296433	FUUIGKHJPIIKRS-UHFFFAOYSA-N	364.361	3.631	50	40	FHGB	
CC[C@@H]1CCC2=C(C1)[C@@H](c1ccccc1)[C@](C#N)(C(=O)OC)C(N)=C2C#N	254761931	YQRJFHQSMAWMSZ-WTGRHJARSA-N	361.445	3.710	50	40	FHGB	
Cn1cccc1CC(=O)N/N=C\c1cn(Cc2ccccc2)c2ccccc12	71335818	MWYLXDDFXPJDNT-IWIPYMOSSA-N	370.456	3.721	50	40	FHGB	
O=C(CSCc1ccccc1Cl)N/N=C/c1ccccc1[N+](=O)[O-]	3081648	HYSXATIQHGMDTK-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
C=CCc1cccc(/C=N/NC(=O)COc2c(C)cc(C)cc2C)c1O	847784	RZPFQJWXPJJMAC-WSDLNYQXSA-N	352.434	3.575	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1cc(Br)c(OCC)c(OCC)c1	6354891	VKDPMBPBGCZRNN-KPKJPENVSA-N	368.227	3.717	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)N2CCOCC2)c(C)n1-c1cccc(Cl)c1	57537777	USEHECVHIGDERR-BOPFTXTBSA-N	369.852	3.513	50	40	FHGB	
CN(C)c1ccc(/C(=N/NC(=O)c2ccc(O)cc2)c2ccccc2)cc1	787765	DPLNWXMMSVHTJS-XTQSDGFTSA-N	359.429	3.641	50	40	FHGB	
OC[C@]1(C#CCCCCl)COc2ccccc2N1Cc1ccccc1	306145459	FWPWOBFBMNAKCG-OAQYLSRUSA-N	355.865	3.839	50	40	FHGB	
CCc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2OC)cc1[N+](=O)[O-]	3421554	DIZIIXXCAOSXNA-XNTDXEJSSA-N	351.362	3.711	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2c(OC)ccc3ccccc23)cc1OC	3576466	PMWCHJUIMVWFJX-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2ccc(Cl)c([N+](=O)[O-])c2)cc1	215880940	ZVAKCISYVBUURG-WQLSENKSSA-N	357.753	3.802	50	40	FHGB	
CCn1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c2ccccc21	408541690	HHCQPDFKZOKFNE-GDNBJRDFSA-N	359.385	3.905	50	40	FHGB	
CCOc1cc(C(=O)N/N=C2/C[C@H]3C=CC[C@H]23)cc(OCC)c1OCC	5463660	KVNSPZJFCLHDFD-JLTGNURUSA-N	358.438	3.565	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C\c2cc(Cl)cc([N+](=O)[O-])c2O)c1	408743880	CDPSVBWOADUWSQ-SDQBBNPISA-N	357.753	3.808	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2cc3cc(C)cc(C)c3[nH]c2=O)cc1	41074233	PIXIEOSXBQODSK-GZTJUZNOSA-N	373.412	3.699	50	40	FHGB	
N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3)ccc2[C@@H]1c1ccncc1	1775977009	VIIJPNKZLDVKPE-FQEVSTJZSA-N	369.380	3.519	50	40	FHGB	
COc1cccc(C(=O)N/N=C(\CC(=O)c2cccs2)C(F)(F)F)c1	5720960	KGFQROXLQDQBIQ-XSFVSMFZSA-N	370.352	3.678	50	40	FHGB	
CCCCCC(=O)Nc1ccc(C(=O)N/N=C/c2cccc(OC)c2)cc1	3083559	YXXOQNCJANEVBI-PXLXIMEGSA-N	367.449	3.978	50	40	FHGB	
COc1cc(/C=N/NC(N)=O)ccc1OCc1ccc(Cl)cc1Cl	2768056	LQYHCMLJASLCLD-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(F)cc3[N+](=O)[O-])o2)o1	409041227	ZTVOGUSHSSAKFO-DJKKODMXSA-N	357.297	3.659	50	40	FHGB	
CC(C)(C)c1ccc([C@@H]2C[C@H]2C(=O)N/N=C\c2ccc(O)c(O)c2)cc1	30738463	YSMQCTMMMJDQNV-KEFQVJQSSA-N	352.434	3.649	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1c[nH]nc1-c1ccc(Cl)cc1	20410699	UQJUFVROUHKHIF-CIAFOILYSA-N	352.825	3.813	50	40	FHGB	
Cc1c(Cl)cccc1N1C[C@@H](C(=O)Oc2ccc([N+](=O)[O-])cc2)CC1=O	7929280	HIUBMJZHDKBABN-LBPRGKRZSA-N	374.780	3.515	50	40	FHGB	
COc1cc(Cl)c(C)cc1NC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2	33466654	OKWSTZVGLXIEGE-MLPAPPSSSA-N	370.792	3.931	50	40	FHGB	
Cc1ccnc(-n2c(C)cc(/C=N\NC(=O)Cc3ccc(F)cc3)c2C)c1	409221199	MMFILYOCDRFKLM-CFRMEGHHSA-N	364.424	3.629	50	40	FHGB	
COc1ccc(-n2cccc2/C=N/NC(=O)c2ccc(Cl)cc2)cc1	408949956	CROIJJKLZVBXSX-FYJGNVAPSA-N	353.809	3.903	50	40	FHGB	
COc1ccc([C@@H]2C3=C(CCCCC3)C(C#N)=C(N)C2(C#N)C#N)cc1OC	36611880	LXHZTPSOWXXKIG-HXUWFJFHSA-N	374.444	3.832	50	40	FHGB	
Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3ccc(F)s3)cc2)n1	252485318	GRCXOPYCILUCGT-KEBDBYFISA-N	356.426	3.513	50	40	FHGB	
O=C(N/N=C/C=C/c1ccccc1)c1ccc(NC(=O)c2ccco2)cc1	6337478	CELGKOCTGPTPOW-CZROTQKJSA-N	359.385	3.961	50	40	FHGB	
COc1ccc(-n2nc3c(c2NC(=O)CCCCl)CSC3)cc1	4223300	LXGVYPODYWQUAR-UHFFFAOYSA-N	351.859	3.585	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CSc2ccc(C)cc2)cc1OC	8515869	NTEXYDJFUQCFEL-FYJGNVAPSA-N	370.474	3.811	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)CNc1ccc(C)cc1	57611093	GBYMWUFAUUDSAL-MFKUBSTISA-N	371.440	3.722	50	40	FHGB	
Cc1cc(C)c(OCC(=O)N/N=C/c2ccccc2OC(F)F)c(C)c1	3196625	WEXDDKDLDCIYCY-LSHDLFTRSA-N	362.376	3.742	50	40	FHGB	
CCCOc1ccc2ccccc2c1/C=C(\C#N)C(=O)NC[C@H]1CCCO1	408735493	SSRPZWVASZVIQA-VJSYINPZSA-N	364.445	3.831	50	40	FHGB	
O=C(O)c1ccc(-n2cccc2/C=N/NC(=O)c2ccccc2Cl)cc1	409235316	BEBVKOWMCFNYCW-CIAFOILYSA-N	367.792	3.593	50	40	FHGB	
Cc1cc(C)cc(OCn2ccc(C(=O)N/N=C/c3ccc(F)s3)n2)c1	252508867	XWGFPCFYLZLKSK-KEBDBYFISA-N	372.425	3.501	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)OC(C)C)cc2)o1	841410	DWGZBDKVBDQIQY-LFIBNONCSA-N	353.374	3.982	50	40	FHGB	
Cc1ccc(S(=O)(=O)N2C[C@H](CCl)Sc3ccccc32)cc1	5545571	LUJVYRBRCLXFFN-ZDUSSCGKSA-N	353.896	3.903	50	40	FHGB	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccoc3)c3ccccc3n2)cc1	17198425	SAABHVBRGFRSNA-UHFFFAOYSA-N	371.396	3.878	50	40	FHGB	
O=C(N/N=C/c1ccc2ccccc2c1)c1cncc(Br)c1	1234866	VCDYOBQXMMOBHU-AWQFTUOYSA-N	354.207	3.761	50	40	FHGB	
COc1ccc([C@H]2CC(=O)NC(SCc3ccccc3)=C2C#N)cc1	2502295	IITYCOFFWBOQOQ-QGZVFWFLSA-N	350.443	3.967	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2sccc2C)c(Br)c1	672016	QZDMEJRCJICTIE-CAOOACKPSA-N	367.268	3.657	50	40	FHGB	
Cc1ccccc1C(=O)Nc1ccc(C(=O)N/N=C/c2ccccc2O)cc1	1434600	VNTKGYZFJMGFSS-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
CC(C)CC(=O)NNC(=O)c1ccccc1OCc1ccc(Cl)cc1	10160437	UJHQTSFNRVILSR-UHFFFAOYSA-N	360.841	3.726	50	40	FHGB	
C[C@H](Sc1nncs1)C(=O)NN=C(c1ccccc1)c1ccccc1	48209266	OZCJHFSGONXDLJ-ZDUSSCGKSA-N	368.487	3.588	50	40	FHGB	
CCc1ccc(OCC(=O)N/N=C(\C)c2ccc(OC(F)F)cc2)cc1	4979820	NIYFAHYNHVNYPF-LPYMAVHISA-N	362.376	3.770	50	40	FHGB	
CCOC(=O)COc1ccc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)cc1	408569265	ZWPJPIOZODLHEH-ZROIWOOFSA-N	365.364	3.708	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(F)cc3)o2)c(O)c1	409392019	MXVCOHGRCKPDJN-SRZZPIQSSA-N	354.337	3.564	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CSc2ccc(Cl)cc2)ccc1O	894632	GXHYYCMFMAFADN-VXLYETTFSA-N	364.854	3.687	50	40	FHGB	
COc1ccc2c(Cl)c(C(=O)NNC(=O)c3cccs3)sc2c1	674963	MQINTDWESPFOQU-UHFFFAOYSA-N	366.851	3.700	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C(\C)c2ccc(OCC)c([N+](=O)[O-])c2)cc1	20764267	DECAIDUQZIPHPY-DEDYPNTBSA-N	371.393	3.546	50	40	FHGB	
Cc1cc(C)cc(CSCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])c1	59473473	JQOKBVNSPQGAED-VXLYETTFSA-N	357.435	3.595	50	40	FHGB	
COc1ccc(/C(C)=N\NC(=O)c2cc(-c3ccccc3Cl)n[nH]2)cc1	8462306	PNYGKNFLMQZBER-MTJSOVHGSA-N	368.824	3.893	50	40	FHGB	
N#C/C(=C\c1cn[nH]c1-c1ccc(Cl)cc1)C(=O)NCc1ccccc1	8581171	FRLJNOCSPOFVBP-MHWRWJLKSA-N	362.820	3.953	50	40	FHGB	
Cc1cc(C)cc(NC(=O)/C(C#N)=C\c2ccc(O[C@@H](C)C(=O)O)cc2)c1	408848202	QQMJJAPRMKMBMR-ZCQLHAAUSA-N	364.401	3.701	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc(Cl)c1O	408962589	IFKZKRYDOWLYTD-ODCIPOBUSA-N	372.730	3.837	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cc(C)cc(C)c1)OCO2	409072331	UZILMIQEWYJJEF-VIZOYTHASA-N	350.374	3.586	50	40	FHGB	
Cc1oc(C)c2c(=O)ccc3c(c12)OC(N)=C(C#N)[C@H]3c1ccc(F)cc1	2408686	YCUAREVJXGUQIY-IBGZPJMESA-N	362.360	3.767	50	40	FHGB	
COc1ccc(SCC(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1	59104078	WVDLNFLUNGKNCK-KGENOOAVSA-N	369.490	3.538	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)[C@@H](C)SCc2ccccc2)cc1OC	20249059	ZPJPUCKVDIMNID-HFITWMCCSA-N	372.490	3.866	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1ccc(F)cc1)c1ccccc1	408996994	KXUYARQIKPBQSV-OEAKJJBVSA-N	361.376	3.842	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N/NC(=O)[C@@H](O)c3ccccc3)c2C)cc1	408589299	LFSVFQWINRFBRE-VSIOZEBNSA-N	361.445	3.586	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc1Cl	408788418	JYMQTDMJFCBGKF-GXDHUFHOSA-N	352.777	3.603	50	40	FHGB	
N#CCOc1ccc2ccccc2c1/C=C(\C#N)C(=O)NCc1ccco1	408928033	UUJNNRXLFVAHMC-FOWTUZBSSA-N	357.369	3.559	50	40	FHGB	
Cc1ccc(NC(=O)C(=O)N/N=C/c2c(Cl)cccc2Cl)cc1C	7782342	TVXALVZXYSWPAU-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(O[C@H](C)C(=O)O)cc2)cc1C	59249695	VJXISLOGQBTYRT-QJISPJEISA-N	364.401	3.701	50	40	FHGB	
O=C(N/N=C/c1ccccc1Oc1ccccc1[N+](=O)[O-])c1ccncc1	1496633	XWDBVLONBMSSFJ-FYJGNVAPSA-N	362.345	3.546	50	40	FHGB	
C=CCOc1ccc(OC)cc1/C=N/NC(=O)CSc1ccccc1	2166368	FHFHBBCBHJQPRE-DEDYPNTBSA-N	356.447	3.502	50	40	FHGB	
O=C(CNc1ccc(Br)cc1)N/N=C/c1ccc(Cl)cc1	3153376	BQLOYJAFUUMSMC-DJKKODMXSA-N	366.646	3.665	50	40	FHGB	
CCCS[C@]1(c2ccc(Cl)cc2)OC(N)=C(C#N)C1=C(C#N)C#N	100249674	SCRKKHWSVMMPKM-KRWDZBQOSA-N	356.838	3.704	50	40	FHGB	
O=S(=O)(Cc1ccccc1)[C@H](I)c1ccccc1	1733325	ZZBNUHVTCUZKLL-AWEZNQCLSA-N	372.227	3.735	50	40	FHGB	
CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccccc1C	9201815	JHMYYQGQYWKLBA-YBFXNURJSA-N	361.239	3.920	50	40	FHGB	
COc1ccc(Br)cc1[C@@H]1NC(=O)NC(C(C)(C)C)=C1C#N	409371228	GDNLNUWRQFOKCR-ZDUSSCGKSA-N	364.243	3.635	50	40	FHGB	
O=C(NNc1ccccc1C(F)(F)F)c1cncn1-c1ccc(F)cc1	69525392	YNZQBEAPERKCRM-UHFFFAOYSA-N	364.302	3.787	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C\c1cn(CC(=O)O)c2ccccc12)c1ccccc1	409241956	PKHYMKMFIXAADA-ZCQLHAAUSA-N	373.412	3.510	50	40	FHGB	
COc1ccccc1/C=N/NC(=O)c1ccc(N2Cc3ccccc3C2)cc1	408730181	OITDNHHIYUVPRT-ZVHZXABRSA-N	371.440	3.979	50	40	FHGB	
CC(C)(C)OC(=O)N1C(=O)OC(=O)C[C@H]1c1ccc(Br)cc1	32098802	ZQUSGUSNRXGGEI-NSHDSACASA-N	370.199	3.794	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-]	853123	CWBKOUCLLSKYFV-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CCCC[C@@H]1C(F)(F)F	44835751	WMMVCUUZWLBFQR-VMJZLSGTSA-N	372.431	3.719	50	40	FHGB	
Cc1cc(C)c2sc(NNC(=O)c3cc4ccccc4oc3=O)nc2c1	38486240	QDYNRPZZTHIASI-UHFFFAOYSA-N	365.414	3.776	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)cc1OC	44028917	SYEQRUGWSRBURW-OVCLIPMQSA-N	351.358	3.612	50	40	FHGB	
CCOC(=O)N/N=C/c1c(C)nn(Cc2ccc(Cl)cc2)c1Cl	3538352	VBRLODXELAHDOL-QGMBQPNBSA-N	355.225	3.627	50	40	FHGB	
Cc1ccc(NC(=O)NNC(=O)CS[C@@H]2CCc3ccccc32)c(C)c1	1574213	LXBNQYUIMUPTCK-GOSISDBHSA-N	369.490	3.877	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1cn(Cc2cccc(C)c2)c2ccccc12	408800264	LGVINCWAVOBXNY-CPNJWEJPSA-N	373.456	3.668	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)c1	409112555	DXHJPIWSDCWLTI-WXUSHSQQSA-N	369.490	3.974	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2cc([N+](=O)[O-])ccc2N(C)C)cc1	408998652	RRYSRNLOHOCCIC-XNTDXEJSSA-N	350.378	3.515	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1cccc(Cl)c1)c1ccco1	6335983	XCXAZFGGIUTHGK-CIAFOILYSA-N	367.792	3.949	50	40	FHGB	
CC1=C(C(=O)OCc2ccccc2)OC(N)=C(C#N)[C@@H]1c1ccc(F)cc1	1073880	RBSQARLWUSGUBX-SFHVURJKSA-N	364.376	3.651	50	40	FHGB	
O=C(NNc1ncccn1)c1csc(-c2ccc(Cl)c(Cl)c2)n1	65843023	LAYBAKMKWFNBNQ-UHFFFAOYSA-N	366.233	3.664	50	40	FHGB	
CO[C@@]1(C(=O)Nc2ccc(OCCBr)cc2)CCC[C@H](C)C1	225634698	YEXIDDHSTKHEFH-GUYCJALGSA-N	370.287	3.994	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)cc1Cl	3036876	DGRLKOUPASBFNO-AWQFTUOYSA-N	367.232	3.840	50	40	FHGB	
C=CCn1cc(/C=N/NC(=O)CC2(C)SCCS2)c2ccccc21	6348180	ILBUXIOMLWPPTA-XDHOZWIPSA-N	359.520	3.864	50	40	FHGB	
Cc1cc(C)nc(SCC(=O)N/N=C\c2ccc(Cl)c(Cl)c2)n1	33096965	URTKRNYKGMCIRH-WSVATBPTSA-N	369.277	3.643	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)OC(C)(C)C)ccc1OC(=O)c1ccco1	4513607	BRCWROOVNWXMJU-UDWIEESQSA-N	374.393	3.756	50	40	FHGB	
COc1ccc(-c2n[nH]cc2/C=N/NC(=O)CCC2CCCCC2)cc1	5917669	OWYRVQCBBSXUTO-FYJGNVAPSA-N	354.454	3.896	50	40	FHGB	
COc1cc(Cl)c(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc1OC	408798926	JIKCKFMQGUVFTF-MBLSOGTRSA-N	362.857	3.959	50	40	FHGB	
O=c1c2ccccc2n2c(CCl)nnc2n1CCc1ccc(Cl)cc1	408712828	VCVNCASCKWUUCP-UHFFFAOYSA-N	373.243	3.679	50	40	FHGB	
Cc1cccc(NCC(=O)N/N=C\C(Br)=C\c2ccccc2)c1	4579385	UBBXAIMIULNESP-UZNBDGRHSA-N	372.266	3.945	50	40	FHGB	
CO[C@](C)(CC(C)C)C(=O)Nc1ccc(OCCBr)cc1	225606179	PMMSUKQEGDHLHK-MRXNPFEDSA-N	358.276	3.850	50	40	FHGB	
N#C/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1Br	5771459	YJUSJDBCTQWSOE-XYOKQWHBSA-N	372.178	3.903	50	40	FHGB	
CCOc1c(Cl)cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1Cl	5408505	WHBCBCFCHIAADM-CYBMUJFWSA-N	365.220	3.642	50	40	FHGB	
O=[P@]1(N(CCCl)CCCl)NCC2(O1)C1CC3CC(C1)CC2C3	5839111	DAMHTNXBIHCYPW-ZRMJPCLXSA-N	367.257	3.689	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccccc1Cl)c1cc(O)ccc1O	13124293	JRPYLHYQIOUTAV-YBFXNURJSA-N	364.854	3.525	50	40	FHGB	
COC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1cc2ccccc2o1	3275449	UCKRAXPUOSEUMU-CIAFOILYSA-N	360.373	3.975	50	40	FHGB	
CCCCSC1=C(C#N)[C@H](c2ccccc2OCC)[C@H](C#N)C(=O)N1	9015527	OEFOPYWMSATOTR-WMLDXEAASA-N	355.463	3.707	50	40	FHGB	
O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)s1)c1ccc(F)cc1	7899897	UYCDCKVCQWCSNF-UHFFFAOYSA-N	358.369	3.768	50	40	FHGB	
N#CC(Nc1sc2c(c1C#N)CCCC2)=C1C(=O)c2ccccc2C1=O	954540	ZUTHQSOPZHDSML-UHFFFAOYSA-N	359.410	3.767	50	40	FHGB	
O=C(N/N=C\c1cc(Cl)cc(Br)c1O)c1ccc(F)cc1	4784613	TZRLNQGMDMWUAG-WSVATBPTSA-N	371.593	3.711	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)NC1CCCC1	409191627	JOWDRQQNZYWJMK-RVDMUPIBSA-N	350.374	3.611	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OC(C)C	40889239	XVALWFOTDIAPMH-WQRHYEAKSA-N	350.418	3.706	50	40	FHGB	
C=CCOc1ccccc1/C=N\NC(=O)c1ccc(OCCC)c(OC)c1	6324544	GAVOJTDDWKCKBQ-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccc2Cl)c(C)n1-c1ccccn1	409230639	DRXCDKJACGOZQM-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
COc1cc(/C=N/NC(=O)C(c2ccccc2)c2ccccc2)ccc1O	3031826	RFNHUDFDSPEWKU-HZHRSRAPSA-N	360.413	3.683	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)N/N=C\c1ccccc1Cl)c(C)n2C	15985491	RTZFQUXZFNYEAC-NHDPSOOVSA-N	355.825	3.913	50	40	FHGB	
Cc1ccc(C(C)C)c(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])s2)c1	1054384	NXOSGKUKUKEDCR-GIJQJNRQSA-N	361.423	3.617	50	40	FHGB	
COc1cc(/C(C#N)=C/c2cccc([N+](=O)[O-])c2)c([N+](=O)[O-])cc1OC	2274042	HXWSZMJNBCQZNW-WUXMJOGZSA-N	355.306	3.584	50	40	FHGB	
O=C(N/N=C/C(Br)=C\c1ccccc1)c1ccc2nc[nH]c2c1	13583244	FHWPVKBMVXZHIK-QXSLLBHJSA-N	369.222	3.715	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C(/C)c2cccc(NC(=O)C3CC3)c2)cc1	6439600	UFPMNRSSDVGGAE-UCQKPKSFSA-N	365.433	3.588	50	40	FHGB	
C/C(=N\NC(=O)Cn1cnc(-c2ccccc2)c1)c1ccc(Cl)cc1	4730512	QERRVUOIJJGACV-HYARGMPZSA-N	352.825	3.744	50	40	FHGB	
CCCCSCC(=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	24763124	DBEXMYMMBBSEBB-UHFFFAOYSA-N	351.350	3.590	50	40	FHGB	
CCn1cc(/C=N/NC(=O)COc2ccccc2Cl)c2ccccc21	408913496	MSAUWVRCWUIYIL-SRZZPIQSSA-N	355.825	3.844	50	40	FHGB	
C=CCn1cc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)c2ccccc21	33785210	MCZMJNBMUZXQFC-LPYMAVHISA-N	363.417	3.608	50	40	FHGB	
Cc1cccc(C(=O)NNC(=O)[C@H]2CC2(c2ccccc2)c2ccccc2)c1	3043179	NBQXVSNGSOAYRK-OAQYLSRUSA-N	370.452	3.762	50	40	FHGB	
CN1C(=C(C#N)C(=O)COc2ccc(F)cc2Cl)N(C)c2ccccc21	2663203	MMOZHFXNKBVXHP-UHFFFAOYSA-N	371.799	3.748	50	40	FHGB	
N#C/C(=C\c1ccc(N2CCCC2)o1)C(=O)NCCc1c[nH]c2ccccc12	1103913	HQLXWAVUPXXMGU-GHRIWEEISA-N	374.444	3.627	50	40	FHGB	
Cc1c(/C=N/NC(=O)COc2cccc(Cl)c2)c2ccccc2n1C	1307763	XUHBHVJAAPZHAX-SRZZPIQSSA-N	355.825	3.669	50	40	FHGB	
CCc1ccc(NC(=O)CCC(=O)N/N=C/c2cccc(Cl)c2)cc1	3101404	PNJAMPZFEOHETR-FYJGNVAPSA-N	357.841	3.771	50	40	FHGB	
CCOc1cc2c(cc1/C=C(/C#N)C(=O)N[C@@H](C)c1ccccc1)OCO2	409236327	DZAIRVYIHAWDHF-DUPVFGOHSA-N	364.401	3.598	50	40	FHGB	
COc1cc(/C=N\NC(=O)[C@H](C)c2ccc(CC(C)C)cc2)ccc1O	32223248	QZKWHVKONPVSPE-VUZLNAKASA-N	354.450	3.853	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@H]2C[C@H]3C=C[C@@H]2C3)cc(OCC)c1OCC	226272279	ZNEHIIAWOIPSAR-JSPGGVSYSA-N	372.465	3.811	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccco2)c(C)n1-c1ccc2ncccc2c1	2175397	AAXBTLVDJMULGS-YDZHTSKRSA-N	358.401	3.999	50	40	FHGB	
CC1=C[C@@H](CO[Si](C)(C)C(C)(C)C)N(C(=O)OC(C)(C)C)C[C@H]1O	220953134	OLBWRIKUNCOAAZ-LSDHHAIUSA-N	357.567	3.935	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2ccc(O)c(Br)c2)cc1	15223231	SCITWEJAVSMZRC-WQLSENKSSA-N	373.206	3.709	50	40	FHGB	
C/C(=N/NC(N)=O)c1ccc2c3c(cc(Br)c2c1)CCCC3	17286518	GYWOWRKIDOUFPF-JMIUGGIZSA-N	360.255	3.873	50	40	FHGB	
CCCCCc1ccc(OCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1	2165470	XIQPWVXOLMRBGD-LPYMAVHISA-N	368.433	3.677	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)c2cc3ccccc3cc2O)c(OC)c1	4751096	IUVOMXRORNWJNJ-LPYMAVHISA-N	364.401	3.717	50	40	FHGB	
CC(=O)N/N=C/c1c(OCc2cccc([N+](=O)[O-])c2)ccc2ccccc12	409016171	SQLQGVGCIDEWFR-CIAFOILYSA-N	363.373	3.797	50	40	FHGB	
O=C(N/N=C\c1cccc([N+](=O)[O-])c1)C(c1ccccc1)c1ccccc1	33580602	BMLFEBAMKOVANE-JCMHNJIXSA-N	359.385	3.877	50	40	FHGB	
O=C(Br)[C@@H](Br)c1ccc(Br)cc1	72207490	TZYLSVNNTRQRRC-ZETCQYMHSA-N	356.839	3.807	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2C)cc(OC)c1OC	213359052	ZFPKEOIWXUSTHK-DHDCSXOGSA-N	352.390	3.567	50	40	FHGB	
CCN1c2ccc(/C=N/NC(=O)c3ccncc3)cc2[C@@H](C)CC1(C)C	223528620	NGXOATLAOYVIHD-FVQJWRHTSA-N	350.466	3.958	50	40	FHGB	
CC[C@H](C)n1nc(C)c(Cl)c1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2	253401018	MGXQOFHRCFNDRF-XPTSAGLGSA-N	360.845	3.631	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1	5543664	QBCDRTCKDWOGOK-NSHDSACASA-N	367.232	3.530	50	40	FHGB	
Cc1ccc(-c2noc(/C(C#N)=C\c3ccc(N4CCOCC4)cc3)n2)cc1	96669753	FOTHRJIOAHYVKK-RGEXLXHISA-N	372.428	3.946	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)cc1	409357645	BFFQXKJNENOIJE-FYJGNVAPSA-N	363.373	3.856	50	40	FHGB	
N#C/C(=C\c1cc(Br)ccc1Cc1ccccc1F)C(N)=O	408871728	ZQDSWXALVVKWNH-RIYZIHGNSA-N	359.198	3.571	50	40	FHGB	
CCCCN1C(=O)/C(=N\NC(=O)c2ccccc2Cl)c2ccccc21	5792785	GFJXFLHUQDUJDL-FXBPSFAMSA-N	355.825	3.621	50	40	FHGB	
COc1ccc(C(CCl)(CCl)c2ccc(OC)c(N)c2)cc1N	1722124	UYEZZGZGOSRFDZ-UHFFFAOYSA-N	355.265	3.632	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1	6554622	PUBWUBOYJOGQDH-YBFXNURJSA-N	369.402	3.972	50	40	FHGB	
O=C(NNc1ccccc1Cl)NC1CCN(Cc2ccccc2)CC1	12984367	TWVZQONJHMCRGW-UHFFFAOYSA-N	358.873	3.631	50	40	FHGB	
Cc1ccc([C@@H]2CC(=O)N3CN(C4CCCC4)CSC3=C2C#N)cc1	20348032	HXTFUMQLLPVZKE-KRWDZBQOSA-N	353.491	3.953	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(N3CCCCC3)s2)cc1OC	6684210	WQYPPLYJKUTDEP-DEDYPNTBSA-N	373.478	3.520	50	40	FHGB	
CCn1cc(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2)c2ccccc21	4739127	CHHJEKCXSAREOQ-SFQUDFHCSA-N	359.429	3.893	50	40	FHGB	
CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(C(C)C)cc3)[C@H]2C1	33936235	GAMUXOLTMHKTAC-SFTDATJTSA-N	371.488	3.555	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)cc1Cl	12859040	KZHQVSTZRPHRMR-UFFVCSGVSA-N	360.841	3.803	50	40	FHGB	
N#C/C(=C\c1coc2ccccc2c1=O)C(=O)Nc1cccc(Cl)c1	1454269	MJIOCZWYFIPBOF-XYOKQWHBSA-N	350.761	3.992	50	40	FHGB	
Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3ccc(Cl)cc3)cc2)n1	6189204	KDQAEINQOMTWNB-WSDLNYQXSA-N	366.852	3.966	50	40	FHGB	
COc1ccc(/C(C)=N\NC(=O)CSc2nc3ccccc3s2)cc1	13552274	UANAGTVKMLSKDA-NDENLUEZSA-N	371.487	3.937	50	40	FHGB	
CS(=O)(=O)/C(C#N)=C/c1ccc(-c2ccccc2Br)o1	7714131	CHSTXYOWPUNEOO-DHZHZOJOSA-N	352.209	3.618	50	40	FHGB	
Cc1ccc2nc(Sc3ccc(/C=C(/C#N)C(=O)N(C)C)o3)[nH]c2c1	59334970	UPSKBCVWMJNYFN-XFXZXTDPSA-N	352.419	3.611	50	40	FHGB	
Cc1occc1C(=O)NNC(=O)c1csc(-c2ccc(C(C)C)cc2)n1	13011702	LHROHAPYSBBKSL-UHFFFAOYSA-N	369.446	3.910	50	40	FHGB	
COc1ccc(-c2n[nH]cc2/C=C(/C#N)C(=O)N[C@@H](C)c2ccccc2)cc1	5728418	MTSKPMKTNZHSGT-BRYHAGSVSA-N	372.428	3.870	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cc(Cl)ccc1C)OCO2	409070993	HUCKUCSAXUPUSC-WLRTZDKTSA-N	370.792	3.931	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCCC3)c(F)c2)cc1	409076207	ZOCORVHXYOISGV-VBKFSLOCSA-N	365.408	3.980	50	40	FHGB	
CCO[Si](CCO[C@H](CC)O[C@@H]1CCCS1)(OCC)OCC	299888443	JUOVIGBDJWCFHQ-GJZGRUSLSA-N	352.569	3.657	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccncc2)c(C)n1-c1cccc(Cl)c1	5739756	UZIJAXQRHMSPMM-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2	1079234	BGVODGCKCYHIDL-SFHVURJKSA-N	364.355	3.677	50	40	FHGB	
C/C(CC(=O)N(C(C)C)C(C)C)=N\NC(=O)c1cc2ccccc2cc1O	4387235	WCHHEUTWJPFTHQ-PXLXIMEGSA-N	369.465	3.687	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)COc2cc(C)cc(C)c2)cc1OCC	6657106	WFNWQJANPUUAGT-LPYMAVHISA-N	370.449	3.630	50	40	FHGB	
CC(=O)Nc1ccc(/C=N/NC(=O)COc2ccc(C)cc2C(C)C)cc1	4926432	HPRXYUGSJLDYJO-WSDLNYQXSA-N	367.449	3.606	50	40	FHGB	
CCOc1cc(/C=N/NC(N)=O)cc(Cl)c1OCc1ccccc1C	408923784	JWMGTFAXKYHCNS-UFFVCSGVSA-N	361.829	3.628	50	40	FHGB	
C#CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)cc1OC	408746590	SWVBXVCNIGRWRH-PTNGSMBKSA-N	366.804	3.906	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)o1	3083280	XWGLQRNKFRLMKB-HYARGMPZSA-N	371.400	3.600	50	40	FHGB	
O=C(Cl)[C@@H]1CC(=O)N(c2ccc(Br)c(C(F)(F)F)c2)C1	57327542	JSNXSFPSJVDLGI-ZCFIWIBFSA-N	370.552	3.586	50	40	FHGB	
CCCC/C(C)=N\NC(=O)c1c(C)nc2ccc(Br)cn12	59515959	VUOFMXBEOJVMRU-ZDLGFXPLSA-N	351.248	3.701	50	40	FHGB	
Cc1ccc(C(=O)O)cc1-n1c(C)cc(/C=C(/C#N)C(=O)NC(C)C)c1C	408774119	ABKCFGOKZMTUDT-NVMNQCDNSA-N	365.433	3.532	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@H]2[C@@H](C=C(Cl)Cl)C2(C)C)ccc1O	4811695	HXJAIYPOVGPKRG-SIUANXPXSA-N	371.264	3.832	50	40	FHGB	
O=C(CSc1nc2ccccc2o1)N/N=C/c1c[nH]c2ccccc12	1088295	YTJZWQOSAYYIIR-KEBDBYFISA-N	350.403	3.552	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)NCc1ccccc1	13584335	ONYQGLJUPAGKNL-PDGQHHTCSA-N	372.380	3.868	50	40	FHGB	
C[C@@H](CNC(=O)c1ccccc1)[C@@](C)(Br)CBr	3124303	IGCDMOGIHHXANY-GWCFXTLKSA-N	363.093	3.601	50	40	FHGB	
C/C(=N\NC(=O)c1ccc2c(c1)OCCO2)c1sc(C(C)(C)C)nc1C	98054681	JOKSPASRQYWMRP-CIAFOILYSA-N	373.478	3.674	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)[C@H](C)SCc2ccccc2)o1	408999362	KPCBQJQKJGGPNL-NPRIEWAGSA-N	359.495	3.898	50	40	FHGB	
CCOc1cc(C(=O)NN)cc(Cl)c1OCc1ccc(Cl)cc1	216836730	JKEFYJIHSSTXMH-UHFFFAOYSA-N	355.221	3.575	50	40	FHGB	
N#C/C(=C\c1ccc(O)c([N+](=O)[O-])c1)C(=O)c1c[nH]c2cc(F)ccc12	40139933	XRVWCLHJMPIJEN-VZUCSPMQSA-N	351.293	3.711	50	40	FHGB	
Cc1cc(C(=O)O)ccc1-n1c(C)cc(/C=C(/C#N)C(=O)NC(C)C)c1C	869959	ZSAUXEIXDJKSFM-ZDLGFXPLSA-N	365.433	3.532	50	40	FHGB	
CCn1cc(/C=C(/C#N)C(=O)NCc2ccc3c(c2)OCO3)c2ccccc21	17076424	VDLWFRLOIPIEDP-YBEGLDIGSA-N	373.412	3.613	50	40	FHGB	
CC(C)N(C(=O)CCl)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1	242718374	XLTOXUILBPGDFS-QAQDUYKDSA-N	366.889	3.700	50	40	FHGB	
CCOC(=O)c1c(NC(=O)[C@@H](C)Br)sc2c1CCCC2	1465974	BIDTZNOHNKSCAQ-MRVPVSSYSA-N	360.273	3.526	50	40	FHGB	
COCCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2)c1C	4994049	RDECOLMRGGXRDO-GZTJUZNOSA-N	371.868	3.807	50	40	FHGB	
CC(=O)Nc1ccc(C(=O)N/N=C/c2cc(C)n(-c3ccccc3)c2C)cc1	107684915	HRJPNKGGAVBGRR-OEAKJJBVSA-N	374.444	3.816	50	40	FHGB	
C[C@H](Oc1ccc(/C=C(/C#N)C(=O)Nc2cccc(Cl)c2)cc1)C(=O)O	59249949	MTBXVTOUPFQXCP-CJAAZZPWSA-N	370.792	3.738	50	40	FHGB	
COc1ccc(SCC(=O)N/N=C\c2cccn2-c2ccccc2)cc1	408846413	NFWDWYHBVHIWFH-STZFKDTASA-N	365.458	3.728	50	40	FHGB	
C[C@@H](Sc1nncs1)C(=O)NN=C(c1ccccc1)c1ccccc1	48209267	OZCJHFSGONXDLJ-CYBMUJFWSA-N	368.487	3.588	50	40	FHGB	
CCCCNC(=S)NNC(=O)c1csc2c1CC[C@@H](C(C)(C)C)C2	6273667	IJWCZBONOXWNQR-GFCCVEGCSA-N	367.584	3.808	50	40	FHGB	
C[C@@H](CC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)c1ccccc1	5578947	YYVRBTRIQMKTDX-BZSISCHUSA-N	354.494	3.934	50	40	FHGB	
Cc1cc(SC#N)ccc1NC(=O)C[C@H](C(=O)O)c1ccc(F)cc1	25207118	JBTBJEJQPMPOAA-HNNXBMFYSA-N	358.394	3.904	50	40	FHGB	
N#C/C(=C/c1ccc(C#N)cc1)C(=O)Nc1ccc(Br)cc1	408748000	WWQANGJWCIPUCC-ZROIWOOFSA-N	352.191	3.866	50	40	FHGB	
Cc1ccc2sc(NNC(=O)c3cc(=O)c4ccccc4o3)nc2c1C	4121430	MLRUOQANEUZACN-UHFFFAOYSA-N	365.414	3.776	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)ccc1O	59922322	MKEYHUGQYIJETJ-UFFVCSGVSA-N	352.312	3.574	50	40	FHGB	
CCOC(=O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccccc3)o2)c1	409156336	FGZPKIZZYMKCQL-HYARGMPZSA-N	362.385	3.887	50	40	FHGB	
O=C(COc1cccc2cccnc12)N/N=C\c1c(F)cccc1Cl	33160883	CQBFTUYLBJWODQ-YVNNLAQVSA-N	357.772	3.556	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@@H]2C[C@@H]3C=C[C@H]2C3)cc(OCC)c1OCC	4150420	ZNEHIIAWOIPSAR-SGRSMKHRSA-N	372.465	3.811	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)CNc2ccc(Cl)cc2)cc1	1444831	SOZZLSXJBRTJQS-LPYMAVHISA-N	358.873	3.748	50	40	FHGB	
N#CC1=C(N)S[C@H](C(=O)C23CC4CC(CC(C4)C2)C3)[C@H]1c1ccncc1	4042608	NZRVOCOZYBMNOA-FWWNRUKASA-N	365.502	3.760	50	40	FHGB	
COc1cccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(C)cc4)c32)c1	985595	ZSJSYFYNMARLBB-KRWDZBQOSA-N	358.401	3.612	50	40	FHGB	
C/C(=N\NC(=O)COc1ccccc1C)c1cccc(Br)c1	408776135	UKNVQWZUPLNXET-CPNJWEJPSA-N	361.239	3.677	50	40	FHGB	
COc1ccc2cc(/C=N/NC(=O)CCc3ccccc3)c(Cl)nc2c1	409127398	QQMHJBSTFQAGAX-LPYMAVHISA-N	367.836	3.980	50	40	FHGB	
N#CC1=C(N)n2c(nc3ccccc32)N[C@@H]1c1cccc(Br)c1	20086163	ZLVINMQBJUUHHA-OAHLLOKOSA-N	366.222	3.616	50	40	FHGB	
CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C\c1ccc(N2CCCC2)o1	408847323	TYAAPMJKISQONA-DHDCSXOGSA-N	357.417	3.888	50	40	FHGB	
COC1(C(=O)Nc2ccc(OCCBr)cc2)CCC(C)CC1	225640136	CFJCYANDJCPUJY-UHFFFAOYSA-N	370.287	3.994	50	40	FHGB	
O=C(NNC(=O)[C@H]1Cc2ccc(Cl)cc21)c1ccc2ccccc2c1	1626182677	FIBPSAYZKMRYEC-SFHVURJKSA-N	350.805	3.594	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(Br)cc2)c(C)n1C	16268219	XETXZNNFUHQPIS-ZROIWOOFSA-N	358.239	3.950	50	40	FHGB	
O=C(CSCc1cccc(Cl)c1)N/N=C/c1ccc([N+](=O)[O-])cc1	59473474	DJNGSOAWXBGGGS-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
COc1ccc2c(-c3ccccc3)c(C(=O)NNc3ncccn3)oc2c1	55214811	SLWUVWDRIUOWJS-UHFFFAOYSA-N	360.373	3.655	50	40	FHGB	
Cn1c(S/C(=C/C#N)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccco1	8511999	WTANPOFFKIEWND-RIYZIHGNSA-N	353.363	3.640	50	40	FHGB	
O=C(NN=C1CCCCCCC1)C(=O)Nc1ccc(Br)cc1	59515744	FNNKXQAYZQITPN-UHFFFAOYSA-N	366.259	3.604	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cc(C)ccc2OC)cc1OC	5713642	LUZVDQBGOWXUHY-LFIBNONCSA-N	366.417	3.957	50	40	FHGB	
Cc1cccc(NC(=S)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	16186224	XSPYHBAXROLFKO-UHFFFAOYSA-N	371.506	3.689	50	40	FHGB	
O=C(N/N=C/C=C/c1cccc([N+](=O)[O-])c1)c1ccccc1Br	4815507	DRSSNVMGBAPOAK-SRFURKKRSA-N	374.194	3.786	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2cccc(Br)c2)ccc1O	408765487	PZXQMHRUJIAFCS-GHXNOFRVSA-N	373.206	3.709	50	40	FHGB	
N#C/C(=C/c1cc(Cl)cc([N+](=O)[O-])c1O)C(=O)Nc1ccccc1F	408819412	RYOATBCWASUOOV-YHYXMXQVSA-N	361.716	3.639	50	40	FHGB	
Cc1cc(N2CCCC2)ccc1/C=N\NC(=O)COc1ccccc1Cl	408959818	GGTWXMQATQTMBS-XKZIYDEJSA-N	371.868	3.778	50	40	FHGB	
CC(=O)NNc1nc(-c2ccccc2)c(NC(=O)c2ccc(C)cc2)s1	72238714	YADJMLLVZSKTJL-UHFFFAOYSA-N	366.446	3.834	50	40	FHGB	
C=CCc1cccc(/C=N/NC(=O)COc2ccc(CCC)cc2)c1O	3167015	KHDKBYNCIHSMQG-HYARGMPZSA-N	352.434	3.602	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)c2ccccc2)cc(Br)c1O	5788382	XPJMPTDXQARSRS-NTUHNPAUSA-N	358.191	3.953	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1	59433854	HXLYKXUOKSIZGU-HZHRSRAPSA-N	373.412	3.876	50	40	FHGB	
COc1ccc(CNNC(=O)C[C@H](c2ccc(F)cc2)c2ccco2)cc1	12390650	STHNLWUCWUIMTC-LJQANCHMSA-N	368.408	3.770	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)Cc2csc(-c3ccccc3Cl)n2)n1	13006190	PBGZUOYZAYFOCS-UHFFFAOYSA-N	373.869	3.556	50	40	FHGB	
CCOc1ccc(CCNC(=O)/C(C#N)=C\c2ccccc2)cc1OCC	6270628	SDLPGVINXHBTKP-RGEXLXHISA-N	364.445	3.750	50	40	FHGB	
CCOC(=O)c1ccc2nc(NC(=O)[C@@H](Br)CC)sc2c1	20132432	UTAQNKKEVUKTNC-VIFPVBQESA-N	371.256	3.585	50	40	FHGB	
COc1cccc(-c2cc(C(=O)N/N=C\c3ccc(C(C)C)cc3)[nH]n2)c1	33283464	PIVNPLZEPSVMNT-XKZIYDEJSA-N	362.433	3.973	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=N\NC(=O)Nc2ccc(F)cc2)cc1	36151378	JBMCTJLWGSSXRU-HMAPJEAMSA-N	365.412	3.838	50	40	FHGB	
O=C(N/N=C\c1ccc2c(c1)OCO2)C(c1ccccc1)c1ccccc1	33335685	KUBVMOSTXCYNNJ-UCQKPKSFSA-N	358.397	3.698	50	40	FHGB	
COc1ccc(O)c(/C=N/NC(=O)[C@H](C)Nc2ccc3ccccc3c2)c1	1092181	SFKQBJDXQDFAKS-KOUDTOEKSA-N	363.417	3.505	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2ccc(C)c(Br)c2)cc1	20764109	MKYXVVQOMVALMO-YBFXNURJSA-N	361.239	3.920	50	40	FHGB	
Cn1cc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc21	4811607	HLVBGNYHGZLPBD-DJKKODMXSA-N	356.769	3.504	50	40	FHGB	
Cn1nc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1-c1ccccc1	253395326	BTSHKRSEUIKGED-LJQANCHMSA-N	374.444	3.538	50	40	FHGB	
CN1/C(=C\C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)C(C)(C)c2ccccc21	13496175	LZCHAVSEFVJHKB-LBBNCXDASA-N	364.405	3.622	50	40	FHGB	
O=C(ON1C(=O)c2ccccc2O[C@@H]1CCCl)c1ccccc1Cl	2577813	RZZTUGOSOZTEBO-OAHLLOKOSA-N	366.200	3.902	50	40	FHGB	
NNC(=O)c1ccc(OCc2cccc3ccccc23)c(Br)c1	226325444	ZCJHBYDMUCGJLG-UHFFFAOYSA-N	371.234	3.785	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1	2582262	UGSIUJIZQWDRTQ-LFIBNONCSA-N	352.346	3.644	50	40	FHGB	
COc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)cc(OC)c1	13135338	JCMDPYUUBBSRSM-RQZCQDPDSA-N	363.822	3.696	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1ccc(O)cc1)c1ccccc1-n1cccc1	409017031	DKNQYOALPHFWDP-XQNSMLJCSA-N	370.412	3.738	50	40	FHGB	
COC(=O)c1c(NC(=O)/C(C#N)=C\c2ccccc2)sc2c1CCCC2	4860388	NORSTCVAJHLVDJ-KAMYIIQDSA-N	366.442	3.959	50	40	FHGB	
O=C(N/N=C\c1ccc(O)c(Br)c1)c1cc2ccccc2o1	408849020	XUCVURYNWALYMH-NVMNQCDNSA-N	359.179	3.665	50	40	FHGB	
C[C@@]1(C(=O)N/N=C/c2ccccc2)NC2(CCCCC2)Cc2ccccc21	408734009	COEAUJVRQDICIU-PCCDRTMGSA-N	361.489	3.901	50	40	FHGB	
COc1ccc(/C(C#N)=C/c2cc(Cl)c(OCC(=O)O)c(OC)c2)cc1	408581580	JCMXIXOKJRYEQD-VGOFMYFVSA-N	373.792	3.885	50	40	FHGB	
O=C(N/N=C/c1cc2cc([N+](=O)[O-])ccc2nc1Cl)c1ccccc1	408728880	VWBHHTCVBFNKEF-VXLYETTFSA-N	354.753	3.560	50	40	FHGB	
N#CC(C#N)=C(N)/C(C#N)=C/c1ccc(-c2ccccc2Br)o1	97960452	YHRPULIWEYTKTD-YRNVUSSQSA-N	365.190	3.876	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1	207881210	QUFOKBCBIXCZKK-XFFZJAGNSA-N	359.769	3.940	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)SCc1ccccc1)c1ccc2c(c1)OCCO2	4714594	RUIIBUBPRUGJEM-HBBMIWKISA-N	370.474	3.620	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2cc(Cl)ccc2OC)cc1	53106504	AYHOMYYLYBVMMN-DHDCSXOGSA-N	356.809	3.581	50	40	FHGB	
CCOC(=O)c1sc(CC(=O)/C(C#N)=C/c2ccc(C)o2)c(C#N)c1C	408547217	VLZCTHLLUJEVBH-NTUHNPAUSA-N	368.414	3.725	50	40	FHGB	
O=C(NNC(=O)c1ccc(-c2cccc(C(F)(F)F)c2)o1)c1ccco1	12779944	IOFJJTSHQHDEJU-UHFFFAOYSA-N	364.279	3.633	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)ccc1OC(C)C	4525110	OAVFSLILCBHEIL-GDNBJRDFSA-N	352.390	3.734	50	40	FHGB	
O=C(Cc1csc(-c2ccc(F)cc2)n1)NNc1ccccc1[N+](=O)[O-]	15631705	BFFUSYBPIXGYFL-UHFFFAOYSA-N	372.381	3.543	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccccc1C)c1cccc([N+](=O)[O-])c1	408784058	SBJXYUOIDBIJRV-XMHGGMMESA-N	357.435	3.677	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(N)=S)ccc1OCc1ccc(F)cc1	408542671	KULDGKMDKQOVDV-DHDCSXOGSA-N	356.422	3.996	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)c1cccc(NC(C)=O)c1	33788346	IPAMOWTYQBHCGK-LPYMAVHISA-N	361.401	3.571	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CCCc2ccc(OC)cc2C)cc1	5872750	ZBFPALDQNKJTDC-PXLXIMEGSA-N	354.450	3.875	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C2\SCC(=O)N2c2ccccc2)c1C	13686527	SGBCKZWZUZLNQT-SILNSSARSA-N	363.442	3.757	50	40	FHGB	
C/C(CCc1ccccc1)=N\NC(=O)C(=O)Nc1cc(Cl)ccc1C	4499511	VTMNXMXSGHDMGV-HYARGMPZSA-N	357.841	3.712	50	40	FHGB	
Cc1cccc(COc2ccc(/C=C(\C#N)C(N)=O)cc2Br)c1	408868831	NKURZMXJOVIKIC-OVCLIPMQSA-N	371.234	3.729	50	40	FHGB	
Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)c2ccccc2N)o1	408727490	ZULVJMJTICJSIG-SRZZPIQSSA-N	364.361	3.509	50	40	FHGB	
C[C@@H](Cl)C(=O)Nc1ccc(C(=O)Nc2nnc(-c3ccccc3)o2)cc1	39765612	YSDOAGKVNOYKQY-LLVKDONJSA-N	370.796	3.555	50	40	FHGB	
COc1ccccc1/C=N\NC(=O)c1cc2cc(Br)ccc2o1	83319758	CWZIICUVYADUPO-GRSHGNNSSA-N	373.206	3.968	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc(Cl)c1OC	16195133	XYMQFAGQLMKRCV-KPKJPENVSA-N	358.781	3.608	50	40	FHGB	
CCc1sc(C(=O)N/N=C(\C)c2ccc(-n3ccnc3)cc2)cc1C	8046152	MXTIJNVBJUJJMV-KGENOOAVSA-N	352.463	3.959	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1cccc(OC2CSC2)c1	59472901	XCVKMIFJMDFPEZ-KEBDBYFISA-N	372.515	3.564	50	40	FHGB	
O=C(N/N=C(\c1ccccc1)c1ccccn1)c1ccc(Br)o1	4499151	SIQJARWNHUILFD-CAPFRKAQSA-N	370.206	3.620	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccc(C#N)cc1F	4739152	HBJPPGFXAMQJFO-AFUMVMLFSA-N	371.371	3.626	50	40	FHGB	
CC(C)N(C(=O)CCl)[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1	79392741	ZCWLYRNUEUDMNZ-SJORKVTESA-N	366.889	3.700	50	40	FHGB	
C[C@@H]1C[C@H]([P+](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)O1	1775964769	BRGBURGZSZDDIA-GCJKJVERSA-N	361.401	3.685	50	40	FHGB	
COc1cc(/C=C(\C#N)c2nc3ccccc3s2)ccc1OCC(=O)O	6181193	FRVJNRLEFQXLMN-MDWZMJQESA-N	366.398	3.832	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)COc2cccc([N+](=O)[O-])c2)Sc2ccccc21	101756757	SDMLIXFXPIUNND-JXAWBTAJSA-N	367.386	3.520	50	40	FHGB	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccco3)c3ccccc3n2)cc1	8355295	YMRUPSPXNQNMOL-UHFFFAOYSA-N	371.396	3.878	50	40	FHGB	
COc1ccc([C@@H]2C(C#N)=C(N)S[C@H]2C(=O)c2ccc(C)cc2)cc1	1079127	YLQAANTXKQFUGS-IEBWSBKVSA-N	350.443	3.779	50	40	FHGB	
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NN=C(CCl)CCl	100244365	FUHSULRNMXPOTE-SSDOTTSWSA-N	358.052	3.711	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)SCc1ccccc1)c1cccc([N+](=O)[O-])c1	20248568	VVWUDBQBKILBBH-ITRAFESCSA-N	357.435	3.757	50	40	FHGB	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1/C=N/NC(=O)OC(C)(C)C	8156507	JBULNKSLCYHTDX-AWQFTUOYSA-N	366.824	3.891	50	40	FHGB	
O=C(N/N=C/c1ccc(O)c(Br)c1)c1ccc(Cl)cc1	3573667	KAOYLRYSFDKXRA-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
COc1cccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)c1OC	5527512	AQLONTWFDUPQOJ-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
C/C(CC(=O)Nc1ccc(F)cc1)=N\NC(=O)Cc1ccc(Cl)cc1	12362366	CBPRYTRCHPSWHM-WSDLNYQXSA-N	361.804	3.543	50	40	FHGB	
Cc1occc1C(=O)NNC(=O)CSCc1ccc(Cl)c(Cl)c1	12851317	RWRNGIVETUAOTJ-UHFFFAOYSA-N	373.261	3.589	50	40	FHGB	
COCCn1c(C)cc(/C=N\NC(=O)c2cc3cc(Cl)ccc3o2)c1C	409022623	DDHJHKSZTXDOQF-NHDPSOOVSA-N	373.840	3.915	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CCCc2ccc(OC)cc2C)c(C)c1	408912750	RGPVIHGBWOAINC-HYARGMPZSA-N	354.450	3.794	50	40	FHGB	
CCS(=O)(=O)[C@@H](Br)C(=O)c1ccc(-c2ccccc2)cc1	96517870	SADVSQOOQONZET-MRXNPFEDSA-N	367.264	3.692	50	40	FHGB	
Cc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2)cc1	5746655	LYKZTQKZJNMYOZ-HXUWFJFHSA-N	356.429	3.766	50	40	FHGB	
CCCn1cc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)c2ccccc21	8811211	RLYVSZQYHPFVBV-LPYMAVHISA-N	365.433	3.832	50	40	FHGB	
C#CCOc1ccc(Br)cc1/C=N/NC(=O)c1cccc(C)c1	59417819	NLJSIKYHNJRITM-UDWIEESQSA-N	371.234	3.533	50	40	FHGB	
O=C(CC[C@@H](O)c1ccccc1)N/N=C/c1cccn1-c1ccccc1F	408755691	LVZGAGXHWXVOCO-KMUCBOENSA-N	365.408	3.580	50	40	FHGB	
COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)Cn1cnc2ccccc21	408691528	CDBQOHRRENFBML-QPEQYQDCSA-N	364.361	3.569	50	40	FHGB	
Cc1ccc(COc2ccc(/C=C(\C#N)C(N)=O)cc2Br)cc1	408869262	RTUBJUTVMBYFPB-OVCLIPMQSA-N	371.234	3.729	50	40	FHGB	
C=CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1	408771303	FTIPBCWGLUXMES-JZJYNLBNSA-N	373.456	3.507	50	40	FHGB	
Cc1ccc(N2C(=O)CS/C2=C(/C#N)C(=O)Nc2cccc(C)c2)cc1	2378798	PPIKQSDBJGLABB-JZJYNLBNSA-N	363.442	3.757	50	40	FHGB	
COc1ccc(OC)c(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)c1	59515940	PVOMYJSZJDYNIJ-JLPGSUDCSA-N	374.440	3.986	50	40	FHGB	
O=N[C@H]1[C@@H](Cl)[C@@H]2C[C@@H]1[C@H]1C[C@H](Br)[C@H](Br)[C@H]21	104068779	GKAXFKDNWWJFFR-ZQJMGGFBSA-N	357.473	3.542	50	40	FHGB	
CN(C)c1ccc(/C=C/C=C(/C#N)C(=O)NCCCc2ccccc2)cc1	409246031	CXLBRQAPEKCQSJ-IEPMXLQJSA-N	359.473	3.965	50	40	FHGB	
O=C(NN=C1CCC(c2ccccc2)CC1)[C@H]1COc2ccccc2O1	4863658	OKQWVABUQLHWQJ-OTOKDRCRSA-N	350.418	3.656	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1	4869314	ORACLIXIGQLDCP-DTQAZKPQSA-N	364.405	3.987	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C(\C)c1ccc(C)o1	408710916	WFQUINWLZPQPNO-LICLKQGHSA-N	351.200	3.513	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccc(F)cc1)c1ccc(Br)cc1	5171370	BMKUIHFONJNOCJ-RGVLZGJSSA-N	364.218	3.541	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-]	6301664	OSPFAWOBXHGREA-FYJGNVAPSA-N	353.422	3.894	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c1	59392379	FMWGIRGTEMRXLR-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2cc(Cl)c(O)c(OC)c2)cc1	20197313	RZGTUILNCUZLHT-RGVLZGJSSA-N	362.813	3.607	50	40	FHGB	
N#C/C(=C/c1cn(CC(=O)N2CCOCC2)c2ccccc12)c1ccccc1	408856265	JQISCZCWCLQHQP-RGEXLXHISA-N	371.440	3.564	50	40	FHGB	
CCCCOc1ccccc1-c1cc(C(=O)N/N=C/c2ccco2)[nH]n1	4094744	KGLDCBRHMCBHAF-DEDYPNTBSA-N	352.394	3.613	50	40	FHGB	
NC(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)=N/OC(=O)CCl	4277457	NBYDQZWYRNRXOT-OWOJBTEDSA-N	374.668	3.792	50	40	FHGB	
C/C(=N/NC(=O)CSc1nc2ccccc2s1)c1ccccc1O	15162587	IPWQBJOCHYRYOM-ODLFYWEKSA-N	357.460	3.634	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCCC2)o1)C(=O)NCCCc1ccccc1	409239615	ZPSRCPJNKUTULD-MNDPQUGUSA-N	363.461	3.926	50	40	FHGB	
O=C(N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(-n2cccc2)cc1	409071277	GKDXKZICYBVUII-NDENLUEZSA-N	368.780	3.803	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cc(C)cc(C)c1)OCO2	409104967	HDJUGPKUGOOGRS-LZYBPNLTSA-N	364.401	3.977	50	40	FHGB	
CCS(=O)(=O)[C@@H](Br)[C@H](O)c1ccc(-c2ccccc2)cc1	96519081	APQWIEYFZHXVEA-HZPDHXFCSA-N	369.280	3.543	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C(/C)c1ccc(F)cc1	5455100	RDJHWUFCKMBRRU-GRSHGNNSSA-N	365.202	3.751	50	40	FHGB	
O=[N+]([O-])c1cc([C@@H](O)CBr)ccc1OCc1ccccc1	22011960	HQGAJOFIQLBIIM-AWEZNQCLSA-N	352.184	3.602	50	40	FHGB	in-vitro
O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccccc1Cl	107851402	RRJMHEFJQKSSDD-SSDVNMTOSA-N	363.804	3.604	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1OCc1ccccc1F	408891396	QAWFLKWZGOGKMA-VGOFMYFVSA-N	374.799	3.849	50	40	FHGB	
C[C@]12CCCC[C@@H]1[C@H]2C(=O)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1	408869943	ULOGQHROLVIHKQ-XTLIACCCSA-N	366.417	3.921	50	40	FHGB	
C=CCc1cc(/C=N/NC(C)=O)cc(OC)c1OCc1cccc(F)c1	409012415	JWHJEAWYOHPBKG-WSDLNYQXSA-N	356.397	3.612	50	40	FHGB	
COc1ccc(-c2nc3cc(C)ccc3o2)cc1NC(=O)CSC#N	216860244	YXOZRGCAGPYLAK-UHFFFAOYSA-N	353.403	3.965	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cc(C)ccc2C)cc(OC)c1OC	3615872	NMOIIJNBCWWARN-CXUHLZMHSA-N	366.417	3.875	50	40	FHGB	
N#C/C(=C\c1cc(Br)c(O)cc1O)c1nc2ccccc2[nH]1	4595462	DVLSQLDHQJEROU-BJMVGYQFSA-N	356.179	3.801	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C/c1ccc(O)c(Br)c1)c1ccccc1	22344738	SXYVRMOFZHJYDQ-KMHUVPDISA-N	371.234	3.939	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccccc2)cc1)[C@H]1COc2ccccc2O1	3282736	YHNXJFHGGAEPOA-KURUZVKSSA-N	358.397	3.644	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C/c2c(C)n(C)c3ccccc23)cc1	4711034	SDTKTYCVSLGKJW-SFQUDFHCSA-N	359.429	3.719	50	40	FHGB	
C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc2ccccc2c1	408599640	YADORCWWPKEHEB-HYARGMPZSA-N	373.368	3.524	50	40	FHGB	
C[C@H](Sc1ccccc1)C(=O)NN=C1CCN(Cc2ccccc2)CC1	409339072	DTVUBEXHNREOQH-KRWDZBQOSA-N	367.518	3.935	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2C)cc1C(=O)O	409156801	SUEMOOCFRFLHQK-MHWRWJLKSA-N	364.401	3.946	50	40	FHGB	
O=C(CCn1c2c(c3ccccc31)CCCC2)NN=Cc1ccccc1O	252429347	FTSNSDIWTRIMLI-UHFFFAOYSA-N	361.445	3.766	50	40	FHGB	
C[C@@H]1[C@H](c2ccccc2)O[P@](=O)(N(CCCl)CCCl)N1C	5411645	WSTLBKXVNMSQSJ-YOEYROIRSA-N	351.214	3.966	50	40	FHGB	
CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(C(C)C)cc3)[C@H]2C1	13479778	GAMUXOLTMHKTAC-LEWJYISDSA-N	371.488	3.555	50	40	FHGB	
CCCCNC(=S)NNC(=O)c1csc2c1CC[C@H](C(C)(C)C)C2	6273665	IJWCZBONOXWNQR-LBPRGKRZSA-N	367.584	3.808	50	40	FHGB	
Cc1cc(/C=N/NC(=O)CNc2ccc(F)cc2)c(C)n1-c1ccccc1	408692577	PQZCFIYKHNXZOH-ZMOGYAJESA-N	364.424	3.795	50	40	FHGB	
N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3/C[C@@H]4C=CC[C@H]34)cc2)cc1	96708556	HXGHNTSONLLCSQ-YOEVCPMYSA-N	357.413	3.672	50	40	FHGB	
Cc1cc([N+](=O)[O-])c(C)cc1-c1ccc(/C=N/NC(=O)c2cccnc2)o1	809061	BGVUOZUHJNDGSD-SRZZPIQSSA-N	364.361	3.631	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)CSc2cccc3cccnc23)cc1	2282026	IXSXTTYWWZZWAL-LPYMAVHISA-N	364.474	3.543	50	40	FHGB	
O=C(N/N=C/c1ccc(OCc2cccc(F)c2)cc1)c1cccc(O)c1	13321740	RXHZPYLSCAQJSG-YDZHTSKRSA-N	364.376	3.874	50	40	FHGB	
CN(C)C(=O)[C@H](c1ccccc1)P(=O)(c1ccccc1)c1ccccc1	1717464	JAXORYJLLZFBDB-NRFANRHFSA-N	363.397	3.830	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccc(-c3ccc(Br)cc3)o2)[nH]n1	18240572	BYDHJEQMTGJUOS-GIJQJNRQSA-N	373.210	3.505	50	40	FHGB	
CC1=CC(=O)[C@](Cl)(C(C)C)[C@H](Cl)/C1=N/S(=O)(=O)c1ccccc1	5602484	AMXLKTIEMKDGJB-RSOPOUMMSA-N	374.289	3.586	50	40	FHGB	
CSc1ccc(/C=N/NC(=O)c2ccc(NC(=O)C3CC3)cc2)cc1	674448	UWYAFPDESMMIGI-UDWIEESQSA-N	353.447	3.521	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=N/NC(=O)[C@@H](C#N)c3ccccc3)c2c1	409204962	MMLRJTQHVAOOQK-OEBVFIGYSA-N	373.412	3.614	50	40	FHGB	
CCOc1cc(Br)c(Br)c(/C=C/C=O)c1O	40544654	UTGIPPNNVXJRAW-ONEGZZNKSA-N	350.006	3.528	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccccc2OC(F)F)c2ccccc2n1	3279438	QUGBFRSUPOMTTP-SSDVNMTOSA-N	355.344	3.909	50	40	FHGB	
O=C(c1ccccc1OC(F)F)[C@H](Br)CBr	309349207	ZYTFUMFPQQJKLD-SSDOTTSWSA-N	357.976	3.629	50	40	FHGB	
Cc1oc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)cc1Br	6184469	HFBXYOIFEAZFOI-DTQASYIRSA-N	367.268	3.981	50	40	FHGB	
CC(=O)N/N=C/c1cccc(OCCCOc2ccc(Cl)c(C)c2)c1	9553320	YIEVUAYSZWJLBB-FYJGNVAPSA-N	360.841	3.966	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)ccc1OC(C)=O	408765349	VLINDKZXPNXCAZ-BOPFTXTBSA-N	364.401	3.865	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)NCc2cccs2)cc1OCC	6949277	QJIHODMUJYNOMY-XNTDXEJSSA-N	356.447	3.769	50	40	FHGB	
N#C/C(=C/c1cccn1-c1cccc(C(=O)O)c1)C(=O)Nc1ccccc1	101529988	FTRWFSVVETZJKP-SSZFMOIBSA-N	357.369	3.721	50	40	FHGB	
N#C/C(=C/c1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)Nc1cccc(Cl)c1	33466983	JBAWDBLPKVWTKX-WCIBSUBMSA-N	371.736	3.523	50	40	FHGB	
COc1ccc(C(=O)NNC(=O)[C@H](c2ccc(Cl)cc2)C(C)C)cc1	14244750	JZMMVJSRLICZSN-KRWDZBQOSA-N	360.841	3.549	50	40	FHGB	
Cc1nn(C)c(Cl)c1C(=O)NN=C(c1ccccc1)c1ccccc1	95947067	NSENPAFLEGTFTK-UHFFFAOYSA-N	352.825	3.564	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N\NC(=O)c3ccccc3O)o2)c([N+](=O)[O-])c1	408872253	BYVNQUYSYHESGY-JAIQZWGSSA-N	365.345	3.633	50	40	FHGB	
Cc1ccc(COc2ccc(/C=N/NC(=O)c3ccc(N)cc3)cc2)cc1	5363069	PVPUGTYWULVFOI-ZVHZXABRSA-N	359.429	3.920	50	40	FHGB	
COc1cc(N2CCCC2)ccc1/C=C(/C#N)C(=O)Nc1ccc(O)cc1	6544867	AXMDUYPDIUEJPR-VBKFSLOCSA-N	363.417	3.547	50	40	FHGB	
O=C(N/N=C/c1c(F)c(F)c(F)c(F)c1F)c1cc(Cl)ccc1O	2746584	QYKCOOVKDASDIW-IPBDZQFASA-N	364.657	3.505	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccc(OC)cc1OC	107995346	FRRIMKQDOOBJOF-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
O=C(NNC(=S)Nc1ccc(SC(F)F)cc1)c1ccc(F)cc1	3175722	WAPROQOEDWESSR-UHFFFAOYSA-N	371.409	3.772	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2OC)c(OC)c1	3205091	NMGMQOKPMPNZOO-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
COC(=O)c1ccc(Cl)c(-c2ccc(/C=N\NC(=O)c3ccco3)o2)c1	409064199	OIIXOFZDNWFHRG-JMIUGGIZSA-N	372.764	3.744	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(C)c([N+](=O)[O-])c3)cc2c1	409187602	SHRQRIUGBMJUFD-JAIQZWGSSA-N	367.361	3.812	50	40	FHGB	
CCCCN1C(=O)/C(=C\C=C\c2ccccc2)C(=O)N(CCCCl)C1=O	17118203	MSRYHGKHZMGRSY-RMXCOSCZSA-N	374.868	3.846	50	40	FHGB	
COc1c(Cl)cc(Cl)cc1/C=C/C(=O)NNC(=O)c1cccs1	1262991	KLDUDKFOSGSLPV-SNAWJCMRSA-N	371.245	3.538	50	40	FHGB	
Cc1cc([C@@H]2C(C#N)=C(N)N(N(C)C)C3=C2C(=O)CC(C)(C)C3)c(C)s1	1444543	JHMAJDUSFWQSAB-QGZVFWFLSA-N	370.522	3.578	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccc2c(c1)OCO2)c1cccc2ccccc12	409180035	USTIOMPAIDKKHE-OEAKJJBVSA-N	361.401	3.521	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1cccc(OC)c1OC	408796053	CZJRLUAFSLOWIA-UKTHLTGXSA-N	372.808	3.911	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)cc1C(=O)O	409169208	PPOJUFNWTXPUOV-XNTDXEJSSA-N	350.374	3.638	50	40	FHGB	
CCC[C@@H](Br)C(=O)Nc1nc2ccc(C(=O)OC)cc2s1	20132742	REPVFSSCSDNBGO-SECBINFHSA-N	371.256	3.585	50	40	FHGB	
CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccoc2)C(C#N)=C(N)S1	1073888	PIRILUYIFGBTCL-KRWDZBQOSA-N	352.415	3.821	50	40	FHGB	
CC(=O)Nc1ccc(C2=NN(C(=O)CCl)[C@@H](c3cccs3)C2)cc1	23175939	JEYVOXWFEXRISB-OAHLLOKOSA-N	361.854	3.623	50	40	FHGB	
Cc1ccsc1C(=O)NNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C	3304161	XLNAGHDTZYDBGP-UHFFFAOYSA-N	371.437	3.678	50	40	FHGB	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(Cl)s1	12917307	CNAKXZMGTXNMNW-LLVKDONJSA-N	374.849	3.783	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cc(Cl)ccc2[N+](=O)[O-])o1)c1cccnc1	408973648	NJUGASXHXHUKPD-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)cccc1[N+](=O)[O-]	408872899	KVXYEMIFKCNLIP-RGVLZGJSSA-N	355.394	3.702	50	40	FHGB	
O=C(NC1CCC(I)CC1)OCc1ccccc1	79436645	JFTNWQVLMRFZNZ-UHFFFAOYSA-N	359.207	3.659	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)N2CCOCC2)c(C)n1-c1ccc(Cl)cc1	98035283	ZDTRSXYZVCMYFK-ATVHPVEESA-N	369.852	3.513	50	40	FHGB	
CCCCOc1ccc([C@@H]2C(C#N)=C(N)OC3=C2CCCC3=O)cc1OC	5792941	FGZOMSVDIHZTAG-IBGZPJMESA-N	368.433	3.689	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(C34CC5CC(CC(C5)C3)C4)c2[C@@H]1c1ccco1	4171146	PADVCXCRTPQXOQ-SQUXUUBPSA-N	362.433	3.689	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)c2ccccc12	6860785	OFFTXKPMMAZMEJ-YDZHTSKRSA-N	362.429	3.994	50	40	FHGB	
Cc1cc(C(=O)N/N=C2/CC(=O)c3ccccc32)c(C)n1-c1ccccc1	102671435	PHMCEQREYZXUHQ-ATJXCDBQSA-N	357.413	3.815	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)Cc2ccc(C)cc2C)cc1OC	20195114	YJPZTHRDZJXIJG-HYARGMPZSA-N	352.434	3.570	50	40	FHGB	
Cc1ccc(C(=O)Oc2cccc(/C=N/NC(=O)c3ccccc3)c2)cc1	408878929	BTMGTBLFJWIZLI-HZHRSRAPSA-N	358.397	3.978	50	40	FHGB	
C[C@@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1	1092203	ODWWIJNRECTXDI-CNRHGSOZSA-N	362.389	3.699	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@H]1c1ccc(C)cc1	629542	VPUYSAARIPPTHH-GOSISDBHSA-N	360.413	3.777	50	40	FHGB	
COc1ccccc1C(=O)N/N=C(/CC(=O)c1cccs1)C(F)(F)F	4492562	QONLABMPXXRWRL-ZHZULCJRSA-N	370.352	3.678	50	40	FHGB	
CCCCOc1ccccc1[C@@H]1C(C#N)=C(N)OC(C)=C1C(=O)OCC	4129570	WGEJNQDNYBCQTG-GOSISDBHSA-N	356.422	3.510	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C/c1ccccc1Cl	8812651	SAFFVTDALGEBQA-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
CC(C)(C)C[C@H](NC(=O)NNC(=O)c1ccccc1O)c1ccccc1	46898038	HNQGARYEKCZXLX-INIZCTEOSA-N	355.438	3.514	50	40	FHGB	
O=C(CCSc1ccc(Cl)cc1)N/N=C/c1cccc([N+](=O)[O-])c1	20248039	HWQUPHMDDKZBPH-WOJGMQOQSA-N	363.826	3.881	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)c1c[nH]c2ccccc12	48253951	APIKHYMXXDVRGX-LGMDPLHJSA-N	357.413	3.794	50	40	FHGB	
CC(/C=N/NC(=O)Cn1nc2ccccc2n1)=C\c1ccccc1C(C)C	1070053	UKBWACICHPVYGR-WWHPCQJGSA-N	361.449	3.760	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C/c1ccccc1Br	3174592	QNJRRIQLCFCRQE-GIJQJNRQSA-N	367.630	3.632	50	40	FHGB	
CC1=C(C#N)C(O)=NC(=O)/C1=C\c1ccc(-c2ccc(C)cc2[N+](=O)[O-])o1	6029258	NNYFCPFQGDTGSR-ZSOIEALJSA-N	363.329	3.883	50	40	FHGB	
COc1cccc([C@H]2CC(=O)N3CN(C4CCCC4)CSC3=C2C#N)c1	20348144	ZOACPYVPNKAXIA-QGZVFWFLSA-N	369.490	3.653	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(-c3ccc(F)cc3)o2)cc1	104756687	SXJGXVHRKCICMT-FSJBWODESA-N	351.381	3.956	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)cc1	409127732	RCNWKDILWAVIAY-QQHUYRGFSA-N	369.490	3.974	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)c2ccc(OCC)c(OCC)c2)cc1	409331419	DBDIOZPRRIYARS-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
C[Si](C)(C)O[Si](O[Si](C)(C)C)(c1ccccc1)c1ccccc1	195791533	QBNMGMSLXRJOOX-UHFFFAOYSA-N	360.678	3.946	50	40	FHGB	
C/C(CC(=O)Nc1cccc(Cl)c1)=N\NC(=O)COc1cccc(C)c1	4550745	KWJFOXNBSFIIJN-HYARGMPZSA-N	373.840	3.548	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC(C)=O)cc2)c1	408755490	OABWEKOCQGRPLS-LFIBNONCSA-N	350.374	3.556	50	40	FHGB	
CC(=O)Oc1ccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)cc1	109041474	TXWFLIVWAVBQLX-VXLYETTFSA-N	362.838	3.508	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)CCSc2ccccc2)cc1OC	59473399	SQALHPDNIKHRLU-XSFVSMFZSA-N	358.463	3.726	50	40	FHGB	
CCOC(=O)N/N=C/c1ccccc1OCCOc1c(C)cccc1C	4525980	PWZUBYPNKQWQLZ-KGENOOAVSA-N	356.422	3.841	50	40	FHGB	
O=C(N/N=C\c1cc([N+](=O)[O-])ccc1Cl)c1cccc(-n2cccc2)c1	409101432	BSXMOIJICLXOLP-NDENLUEZSA-N	368.780	3.803	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1OC	7889927	AFUQRBJDDAJVQO-PXLXIMEGSA-N	363.417	3.649	50	40	FHGB	
CCSC1=C(C#N)[C@H](c2ccc(O)c(OC)c2)C2=C(CCCC2=O)N1	13284579	PCQFJVWEHKIOTJ-KRWDZBQOSA-N	356.447	3.583	50	40	FHGB	
C/C(=N\NC(=O)[C@H]1Oc2ccccc2O[C@H]1c1ccccc1)c1ccncc1	95532832	GXMPUDGJNOMCAZ-LZZAFKOHSA-N	373.412	3.503	50	40	FHGB	
CC(C)CC(=O)Nc1ccc(C(=O)N/N=C2\CC(=O)CC(C)(C)C2)cc1	100066218	FEJLMNVSQLKLDT-CJLVFECKSA-N	357.454	3.536	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Cl)cc1Cl)=N\NC(=O)c1ccccn1	100927702	XEBUSYNRMJHMLV-UFFVCSGVSA-N	365.220	3.523	50	40	FHGB	
CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COc1ccc(C#N)cc1Cl)C2	102446677	SMKHFOMYKJTRNT-CBJFBRNBSA-N	359.857	3.909	50	40	FHGB	
CC1=C(C#N)C(=O)NC(=O)/C1=C\c1ccc(-c2cccc3ccccc23)o1	12469615	YMKOUVGSDDXZKL-WQRHYEAKSA-N	354.365	3.980	50	40	FHGB	
N#C/C(=C\Nc1cc(F)cc(F)c1)S(=O)(=O)c1ccc(Cl)cc1	6088172	WNKKDGVQFDPXQT-OQLLNIDSSA-N	354.765	3.869	50	40	FHGB	
C/C(=N\NC(=O)Cc1cccc2ccccc12)c1cc([N+](=O)[O-])cs1	4549781	FDJMODDSCUQYMA-XDHOZWIPSA-N	353.403	3.892	50	40	FHGB	
CCn1cc(/C=C(\C#N)C(=O)NCc2ccc3c(c2)OCO3)c2ccccc21	6568614	VDLWFRLOIPIEDP-MHWRWJLKSA-N	373.412	3.613	50	40	FHGB	
CC(C)(C)OC(=O)NNC(=O)CSCc1ccc(Cl)c(Cl)c1	6999782	XPCCVGIDHMNZJL-UHFFFAOYSA-N	365.282	3.783	50	40	FHGB	
O=C(c1cccc(OC(F)F)c1)[C@@H](Br)CBr	309549362	JLSMXAFXBLFYEY-QMMMGPOBSA-N	357.976	3.629	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)c(C)n1-c1ccncc1	409195214	SGMHQIVVHRKIFT-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1C	408811726	OEVSQLVNGFTMQJ-LDADJPATSA-N	360.413	3.870	50	40	FHGB	
Cc1cccc(C)c1NCC(=O)N/N=C\c1cccc(Br)c1	30738321	SNIOBUJTSUCULN-JMIUGGIZSA-N	360.255	3.628	50	40	FHGB	
C/C(=N/NC(=O)C1CCCCC1)c1ccc(NC(=O)C(F)(F)F)cc1	6021380	GWZOUIJKCYKAPU-JJFYIABZSA-N	355.360	3.608	50	40	FHGB	
CCOc1cc(C(=O)N/N=C2/C[C@@H]3C=CC[C@@H]23)cc(OCC)c1OCC	5463677	KVNSPZJFCLHDFD-KEMFXACRSA-N	358.438	3.565	50	40	FHGB	
Cc1cc2c(cc1/C=N/NC(=O)c1cccnc1)[C@H](C)CC(C)(C)N2C	208214730	UWUPSYXUWWTZLI-LJGKHRNASA-N	350.466	3.876	50	40	FHGB	
Cc1cc(C)c(OCC(=O)N/N=C/c2c(O)ccc3ccccc23)c(C)c1	59519624	QOJGASWMMNDWET-FSJBWODESA-N	362.429	4.000	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1	2805750	JPTTYGFYSBCARQ-GHRIWEEISA-N	363.417	3.777	50	40	FHGB	
Cc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	12851722	MPGUTLMBCSMITB-OAHLLOKOSA-N	363.417	3.768	50	40	FHGB	
O=C(N/N=C/c1cc(Cl)cc(Br)c1O)c1cccs1	4132801	FTCYZNRTCFQAGE-GIDUJCDVSA-N	359.632	3.634	50	40	FHGB	
COc1cc(OC)c(/C(C)=N\NC(=O)c2cccc(Cl)c2)c(OC)c1	5282390	CNZQHJLOYHIHHE-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=C(\C#N)C(=O)Nc1ccccc1	408999274	ULNNDKUTLDGYPS-FOWTUZBSSA-N	364.405	3.987	50	40	FHGB	
Cc1ccc([N+](=O)[O-])cc1-n1c(C)cc(/C=N/NC(=O)c2ccco2)c1C	408587694	GRMDKHUBHDIOHN-RGVLZGJSSA-N	366.377	3.668	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C/c1cccc(OC(=O)/C=C/c2ccco2)c1	3033889	DRBRYLVOXIMHBJ-KHUKTUNBSA-N	374.396	3.591	50	40	FHGB	
COc1c(Br)cc(Br)cc1/C=C/C(=O)Cl	2578564	RRUMAYVRTRVPDI-NSCUHMNNSA-N	354.425	3.999	50	40	FHGB	
C/C(=N\NC(=O)COc1cc(C)ccc1C(C)C)c1ccc([N+](=O)[O-])cc1	1433425	RAROVOFWIAGGPU-RCCKNPSSSA-N	369.421	3.946	50	40	FHGB	
Cc1ccc2nc(Cl)c([C@H]3C(C#N)=C(N)Oc4cc(N)ccc43)cc2c1	899596	PGXJWRZSBTYYGB-SFHVURJKSA-N	362.820	3.997	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C12CC3CC(CC(C3)C1)C2	4753999	KXLSQVAUVHUCFU-UHFFFAOYSA-N	370.537	3.957	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc3ccccc3c2)cc(OC)c1OC	657596	JQJZIGSILXHZOO-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(F)cc2[N+](=O)[O-])o1)c1cccs1	1096462	QYPAIFWTFJWJCJ-GIJQJNRQSA-N	359.338	3.819	50	40	FHGB	
COc1ccc(CNNC(=O)C[C@@H](c2ccc(F)cc2)c2ccco2)cc1	12390649	STHNLWUCWUIMTC-IBGZPJMESA-N	368.408	3.770	50	40	FHGB	
COC(=O)CCCCCN/C(S)=C(\C#N)c1nc2ccccc2s1	105304428	ANVSHMFIYPDNHX-VBKFSLOCSA-N	361.492	3.741	50	40	FHGB	
CNP(Br)(c1ccccc1)(c1ccccc1)c1ccccc1	104111267	UIRNPIYOKOYSEE-UHFFFAOYSA-N	372.246	3.961	50	40	FHGB	
C/C(=N/NC(=O)[C@H]1C[C@H]1c1ccccc1)c1cccc(NC(=O)C2CC2)c1	17074418	KDHORHKPXUVVTA-UWLAKRBBSA-N	361.445	3.679	50	40	FHGB	
Cc1ccc([C@@H]2C[C@H]2C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	8685695	KYMUYZDKPNXNDH-JKSUJKDBSA-N	359.882	3.770	50	40	FHGB	
Cc1ccc(Sc2ccc(/C=C(/C#N)C(=O)N3CCOCC3)cc2)cc1	409243394	WCSBRBVDOQQICP-JXAWBTAJSA-N	364.470	3.912	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1OCC	65997623	QDNSHSUYKKVHMF-FYJGNVAPSA-N	360.841	3.830	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)c2cc3cc(OCC)ccc3o2)cc1	409188075	WSQHXXBVYNPYOM-BKUYFWCQSA-N	352.390	3.994	50	40	FHGB	
O=C(NN(c1ccccc1)c1ccccc1)C1CCN(C(=O)C2CC2)CC1	36725129	HDNIJSFKHYDFLT-UHFFFAOYSA-N	363.461	3.505	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1	96840682	JFJLLXJDKCQDFU-XFFZJAGNSA-N	359.769	3.940	50	40	FHGB	
COC(=O)c1cc(N/C=C(\C=O)c2nc3ccccc3o2)ccc1Cl	2062371	NZZGRYSAIRBYPA-PKNBQFBNSA-N	356.765	3.920	50	40	FHGB	
Cc1ccc([C@H](NC(=O)N2C[C@@H](C)O[C@H](C)C2)C(Cl)Cl)cc1F	3212601	HVZZCOGLJCDBBM-GYSYKLTISA-N	363.260	3.798	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)[C@H]2[C@H]3CCCC[C@]23C)cc1[N+](=O)[O-]	100177055	DGXSHMSRISYRIG-DLVQAKNOSA-N	359.426	3.660	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)c2cc3ccccc3o2)cc(OC)c1OC	408853551	PGQHYBAGNNAAQM-XKZIYDEJSA-N	364.401	3.942	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)c2ccccc12	409197090	VREAFWSYDLRJOC-FBTHGLLTSA-N	357.413	3.996	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@H]2C[C@@H]3C=C[C@H]2C3)cc(OCC)c1OCC	4150421	ZNEHIIAWOIPSAR-IYJAZHSYSA-N	372.465	3.811	50	40	FHGB	
CC(C)N(C(=O)OCc1ccccc1)[C@H]1CC[C@H](NC(=O)CCl)CC1	242687833	UWXDOTWCMIZPEQ-QAQDUYKDSA-N	366.889	3.700	50	40	FHGB	
Cc1nc(Cl)c(C[C@H](Br)CBr)c(Cl)n1	2254696	PBRBWLPPSRTUND-YFKPBYRVSA-N	362.880	3.793	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)c2sccc2C)c([N+](=O)[O-])cc1OC	48366817	ZOPAMWGOVZWSMS-SDQBBNPISA-N	358.375	3.772	50	40	FHGB	
CCc1cccc(OCC(=O)NN=Cc2c(OC)ccc3ccccc23)c1	245241393	COMFDULREWSWQD-UHFFFAOYSA-N	362.429	3.940	50	40	FHGB	
CCOc1ccc2ccc(OCC)c(/C=N\NC(=O)c3ccncc3)c2c1	15224557	UHXFABJLMOZNEV-UCQKPKSFSA-N	363.417	3.796	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)CSCCc2ccccc2)cc1	5321766	IECOCOKHASMUJJ-CJLVFECKSA-N	369.534	3.959	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C/c1cc(Cl)cc([N+](=O)[O-])c1O)c1ccccc1	15980926	KUQLXLLTNAYQOM-NGPAHMQLSA-N	371.780	3.738	50	40	FHGB	
COc1ccc([C@H]2CC(=O)N3CN(C4CCCC4)CSC3=C2C#N)cc1	20347987	PVUMOIWHLMZPSZ-QGZVFWFLSA-N	369.490	3.653	50	40	FHGB	
Cc1n[nH]c2c1[C@@H](c1ccc(F)c(Oc3ccccc3)c1)C(C#N)=C(N)O2	804047	LPAFRQAQWKXFMT-SFHVURJKSA-N	362.364	3.868	50	40	FHGB	
CCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2ccccc2[N+](=O)[O-])c1C	46135996	ACZWPKCUUQUKAA-WOJGMQOQSA-N	366.421	3.647	50	40	FHGB	
O=C(NNC(=O)c1cccc2ccccc12)c1cccc(Br)c1	2022295	RLIWEADVGOABFV-UHFFFAOYSA-N	369.218	3.677	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2ccccc2OCC)cc1OCC	6355788	IBXKOCSCRQRIRL-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
CC/C(=N\NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1	4491476	DCQDUBYNKGKSCP-KGENOOAVSA-N	364.232	3.862	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c(C)n1-c1ccccc1	3251382	QOYVZPARARWRIW-FYJGNVAPSA-N	362.389	3.766	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nc2ccccc2C)ccc1OCC#N	408742480	ALTFACCDLRRWOH-ATVHPVEESA-N	361.401	3.842	50	40	FHGB	
COc1ccc(/C=C/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1	4723179	UWBYKERGCUDEAH-AHEGLGOKSA-N	371.440	3.999	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C\c2ccc(-c3ccccc3F)o2)cc1	4724666	KMUQKRJIWAPLAV-UUYOSTAYSA-N	352.365	3.923	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1	4953674	HKHWNUSOLYWHHL-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(N2CCCCC2)o1	409001464	WCCKCFPZAMZWBI-AUQXIXNCSA-N	357.479	3.901	50	40	FHGB	
CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)CBr	1717088	PXNOMHXZYIPREU-UHFFFAOYSA-N	368.252	3.925	50	40	FHGB	
COC(=O)c1ccc(N/C=C(\C=O)c2nc3cc(Cl)ccc3o2)cc1	2741272	XMPLRXNJDQMCBH-FMIVXFBMSA-N	356.765	3.920	50	40	FHGB	
C=CCOc1cccc(/C=N\NC(=O)c2c(C)nc3ccc(Cl)cn23)c1	59435502	TWFJANPJVQWRRA-NHDPSOOVSA-N	368.824	3.625	50	40	FHGB	
CCCCC(O)(CCCC)C(=O)NN(C(=O)OC)c1ccc(C)cc1	2302492	QLOCIJJGPBGSRH-UHFFFAOYSA-N	350.459	3.711	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)NCCCc2ccccc2)c(OC)c1C	409234656	ONBXTEZZQMQYJY-RGEXLXHISA-N	364.445	3.668	50	40	FHGB	
CCCCCC(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	32906329	DURHZAUMHLJKCU-UHFFFAOYSA-N	351.406	3.836	50	40	FHGB	
CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(Cl)cc2Cl)cc1	5378361	OOGIFLCDXKMVOO-DJKKODMXSA-N	350.205	3.716	50	40	FHGB	
Cn1cccc1/C=C(/C(=O)c1ccccc1)N1C=CC=CC1=C(C#N)C#N	15906040	DVLCLJMXJVXATP-STZFKDTASA-N	352.397	3.936	50	40	FHGB	
O=c1ccc(/N=C\c2ccc(N(CCCl)CCCl)cc2)ccc1O	104056850	YJNYYVQHOYUIOW-BKUYFWCQSA-N	365.260	3.787	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1Br)c1ccc([N+](=O)[O-])cc1	5382025	QYUXUKHORQCLMU-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
C/C(CC(=O)Nc1cccc2ccccc12)=N\NC(=O)Cc1cccs1	101960425	FDFZACRDPOAOOW-HYARGMPZSA-N	365.458	3.965	50	40	FHGB	
C/C(CCc1ccccc1)=N\NC(=O)CN1C(=O)c2cccc3cccc1c23	106824844	RDYXNOPAIBGYBU-LFVJCYFKSA-N	371.440	3.925	50	40	FHGB	
O=C(CCCC[C@@H]1CCSS1)Nc1ccc(Cn2cncn2)cc1	24629847	LFBLGRHXZKUPHH-MRXNPFEDSA-N	362.524	3.979	50	40	FHGB	
CN1CCC(=NNC(=O)c2ccc(CSCc3ccccc3)cc2)CC1	408827522	KDFHAJPBFRSZES-UHFFFAOYSA-N	367.518	3.931	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CC2(C)SCCS2)c(OCC)c1	409254572	ICPILYCVHMWVMN-LDADJPATSA-N	368.524	3.520	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N\NC(=O)c3cccc(O)c3)o2)c([N+](=O)[O-])c1	408719530	NCPBCYHHMXQJNW-JAIQZWGSSA-N	365.345	3.633	50	40	FHGB	
Cc1ccc2nc(C)c(C(=O)N/N=C/c3ccccc3C(F)(F)F)n2c1	408976382	AQCCVGSJKVDRLE-LSFURLLWSA-N	360.339	3.734	50	40	FHGB	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H](C)c2ccccc2)c1C	78267774	YBIUABXOMXQMQO-FPXKJXHESA-N	351.450	3.536	50	40	FHGB	
CC[C@H]1CCC2=C(C1)[C@@H](c1ccccc1)[C@@](C#N)(C(=O)OC)C(N)=C2C#N	16636816	YQRJFHQSMAWMSZ-BPSNYSSFSA-N	361.445	3.710	50	40	FHGB	
CCCCSC1=C(C#N)[C@@H](c2ccccc2OCC)[C@H](C#N)C(=O)N1	9015528	OEFOPYWMSATOTR-YOEHRIQHSA-N	355.463	3.707	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccco2)ccc1OCc1ccccc1	1475153	QFHPRIZRMDDZFE-FYJGNVAPSA-N	350.374	3.631	50	40	FHGB	
COc1ccc2c(Cl)c(C(=O)NNC(=O)c3ccc(C)cc3)sc2c1	674954	ASFQUYFLONQABP-UHFFFAOYSA-N	374.849	3.947	50	40	FHGB	
COc1ccc2[nH]cc(/C=N/NC(=O)c3ccc(Br)cc3)c2c1	2423161	LBDNQLMXOPEVOD-KEBDBYFISA-N	372.222	3.703	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)Cc2ccc(CC)cc2)cc(Cl)c1O	409364412	PLJHFVXILRMXCO-MTJSOVHGSA-N	360.841	3.700	50	40	FHGB	
N#CC1=C(SCCOc2ccccc2)NC(=O)C[C@H]1c1ccc(F)cc1	409303216	MHEBAKNVNYRAJO-KRWDZBQOSA-N	368.433	3.977	50	40	FHGB	
O=C(Cl)[C@@H]1CC(=O)N(c2cc(C(F)(F)F)ccc2N2CCCCC2)C1	45888121	IODPMIKMSVHQBE-LLVKDONJSA-N	374.790	3.814	50	40	FHGB	
ClCCN(CCCl)c1ccc(CCCCN2CCOCC2)cc1	95752427	BNNZIUGHGJYUOP-UHFFFAOYSA-N	359.341	3.626	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2cn(CC(=O)O)c3ccccc23)cc1	5007755	FSISHMPIUICZMR-GDNBJRDFSA-N	359.385	3.580	50	40	FHGB	
C#CCOc1ccc(/C=C(/C#N)C(=O)N[C@H](C)c2ccccc2)cc1OCC	207829075	NOEWINKMVIUUPL-LCJWNIEWSA-N	374.440	3.882	50	40	FHGB	
COc1ccc(-c2n[nH]cc2/C=C(/C#N)C(=O)NC2CCCCCC2)cc1	17074905	FGQPNVSSEWTFSY-VBKFSLOCSA-N	364.449	3.831	50	40	FHGB	
Cc1ccc(C)n1NC(=O)/C(C#N)=C\c1ccc(-c2ccccc2C#N)o1	409377257	HAQOQXMOFJHINF-BOPFTXTBSA-N	356.385	3.914	50	40	FHGB	
N#C/C(=C/c1cccn1-c1ccc(O)cc1)C(=O)NCCCc1ccccc1	409221977	AIKRACFNNLCXPQ-MNDPQUGUSA-N	371.440	3.839	50	40	FHGB	
CC(C)OC(=O)N[C@@H]1c2ccccc2CC[C@@H]1I	17352952	XVBFCQDDPWPAKJ-QWHCGFSZSA-N	359.207	3.612	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)NN=Cc1ccc(Cl)cc1)c(C)n2C	15985389	ICHVQFCBGVXEKY-UHFFFAOYSA-N	355.825	3.913	50	40	FHGB	
O=C(CCCl)Nc1ccc(C(=O)Nc2nnc(-c3ccccc3)o2)cc1	9062094	RYYVMJRJJOJYOZ-UHFFFAOYSA-N	370.796	3.556	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2c[nH]c3cccc(Cl)c23)cn1	61718016	WBAONUGVRHTPDR-YRNVUSSQSA-N	352.781	3.771	50	40	FHGB	
N#C/C(=C\c1cccc(F)c1)S(=O)(=O)c1ccc(Br)cc1	7917199	RVXHCTIXKSPVLV-OQLLNIDSSA-N	366.211	3.927	50	40	FHGB	
COc1cc(/C=N/NC(=O)CCSc2ccc(Cl)cc2)ccc1O	20248761	VUOXBJVZRGCLIL-YBFXNURJSA-N	364.854	3.687	50	40	FHGB	
NNC(=O)c1cc(-c2ccc(-c3ccccc3)cc2)n(-c2ccccc2)n1	408723923	ANAHZQYXDHPMOO-UHFFFAOYSA-N	354.413	3.810	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C\c2ccc(C)c([N+](=O)[O-])c2)c1	408746866	WYHMKBIJAWZAIG-DHDCSXOGSA-N	351.362	3.848	50	40	FHGB	
CC(C)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1	17073772	MPCMWQWYJFXIGI-SFHVURJKSA-N	357.413	3.870	50	40	FHGB	
CCOC(=O)c1sc(CC(=O)/C(C#N)=C/c2ccccc2)c(C#N)c1C	107952695	CTZGMHVRMDIKLJ-OQLLNIDSSA-N	364.426	3.824	50	40	FHGB	
CCC(C)(C)[C@H]1CCc2[nH]nc(C(=O)N/N=C\c3ccc(F)cc3)c2C1	33336186	YOQYZTXXADEVBO-ZDXHCBJDSA-N	356.445	3.854	50	40	FHGB	
Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)c2cccs2)o1	59197665	OEGJOVNIEZBOIW-VCHYOVAHSA-N	355.375	3.989	50	40	FHGB	
COC(=O)Nc1ccc(S(=O)(=O)Sc2cccc3cccnc23)cc1	28628043	AZSWZDJBSPXDMM-UHFFFAOYSA-N	374.443	3.894	50	40	FHGB	
CC(C)(C)c1cc(/C=N/NC(=O)c2cncc(O)c2)cc(C(C)(C)C)c1O	15414553	KEWWZIDVIURCLK-AUEPDCJTSA-N	369.465	3.852	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N/NC(=O)c3ccco3)c2C)cc1[N+](=O)[O-]	409000397	YTLXIVZHLSPDRC-RGVLZGJSSA-N	366.377	3.668	50	40	FHGB	
N#C/C(=C/c1ccc(Sc2ccc(Cl)cc2)cc1)C(=O)NC(N)=O	409240430	KRSWOTVOAJNRJY-XFXZXTDPSA-N	357.822	3.593	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2OC)cc1OC	5654045	GXOZNVMIVOSRHG-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
CCN(CC)c1ncc(/C=N/NC(=O)c2cc3ccccc3cc2O)s1	7949743	SIJGVROBKGHIGX-CIAFOILYSA-N	368.462	3.612	50	40	FHGB	
CCOc1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)ccc1OC	818659	IROVYXILADISDQ-GOSISDBHSA-N	368.433	3.545	50	40	FHGB	
CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	4940425	HROKMTWSVSFHHI-QWBHJXDQSA-N	356.209	3.636	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc(O)c2)ccc1OC(C)C	1453889	AKURTJSHJPTNFQ-OQLLNIDSSA-N	352.390	3.734	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1ccc(O)cc1)c1cccc(C(F)(F)F)c1	1106794	BDBPOCWGKRUOSI-FSJBWODESA-N	373.334	3.966	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@H]2CC=CCC2)cc(OCC)c1OCC	4646736	DFBYNJYNYSHIIE-HBBMIWKISA-N	360.454	3.955	50	40	FHGB	
COc1cccc(CSC2=C(C#N)C3(CCCCC3)C(C#N)=C(N)N2)c1	4721648	UPQPODRYLAMTTA-UHFFFAOYSA-N	366.490	3.911	50	40	FHGB	
Cc1cc(-c2ccccc2)nc2oc(C(=O)N/N=C/c3cccnc3)c(N)c12	642380	IERAUNNYSCXYDC-WYMPLXKRSA-N	371.400	3.544	50	40	FHGB	
COc1cc2ccccc2cc1C(=O)N/N=C/c1cc2c(cc1C)OCO2	107896194	GBYFJXCRQMVMAX-SSDVNMTOSA-N	362.385	3.649	50	40	FHGB	
COc1cc(/C=N/NC(=O)OC(C)(C)C)ccc1OC(=O)OC(C)(C)C	3354075	YFGVQRDXBQCVGD-YBFXNURJSA-N	366.414	3.868	50	40	FHGB	
N#C/C(=C/Nc1ccc(F)c(F)c1)S(=O)(=O)c1ccc(Cl)cc1	5489182	TYJJMGQZVHTXMJ-LCYFTJDESA-N	354.765	3.869	50	40	FHGB	
CC(=O)N/N=C/c1c(Br)c(C)n(-c2ccc(C)c(C)c2)c1C	20243818	NKSOJSKQXJGUMZ-DJKKODMXSA-N	362.271	3.943	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C\c2cccc(OCC)c2)cc1OC	409310370	AVBZHCQMQBJEIH-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
FC(F)(F)[C@@H](Br)COC[C@H](Br)C(F)(F)F	1083807990	OVGIBYXHSJQMIX-IMJSIDKUSA-N	367.909	3.655	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccccc2Cl)o1)[C@@H](O)c1ccccc1	1248506	KBIJEORWNUZLRL-IUOVYFEOSA-N	354.793	3.784	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc3c(c2)CN(c2ccccc2)C3)cc1	1028918	CHKUCXKEADSVLL-ZVHZXABRSA-N	371.440	3.979	50	40	FHGB	
O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1)c1cccc(Cl)c1	409007597	PRFBKQCBUDOINS-UDWIEESQSA-N	372.812	3.612	50	40	FHGB	
O=C(NNc1cccc2cccnc12)C(O)(c1ccccc1)c1ccccc1	2305383	ZRKVRENWKVGOIR-UHFFFAOYSA-N	369.424	3.614	50	40	FHGB	
O=C(COc1cccc2ccccc12)N/N=C/c1cc(Cl)ccc1O	726732	USPMCKOEGUDHAT-SRZZPIQSSA-N	354.793	3.728	50	40	FHGB	
Cc1cc(/C=N\NC(=O)COc2ccc(Cl)cc2Cl)cc(C)c1O	109748035	LUZHFWLXWOPHBB-ZBKNUEDVSA-N	367.232	3.845	50	40	FHGB	
N#C/C(=C\c1c(-c2ccc(Br)s2)nc2ccccn12)C(=O)O	55036920	KBKNDMXKWVHFDY-VQHVLOKHSA-N	374.219	3.817	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/c1c(O)ccc2oc3c(c12)CCCC3	2287679	UPXDPVUEMKQHJV-WSDLNYQXSA-N	364.401	3.790	50	40	FHGB	
C/C(=N/NC(=O)Cn1ccc2ccccc21)c1ccc(Br)cc1	197380833	JYOXSHNCQMALIS-MOSHPQCFSA-N	370.250	3.944	50	40	FHGB	
CC(C)(C)c1cc(C(=O)N/N=C\c2cccs2)n(-c2ccccc2)n1	5383795	GGLLGKVBIXBVHG-MOSHPQCFSA-N	352.463	3.995	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)cc1Br	101358568	KBHIRKVXQIODMK-FSUZVNHLSA-N	365.271	3.734	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1OCC	409142423	LHQRZHMRKHPAQF-CJLVFECKSA-N	354.450	3.957	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(=O)OC)c2C)c1C	4782555	AVYQEXSPSIKFKH-GZTJUZNOSA-N	366.417	3.659	50	40	FHGB	
COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccc(OC)c(OC)c1	408816996	VCRKLMGAZNOCAR-XNTDXEJSSA-N	352.390	3.567	50	40	FHGB	
COC(=O)c1ccc(Cl)c(-c2ccc(/C=C(/C#N)C(=O)NC(C)C)o2)c1	408781270	BPEKPMOJMGWQKP-JYRVWZFOSA-N	372.808	3.818	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)CNc1cccc(C(F)(F)F)c1	408534008	UMZBQUOXMOUFOK-FOKLQQMPSA-N	365.355	3.666	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1	36290043	MZQIUISEKGOUEB-UDWIEESQSA-N	372.494	3.515	50	40	FHGB	
O=C(COc1cccc(Cl)c1)N/N=C\c1cccc(Br)c1	30791405	HXIYKNYBIYYLFR-NVMNQCDNSA-N	367.630	3.632	50	40	FHGB	
O=C(N/N=C/c1sc(N2CCCCC2)nc1-c1cccs1)C1CC1	6226328	ACSNUPGSJBXXDR-WOJGMQOQSA-N	360.508	3.722	50	40	FHGB	
N#CC1=C(SCC(N)=O)N=C2CCCC(O)=C2[C@H]1c1ccccc1Cl	100086697	SQEWZSWDUNFGQH-INIZCTEOSA-N	373.865	3.828	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)Cc2coc3ccc4ccccc4c23)cc1	7795452	UFMJPEJEPAVHCX-UHFFFAOYSA-N	358.397	3.898	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=N/NC(=O)c2ccccc2C)cc1OCC	9200925	SXDXEQSURBHFMG-LPYMAVHISA-N	370.836	3.823	50	40	FHGB	
Cc1cccc(C)c1NC(=O)/C(C#N)=C1\SCC(=O)N1c1ccccc1	2237069	LGZNCWMGCMAFCZ-SILNSSARSA-N	363.442	3.757	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)COc2ccc(C(C)(C)C)cc2)c(O)c1	5119663	IFJUQVPAXYLLED-HYARGMPZSA-N	370.449	3.618	50	40	FHGB	
CCCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(O)cc1	408803737	SXCMHMOAONNKLJ-RVDMUPIBSA-N	352.390	3.735	50	40	FHGB	
Cc1cccc(C(=O)N/N=C/c2ccccc2OC(=O)c2ccccc2)c1	825342	LIHBRKDSCUSKEB-HZHRSRAPSA-N	358.397	3.978	50	40	FHGB	
O=C(N/N=C/c1ccccc1O)c1ccccc1/N=C/c1ccccc1O	1021438	ZWVSPCFXKBXUSF-MSKUYSOUSA-N	359.385	3.612	50	40	FHGB	
Cn1cc(C(=O)N/N=C/c2ccc(Br)cc2)c2ccccc21	1254534	YSFNEVLZCREYHA-VXLYETTFSA-N	356.223	3.705	50	40	FHGB	
C[C@H](Oc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2Cl)cc1)C(=O)O	59247990	JYNDIZXKZGDZFI-GVIGZQTCSA-N	370.792	3.738	50	40	FHGB	
Cc1oc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)cc1Br	6184467	HFBXYOIFEAZFOI-LBFZPMSMSA-N	367.268	3.981	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)c(OCC)c1	408818855	ZBQVTAJVOZCSSL-BKUYFWCQSA-N	352.390	3.994	50	40	FHGB	
N#C/C(=C/c1cccc(Br)c1)C(=O)c1ccc2c(c1)OCO2	48312296	AYCZANHZRCLAJN-MLPAPPSSSA-N	356.175	3.968	50	40	FHGB	
CN1C(=O)/C(=N/NC(=O)c2cc3c(ccc4ccccc43)o2)c2ccccc21	8091854	LLEZFDXQHAEARW-BSYVCWPDSA-N	369.380	3.697	50	40	FHGB	
CCN(CC)c1ccc(C(=O)[C@H](Br)CBr)cc1	575358142	LOTJOQDOYILIRV-GFCCVEGCSA-N	363.093	3.874	50	40	FHGB	
O=[N+]([O-])c1ccc(S(=O)(=O)C[C@H](Br)c2ccccc2)cc1	823773	HJJXHEUFCYYHCB-AWEZNQCLSA-N	370.224	3.505	50	40	FHGB	
COC(=O)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2sc2ccccc32)cc1	3229998	VWQFDTIVJRSAQZ-MRXNPFEDSA-N	362.410	3.906	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1	408898565	XACZOWVZZJIWKI-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C\c2cccc(OC)c2OC)c1	408745466	MNHAJLZDFRTGJD-PTNGSMBKSA-N	352.390	3.648	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccc(-c3cccc(Br)c3)o2)[nH]n1	6691035	RTVJLIRTEZUTGU-GIJQJNRQSA-N	373.210	3.505	50	40	FHGB	
Cc1cc(C)n(CC(=O)N/N=C/c2c(-c3ccccc3)[nH]c3ccccc23)n1	6932220	JFSRMZLVDGPNHN-YDZHTSKRSA-N	371.444	3.799	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C\c1cc([N+](=O)[O-])c(Cl)cc1Cl	409218686	XKPMDZWOFLECGE-NVMNQCDNSA-N	352.177	3.594	50	40	FHGB	
C[C@@H](Cl)C(=O)Nc1ccccc1C(=O)Nc1nnc(-c2ccccc2)o1	39758227	QKYLVQFWUHNNSY-LLVKDONJSA-N	370.796	3.555	50	40	FHGB	
CO/C(O)=C(C#N)/C=C(\C(=O)c1ccc(Cl)cc1)[n+]1cccc(C)c1	136491609	JATXDWIGLFOMBM-UHFFFAOYSA-O	355.801	3.599	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)NN=Cc1cn(C)c3ccccc13)c(C)n2C	252677969	BWKJLYHWTSAXBJ-UHFFFAOYSA-N	374.444	3.751	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)CCC(=O)N/N=C/c1ccccc1F	3083933	HMKWOFYKCIHLBR-SRZZPIQSSA-N	361.804	3.657	50	40	FHGB	
CC[C@H](C)c1ccc(OCC(=O)N/N=C/c2cccc(OC)c2OC)cc1	1320105	QVQPUOAQDZPUIR-NSMHLIOHSA-N	370.449	3.746	50	40	FHGB	
O=C(CSc1ccc(Cl)cc1)NNC(=O)[C@H]1CCCc2ccccc21	12985281	GQMPJVFVSUKPOZ-KRWDZBQOSA-N	374.893	3.700	50	40	FHGB	
C=CCNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1	6054158	SSUXSJOCKGYGGT-JXAWBTAJSA-N	354.413	3.748	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)c2cc3ccccc3cc2O)c1	4502835	SSVXDXZOCCMSDN-YDZHTSKRSA-N	361.401	3.658	50	40	FHGB	
O=C(CSc1ccc(Cl)cc1)N/N=C/c1ccc(Br)o1	40961743	QYYYOCGOSSLBQO-FRKPEAEDSA-N	373.659	3.938	50	40	FHGB	
COc1cc(/C=C/C(=O)NN)ccc1OCc1ccc(Cl)cc1Cl	226336551	QUGUZNDDZINRIM-XVNBXDOJSA-N	367.232	3.584	50	40	FHGB	
CCCCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(N(C)C)cc2)C1=O	16806501	UZTZHSNPXLIBDP-RGEXLXHISA-N	365.477	3.925	50	40	FHGB	
O=C(N/N=C/c1ccc(N2Cc3ccccc3C2)cc1)c1ccccc1O	58871721	HXKKRFOWGASRDE-YDZHTSKRSA-N	357.413	3.676	50	40	FHGB	
CC(C)(C)c1ccc(C(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)cc1	4550598	HUAVXWCJMJJVTF-UHFFFAOYSA-N	354.372	3.788	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)c(OC)c1	903647	YHYBLJGISSXHTG-VXLYETTFSA-N	364.854	3.600	50	40	FHGB	
Cc1cccc(COc2ccc([C@@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)cc2)c1	5941768	JRWQNWJBFRBXIU-HXUWFJFHSA-N	372.428	3.824	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)cc(OC)c1OC	16692623	SMWXPXAIVAERMM-JYRVWZFOSA-N	372.808	3.911	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)COc2ccc(C)cc2Br)cc1	1444071	QDVYVFAJTSCXAN-VXLYETTFSA-N	361.239	3.595	50	40	FHGB	
N#CC(C#N)=C1C(=O)N(Cc2ccccc2)c2ccc(Br)cc21	2449515	AKWUWLMIYWMKRY-UHFFFAOYSA-N	364.202	3.797	50	40	FHGB	
O=C1Nc2ccccc2/C1=N/NC(=O)c1sc2ccccc2c1Cl	18105754	WOFSPSLPKXCJJS-UHFFFAOYSA-N	355.806	3.641	50	40	FHGB	
Cc1ccc(C(C)C)c(OCCOc2ccc(/C=C(\C#N)C(N)=O)cc2)c1	4676923	CNBQQGQSZRLUCC-QGOAFFKASA-N	364.445	3.969	50	40	FHGB	
COc1cc(Cl)c(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc1OC	408798924	JIKCKFMQGUVFTF-LLOPKGDWSA-N	362.857	3.959	50	40	FHGB	
CCN(C(C)=O)c1nc(/C=C(\C#N)c2ccc(C(F)(F)F)cn2)cs1	24365712	LUUIUJDNEDOGMA-IZZDOVSWSA-N	366.368	3.994	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(OCC#N)cc1	408832196	XDOWXXXSKAEHKP-LNOXHEFASA-N	373.865	3.873	50	40	FHGB	
O=C(COc1cccc(Cl)c1)N/N=C\c1cccn1-c1ccccc1	408852408	KLIWSBXZYVRGOJ-BKUYFWCQSA-N	353.809	3.660	50	40	FHGB	
N#C/C(=C/c1cccc(Br)c1)C(=O)Nc1cccc(C(=O)O)c1	408542555	MEPPZIOAVWRYOC-QPEQYQDCSA-N	371.190	3.693	50	40	FHGB	
O=C(N/N=C\c1ccc(N2CCCC2)cc1)c1ccc(-n2cccc2)cc1	408961705	UUIUCPSHNNEFBO-QJOMJCCJSA-N	358.445	3.841	50	40	FHGB	
COc1cc(OC)cc(C(=O)N/N=C\c2ccc(OCC(C)C)cc2)c1	33793896	DWBUBTSXSLAZHA-MTJSOVHGSA-N	356.422	3.503	50	40	FHGB	
C=CCNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1cccs1	2278134	HTSQIHHCUYPOOO-NTCAYCPXSA-N	360.442	3.810	50	40	FHGB	
NC(=O)[C@@H](c1ccccc1)c1ccc(N(CCCl)CCCl)cc1	1602314	MVYSCWDJCYSMCC-KRWDZBQOSA-N	351.277	3.588	50	40	FHGB	
O=C1OC(=O)[C@H]2[C@H]1[C@]1(c3ccccc3)O[C@]2(c2ccccc2)c2ccccc21	100494305	LXGWNCJNLUFEQL-FAYOUJPWSA-N	368.388	3.533	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)c(OC)c2)c1	408740287	FIZWMPCSQJPRDH-XNTDXEJSSA-N	352.390	3.648	50	40	FHGB	
CCOC(=O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccc(C)o3)o2)c1	408975026	IQMWBONCHQVCMJ-CIAFOILYSA-N	366.373	3.789	50	40	FHGB	
C/C(=N\NC(=O)c1ccco1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	5621216	PLSCEPOTBTYOKW-YDZHTSKRSA-N	365.364	3.825	50	40	FHGB	
CCn1cccc1/C=C(\C#N)C(=O)Nc1sc2c(c1C#N)CCCC2	408551408	CPGPNMTWTDXENB-JLHYYAGUSA-N	350.447	3.866	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2c(OC)ccc3ccc(OC)cc23)c1	409013676	COMHADWAZPBOIC-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
C/C(=N/NC(=O)COc1ccc(C(C)(C)C)cc1C)c1ccc(O)cc1	5003560	BPDGJLUXNCZAAG-JCMHNJIXSA-N	354.450	3.917	50	40	FHGB	
COc1ccc([C@@H]2CC(c3cccs3)=NN2C(=O)CCl)cc1OC	3886988	AQTIYCHYBRWPPP-ZDUSSCGKSA-N	364.854	3.682	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1ccc(OC2CSC2)cc1	4481553	BBOKDFPFVPBWJF-KEBDBYFISA-N	372.515	3.564	50	40	FHGB	
C/C(=N/NC(=O)c1cccnc1)c1ccc(NC(=O)C2CCCCC2)cc1	5888710	QGRKLIDBFSBODS-IWIPYMOSSA-N	364.449	3.754	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1cccc2ccccc12	409177422	AKBGPKPMNCDRAF-FYJGNVAPSA-N	363.373	3.911	50	40	FHGB	
O=C(N/N=C1/C(O)=Nc2ccc(Cl)cc21)c1cc2ccccc2cc1O	20791324	BVPGSNDNUYOMRT-UHFFFAOYSA-N	365.776	3.935	50	40	FHGB	
CCCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)Cc1ccc(C)cc1C	20195414	ANYKDRJTPQAGQW-FYJGNVAPSA-N	369.421	3.693	50	40	FHGB	
C[C@@H]1CCCN(c2ccc(C(=O)NN(C)c3ccccc3)cc2[N+](=O)[O-])C1	58415778	NTCUWPLDQBDAOR-OAHLLOKOSA-N	368.437	3.612	50	40	FHGB	
CN(C)NC(=O)Nc1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1	408976900	GZRVCMQGJCKQSD-UHFFFAOYSA-N	363.377	3.748	50	40	FHGB	
Cc1ccc(NC(=O)NNC(=O)CS[C@H]2CCc3ccccc32)c(C)c1	5664990	LXBNQYUIMUPTCK-SFHVURJKSA-N	369.490	3.877	50	40	FHGB	
O=C(Cc1c[nH]c2ccccc12)N/N=C/c1ccc(Br)cc1	1429057	FYBMMQXHTGSSMA-KEBDBYFISA-N	356.223	3.623	50	40	FHGB	
CC(C)(C)C[C@@H](NC(=O)NNC(=O)c1ccccc1O)c1ccccc1	46898041	HNQGARYEKCZXLX-MRXNPFEDSA-N	355.438	3.514	50	40	FHGB	
C#CCOC1(c2ccccc2)[C@H]2CCC[C@H]1C2I	100547438	FMFHAGCYRDGRHL-FXQLRMTLSA-N	352.215	3.765	50	40	FHGB	
CC(=O)Nc1ccc(O)c(SSc2cc(NC(C)=O)ccc2O)c1	65743209	RKYJNUFUOUFMRJ-UHFFFAOYSA-N	364.448	3.814	50	40	FHGB	in-vitro
COc1ccc2nc(/C(C#N)=C\c3ccc(OC)c([N+](=O)[O-])c3)[nH]c2c1	409391156	HKYZFVJRQIGGKC-GHXNOFRVSA-N	350.334	3.552	50	40	FHGB	
CC(=O)N/N=C/c1ccc(OCCOc2ccc(C(C)(C)C)cc2)cc1	4677272	VABSZMCCIAWRMB-PXLXIMEGSA-N	354.450	3.912	50	40	FHGB	
Cc1cccc(C)c1OCC(=O)N/N=C/c1ccccc1OCC(C)C	408916616	YNNNNGFOJIIQHJ-WSDLNYQXSA-N	354.450	3.867	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NC(C)C)c2C)cc1[N+](=O)[O-]	408773901	TXKGIAMUHPWZIJ-MFOYZWKCSA-N	366.421	3.742	50	40	FHGB	
N#C/C(=C\c1ccccc1OCC(=O)O)c1ccc(Br)cc1	408581220	VEAJBYOPPGNCOU-NTEUORMPSA-N	358.191	3.977	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2ccc(-c3ccccc3C#N)o2)cc1	409160374	HMAZJNVBZLWEQL-OEAKJJBVSA-N	359.385	3.520	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)[C@H](C)SCc2ccccc2)cc1[N+](=O)[O-]	408719165	IJBOOAISSGQIJB-YRIIZNAFSA-N	357.435	3.675	50	40	FHGB	
CCc1ccccc1NC(=O)/C(C#N)=C/c1cc2c(cc1OC)OCO2	409109009	ZMCZJIPKAKJJBF-OVCLIPMQSA-N	350.374	3.532	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)c2ccc(Br)cc2)cc1	408827255	IGWCVZDKDYCEPU-RGVLZGJSSA-N	374.238	3.562	50	40	FHGB	
Cc1cc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)c(C)n1-c1ccccc1	409199762	JWJVJDJOHICYPS-MNQDVBFDSA-N	356.429	3.852	50	40	FHGB	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)c2ccccn2)cc1	16695106	GAHOXHYLXTWBCR-GHRIWEEISA-N	355.401	3.932	50	40	FHGB	
CCCS[C@@]1(c2ccc(Cl)cc2)OC(N)=C(C#N)C1=C(C#N)C#N	100249669	SCRKKHWSVMMPKM-QGZVFWFLSA-N	356.838	3.704	50	40	FHGB	
CCC1=C(C(=O)OC)[C@H](c2cccc(Cl)c2Cl)C(C#N)=C(N)O1	706894	ZSMPKTJMQPWKCG-GFCCVEGCSA-N	353.205	3.638	50	40	FHGB	
C=CCOc1ccccc1/C=N\NC(=O)c1ccc(OCC)c(OCC)c1	6964214	NTXHZKMLVJUVTA-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2coc3ccc(Cl)cc3c2=O)cc1C	655011	VNDLSPXREHFRGQ-ZVBGSRNCSA-N	354.793	3.827	50	40	FHGB	
COc1cccc(/C=N/NC(=O)c2ccccc2NC(=O)c2ccccc2)c1	408998276	PSMHSGIGIVXONU-HZHRSRAPSA-N	373.412	3.711	50	40	FHGB	
Cc1cccc(OCC(=O)NNC(=O)[C@H](c2ccc(Cl)cc2)C(C)C)c1	5272867	FHYBLGAKWOYFQJ-IBGZPJMESA-N	374.868	3.614	50	40	FHGB	
COc1ccc(-c2ccc(/C=N\NC(=O)c3ccc(C)o3)o2)c([N+](=O)[O-])c1	408718633	MQTJRRPRAWASBQ-GRSHGNNSSA-N	369.333	3.529	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccccc2F)o1)c1ccc([N+](=O)[O-])cc1	5562296	HYXJLHLMYLQQCM-RGVLZGJSSA-N	353.309	3.758	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N/NC(=O)COc1ccc(Cl)cc1	409102184	DAPQXWDMSBIAQJ-KEBDBYFISA-N	367.232	3.921	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)cc1Cl	408793730	GIKUPGHLSPXRDI-RVDMUPIBSA-N	366.804	3.906	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCCCC2)o1)C(=O)Nc1ccc(O)cc1	409377477	IQFONKQZVCRVCX-SQFISAMPSA-N	351.406	3.911	50	40	FHGB	
N#C/C(=C\c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cccc(F)c1	409393949	TZVZPVGVNPAMBB-MHWRWJLKSA-N	353.353	3.635	50	40	FHGB	
N#C/C(=C\c1cc(Br)ccc1F)C(=O)NC1CCCCC1	6410665	VBGYZPSLFFBKMR-XYOKQWHBSA-N	351.219	3.944	50	40	FHGB	
CC/C(=N\NC(=O)[C@@H](C)Sc1ccccc1)c1ccc2c(c1)OCCO2	4714626	WAQVSYGAJNXVPI-LQFHHUIYSA-N	370.474	3.869	50	40	FHGB	
O=C(NN=C1CCCCCCC1)C(=O)Nc1cccc(C(F)(F)F)c1	59515767	JOMQUQOCZFUDTM-UHFFFAOYSA-N	355.360	3.860	50	40	FHGB	
O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(Cl)cc1Cl	3196921	JUNNEGRVIIJHFF-GIJQJNRQSA-N	352.177	3.594	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCC2)cc1F)C(=O)Nc1ccc(O)cc1	108092815	BRJOYLRUTSLPIX-PTNGSMBKSA-N	351.381	3.677	50	40	FHGB	
Cc1cccc(C)c1OCC(=O)N/N=C/c1ccc(OCC(C)C)cc1	408915558	QARPAZZEVGBIRD-WSDLNYQXSA-N	354.450	3.867	50	40	FHGB	
Cc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(C(C)C)cc3)CC2=O)cc1	409156577	OXAZRMTTWMQEAR-AYBNGVQBSA-N	363.461	3.622	50	40	FHGB	
Cc1cccc2cc(CN(CCc3ccccc3)C(=O)CCl)c(=O)[nH]c12	13566558	MYJISENRKRFUDE-UHFFFAOYSA-N	368.864	3.647	50	40	FHGB	
C=CCOc1c(Cl)cc(/C=N/NC(=O)c2ccc(F)cc2)cc1OC	8812365	IANLVQPLSMWZNF-SRZZPIQSSA-N	362.788	3.816	50	40	FHGB	
COc1ccc(OC)c(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)c1	948100	BBXYDZXPNSRZQF-MHWRWJLKSA-N	363.822	3.696	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=N\NC(=O)c3cccc(C)c3)o2)cc1	408972635	TVWWDGNPNOKFAD-XKZIYDEJSA-N	362.385	3.806	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1c(C)nn(-c2cccc(C(F)(F)F)c2)c1Cl	32798417	HUWHQQKRBWBSEC-UXBLZVDNSA-N	368.746	3.506	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC(C)C)cc2)cc1	942001	JULOIPKMZNNXDE-SFQUDFHCSA-N	364.401	3.806	50	40	FHGB	
CCCCCCc1cc(C(=O)OC/C(C)=N\NC(N)=O)c2ccccc2n1	17157830	SVQRZKRYUAPAFC-UCQKPKSFSA-N	370.453	3.559	50	40	FHGB	
Cc1ccccc1-c1nnc(NC(=O)[C@@H](Br)C(C)C)s1	4070339	BWADFIRMTREXKT-NSHDSACASA-N	354.273	3.872	50	40	FHGB	
COc1ccc(/C(C)=N/OC/C(O)=C(\C#N)c2nc3ccccc3[nH]2)cc1	101945090	LXSCYQOYFQPALJ-GIQOEUNPSA-N	362.389	3.805	50	40	FHGB	
C/C(CC(=O)NC12CC3CC(CC(C3)C1)C2)=N\NC(=O)c1ccc(C)cc1	4713766	JDXZMFJZFQPHRJ-BUVRLJJBSA-N	367.493	3.576	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NC2CC2)c(C)n1-c1ccc(F)c(F)c1F	46485607	ZIALRQQPGOFICW-MDWZMJQESA-N	359.351	3.697	50	40	FHGB	
O=C(NCc1ccc(NC(=O)C2CC2)cc1)NNc1ccccc1Cl	23174363	CVBZJVBMBDIDMW-UHFFFAOYSA-N	358.829	3.515	50	40	FHGB	
O=C(N/N=C/c1c[nH]c2ccccc12)C1(O)c2ccccc2-c2ccccc21	861675	HZYBYSFMWNLSCP-AFUMVMLFSA-N	367.408	3.535	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@@H]2C[C@H]3C[C@H]2[C@H](CBr)C3)cc1	100399478	SSOHWXRVPHYKLJ-PAPYEOQZSA-N	359.285	3.510	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2ccc(OC)c(OCC)c2)cc1	20197366	KXNRBTXKTASNIH-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
N#C/C(=C1/C(=O)Nc2ccc(Br)cc21)c1nc2ccccc2[nH]1	5071757	FWESHNFOJHKJRO-PTNGSMBKSA-N	365.190	3.712	50	40	FHGB	
O=C(Oc1ccc([N+](=O)[O-])cc1)c1c(Cl)nsc1Br	1505839838	BKNVDMWPJDLDEP-UHFFFAOYSA-N	363.576	3.686	50	40	FHGB	
CCOc1ccc(NC(=O)c2ccc(C(C)=O)cc2)cc1[S@@](=O)Cl	390822966	OMEJGLZCFSPQLA-XMMPIXPASA-N	365.838	3.802	50	40	FHGB	
CCc1ccc(NC(=O)CCC(=O)N/N=C/c2ccccc2Cl)cc1	3101376	RDZDISMORMXIEA-FYJGNVAPSA-N	357.841	3.771	50	40	FHGB	
COc1cccc(/C=C(\C#N)C(=O)Nc2cccc(Br)c2)c1O	8168708	QWLDXWXQQXGPML-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N/NC(=O)CNc3ccccc3)c2C)cc1	6297609	OPJBCQRMLMMZLQ-ZVHZXABRSA-N	360.461	3.965	50	40	FHGB	
Cc1ccc(/C(Cl)=C(\C=O)c2cc(C#N)c(C#N)cc2[N+](=O)[O-])cc1	96336797	FXSAZBSTKUICDQ-VLGSPTGOSA-N	351.749	3.953	50	40	FHGB	
Cc1ccc([C@H]2CC(=O)N3CN(C4CCCC4)CSC3=C2C#N)cc1	20348034	HXTFUMQLLPVZKE-QGZVFWFLSA-N	353.491	3.953	50	40	FHGB	
CCOP(=S)(OCC)Oc1cc(Nc2ccc(OC)cc2)n(C)n1	2577938	RTTXXJWYTMNLQG-UHFFFAOYSA-N	371.399	3.849	50	40	FHGB	
Cc1ccc([C@H]2C[C@@H]2C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	8685693	KYMUYZDKPNXNDH-CVEARBPZSA-N	359.882	3.770	50	40	FHGB	
CCN1C(=O)/C(=C2/Sc3ccccc3N2C)S/C1=N/CCCl	97405314	DPJXISSVOPOXGI-KPANNZBFSA-N	353.900	3.588	50	40	FHGB	
O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccccc1Cl	6286631	HPFCHKMAMVSGBQ-LSFURLLWSA-N	355.747	3.921	50	40	FHGB	
Cc1c(/C=N/NC(N)=O)c2ccccc2n1CCOc1ccc(Cl)cc1	4560767	KFJRRTULRYDUSV-WSDLNYQXSA-N	370.840	3.684	50	40	FHGB	
CC(C)(C)c1ccc([C@H]2C[C@@H]2C(=O)N/N=C\c2ccc3c(c2)OCO3)cc1	30738473	LGKQQCGYSWJFTD-GBOPDRENSA-N	364.445	3.967	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)N(c2ccccn2)c2ccccn2)cc1	3179791	FHCDGQIRIWLBSN-SAPNQHFASA-N	356.385	3.757	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(OC(C)C)c([N+](=O)[O-])c2)c(C)c1	20195464	IOCNMSRGRRPKLY-CIAFOILYSA-N	369.421	3.692	50	40	FHGB	
COc1ccc(C2=C[C@H](c3ccccc3)C(C#N)(C#N)C(N)=C2C#N)cc1	4663857	GAACJNIOAZJWFX-HXUWFJFHSA-N	352.397	3.646	50	40	FHGB	
COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2cc(Cl)ccc2Cl)[nH]1	96035437	GUVWVZDKLHTTFG-RMKNXTFCSA-N	364.188	3.654	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)CNc2cccc3ccccc23)c1	409393405	WXYDVOWVBALQMD-BUVRLJJBSA-N	359.429	3.967	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C\c1cn(CC(=O)O)c2ccccc12)c1ccccc1	409241950	PKHYMKMFIXAADA-QJISPJEISA-N	373.412	3.510	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/c1cc(F)c(N2CCCC2)cc1C	33741150	XLEZLTWVQBNEPZ-LPYMAVHISA-N	355.413	3.507	50	40	FHGB	
C[C@@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc(N(C)C)cc1	1092221	WTVPSJCGXTVDMA-LGVXEURYSA-N	360.461	3.857	50	40	FHGB	
Cc1sc(-n2c(C)cc(/C=C(/C#N)C(=O)N(C)C)c2C)c(C#N)c1C	408851074	HHTXQWQIEJIKAW-PXNMLYILSA-N	352.463	3.639	50	40	FHGB	
COc1cccc([C@@H]2CC(c3cccs3)=NN2C(=O)CCl)c1OC	4862957	FAGXVTWEZQAPIG-ZDUSSCGKSA-N	364.854	3.682	50	40	FHGB	
CCCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2)cc1	1766552	GQFQQBFXRPEDRI-GHRIWEEISA-N	364.401	3.808	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccco2)c(C)n1-c1ccc(N(C)C)cc1	408992748	BLXVSVORTLJVKK-FYJGNVAPSA-N	350.422	3.517	50	40	FHGB	
Cc1cccc(-n2c(C)c(Br)c(/C=N/NC(=O)CC#N)c2C)c1	20243770	ASLBYNDUKMVBFV-KEBDBYFISA-N	373.254	3.529	50	40	FHGB	
Cc1cc(C)cc(NC(=O)/C(C#N)=C\c2ccc(O[C@H](C)C(=O)O)cc2)c1	408848201	QQMJJAPRMKMBMR-QJISPJEISA-N	364.401	3.701	50	40	FHGB	
Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1/C=C(\C#N)C(=O)O	1607994143	GLLGJIYJIAZVKE-WEVVVXLNSA-N	355.703	3.845	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)c2ccc(Br)cc2)Nc2ccccc21	11617373	GKOTXXOJPUJNGN-GHRIWEEISA-N	354.207	3.929	50	40	FHGB	
Cc1ccc([C@@H](Br)[C@@H](Br)C(=O)[C@]2(C)CO2)cc1	4953620	PQHOXCGXAACSQA-WZRBSPASSA-N	362.061	3.553	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccccc1F)[C@@H](Br)C2=O	27026854	SFCDVEAYTLQJKX-VUCTXSBTSA-N	368.246	3.923	50	40	FHGB	
N#C/C(=C\c1cccc(Br)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1	4953724	UILCLGUCOUAYHE-XYOKQWHBSA-N	372.178	3.903	50	40	FHGB	
O=C(NN=C(c1ccccc1)c1ccccc1)c1c[nH]c2ccccc2c1=O	89821678	UUFLOPBRKAHGBU-UHFFFAOYSA-N	367.408	3.711	50	40	FHGB	
CCCOc1c(/C=N/NC(=O)COc2c(C)cccc2C)cccc1OC	408911276	JTLWSQAZLLHXCC-LPYMAVHISA-N	370.449	3.630	50	40	FHGB	
Cc1cc(/C=N/NC(=O)Cc2ccccc2)c(C)n1-c1ccc(N(C)C)cc1	408741444	PUAVCLOUXOYOFK-LFVJCYFKSA-N	374.488	3.853	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)cc(Cl)c1O	1096169	JRPXCQJENMOSIA-MHWRWJLKSA-N	370.836	3.710	50	40	FHGB	
CC(C)[C@@H](Br)C(=O)Nc1nnc(-c2ccc(F)cc2)s1	4070335	ZLDKPSXUIRBUQB-SNVBAGLBSA-N	358.236	3.702	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1C	874064	YHAWTDJGRMZMQD-PDGQHHTCSA-N	359.429	3.751	50	40	FHGB	
O=C(N/N=C/[C@@H]1CCOC1)c1cc(-c2ccc(F)cc2)nc2ccccc12	54279434	GBHRBBUDBLEZHP-XMTZNVEYSA-N	363.392	3.793	50	40	FHGB	
O=C(N/N=C\c1ccc(N2CCCC2)c(F)c1)c1cc2ccccc2o1	34690233	MYFBNYGOKYGCIB-XKZIYDEJSA-N	351.381	3.936	50	40	FHGB	
CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N/N=C/C=C/c1ccccc1	3039699	PDDDDYPEJDNCMW-MOERGMJESA-N	363.461	3.647	50	40	FHGB	
CC(=O)Nc1ccc(C(=O)N/N=C/c2cccc(Cl)c2Cl)cc1	5481014	NODDKJBNPAYINU-DJKKODMXSA-N	350.205	3.716	50	40	FHGB	
O=C(N/N=C/c1ccc(F)cc1)c1ccc(NC(=O)c2ccccc2)cc1	5601731	PCBHISAOKDZEEA-OEAKJJBVSA-N	361.376	3.842	50	40	FHGB	
N#CC(C#N)=C1C(=O)N(Cc2ccc(Br)cc2)c2ccccc21	1320730	FRSRFVXBFMLKSS-UHFFFAOYSA-N	364.202	3.797	50	40	FHGB	
CCc1ccc(NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C)cc1	8733152	QOJYHQLAYZMQMD-OAHLLOKOSA-N	369.303	3.503	50	40	FHGB	
COc1ccc(CCCC(=O)N/N=C/c2ccc(C)c(OC)c2)cc1C	1445246	BOMJPXQAHUXJOY-HYARGMPZSA-N	354.450	3.794	50	40	FHGB	
COc1cccc([C@H]2C(C#N)=C(N)N(c3ccccc3)C3=C2C(=O)CCC3)c1	66089462	FUDBYSPYGPLRNS-NRFANRHFSA-N	371.440	4.000	50	40	FHGB	
COc1ccc(C/C(C)=N/NC(=O)c2cccc3cc[nH]c23)cc1OC	4806471	XAVSYJQSVLUVQU-LPYMAVHISA-N	351.406	3.534	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2ccc(OCC)cc2)cc1OCC	20764773	UUZBWJZVVGTDRQ-PXLXIMEGSA-N	368.433	3.813	50	40	FHGB	
N#C/C(=C\c1cccc(OCc2ccc(F)cc2)c1)C(=O)N1CCCC1	193407959	OCZJFXISOOJCAG-LDADJPATSA-N	350.393	3.934	50	40	FHGB	
C/C(=N/NC(=O)c1ccn(Cc2ccc(Cl)cc2)n1)c1ccccc1	5455332	BXCBPNZGRHAGKV-STZFKDTASA-N	352.825	3.739	50	40	FHGB	
CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)c3ccccn3)c2C)cc1	6617424	GYQIOVZDNGRMLD-OEAKJJBVSA-N	362.433	3.652	50	40	FHGB	
C=CCc1ccccc1OCCn1cc(/C=N/NC(C)=O)c2ccccc21	1093745	XFLUAXJCUNFIOH-HZHRSRAPSA-N	361.445	3.919	50	40	FHGB	
COc1ccc(/C=C/C(=O)NN)cc1OCc1ccc(Cl)c(Cl)c1	216901509	QVWHRKCCTWSBLO-QPJJXVBHSA-N	367.232	3.584	50	40	FHGB	
COc1ccc(S(=O)(=O)/C(C#N)=C/C2=Cc3ccccc3O[C@H]2C)cc1	80345337	WSBNPEDIVUGSDG-BXUJETTOSA-N	367.426	3.741	50	40	FHGB	
Cc1cccc(C(=O)Nc2cccc(C(=O)N/N=C/c3ccccc3O)c2)c1	3202561	ZCQIXCWAJHVOSC-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
O=C(CNc1ccccc1)N/N=C/c1ccccc1OCc1ccccc1	5338339	QRRLATZLNHUABQ-BUVRLJJBSA-N	359.429	3.828	50	40	FHGB	
C[C@@]12CCCC[C@@H]1[C@@H]2C(=O)N/N=C/c1ccc(-c2ccc(C(=O)O)cc2)o1	4832045	GMECDSONWHNXFI-BYUHBYHNSA-N	366.417	3.921	50	40	FHGB	
CC1(C)C(C#N)=C(SCCCC(=O)c2ccc(F)cc2)NC(=O)[C@@H]1C#N	14231600	RMSXLCUPLUHSLR-AWEZNQCLSA-N	371.437	3.553	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2)cc(Cl)c1OCC#N	408740989	GDNTTZUZROMTOL-ZROIWOOFSA-N	367.792	3.797	50	40	FHGB	
Cc1c(/C=N/NC(=O)c2ccc(F)cc2)c(Cl)nn1-c1ccccc1	408893333	MHKNWFYZRRMNJQ-SRZZPIQSSA-N	356.788	3.737	50	40	FHGB	
CCOc1cc(C(=O)NN)ccc1OCc1ccc(Cl)cc1Cl	216822930	MDAGPIHWFXQNNB-UHFFFAOYSA-N	355.221	3.575	50	40	FHGB	
COc1cccc([C@@H]2C(C#N)=C(N)N(c3ccccc3)C3=C2C(=O)CCC3)c1	66089460	FUDBYSPYGPLRNS-OAQYLSRUSA-N	371.440	4.000	50	40	FHGB	
C=CCOc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc1OC	6899347	NSNTTZOJRZGMTM-QPYDYZPCSA-N	354.450	3.862	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1)c1cc2ccccc2cc1O	670340	FRWLDBUDJHPONC-KEBDBYFISA-N	369.764	3.871	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc(CC)cc2)cc1[N+](=O)[O-]	409363784	NLJLRJOYIAPJOK-KGENOOAVSA-N	369.421	3.639	50	40	FHGB	
COC(=O)COc1ccc(/C=C(/C#N)c2nc3cc(C)c(C)cc3[nH]2)cc1	408545232	ZWZHYGUQQOOTLK-YBEGLDIGSA-N	361.401	3.796	50	40	FHGB	
CC(C)COC(=O)N[C@@H](C)C(=O)NN(c1ccccc1)c1ccccc1	409002496	NUVHRPNUDDAWOO-INIZCTEOSA-N	355.438	3.627	50	40	FHGB	
CCOc1ccccc1/C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12	408949718	IREOTZSIGRJAPM-AQTBWJFISA-N	359.429	3.832	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1	409365190	ZCECYCLELNSHDI-FYJGNVAPSA-N	363.373	3.856	50	40	FHGB	
COc1cc(C(=O)NN(C)c2ccccc2)ccc1OCc1cscn1	40068145	LXTHVAQKIWUILV-UHFFFAOYSA-N	369.446	3.512	50	40	FHGB	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	1085486	DLAHYGFQJHVIJY-CNRHGSOZSA-N	363.373	3.666	50	40	FHGB	
COc1ccc(Br)cc1/C=C(/C#N)C(=O)NCc1ccccc1	6182136	PWLMQGBJVVSVOB-DHDCSXOGSA-N	371.234	3.681	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc(C)o2)ccc1OCc1ccccc1	5547636	ALGZFGKGRFXPRU-LPYMAVHISA-N	364.401	3.940	50	40	FHGB	
COC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1ccc(OC)c(Cl)c1	1439567	QAWITCAPHJXNRJ-UKTHLTGXSA-N	370.792	3.681	50	40	FHGB	
COc1cc(Cl)c(C)cc1NC(=O)/C(C#N)=C\c1ccc(C(=O)O)cc1	40161134	ILLXUCUBJPBFKD-ZSOIEALJSA-N	370.792	3.901	50	40	FHGB	
N#C/C(=C/c1ccccc1Br)C(=O)c1ccc2c(c1)OCO2	57996435	JBNOGJZQRKLMGV-QPEQYQDCSA-N	356.175	3.968	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2ccc(OC)c(Cl)c2)cc1OC	409300983	BQYMZMHYOMOOQN-MTJSOVHGSA-N	374.824	3.686	50	40	FHGB	
CCOc1ccc(NC(=O)c2ccc(C(C)=O)cc2)cc1[S@](=O)Cl	390822965	OMEJGLZCFSPQLA-DEOSSOPVSA-N	365.838	3.802	50	40	FHGB	
C[C@@H]1[C@@H](c2ccccc2)O[P@](=O)(N(CCCl)CCCl)N1C	5411647	WSTLBKXVNMSQSJ-YLGBZRSBSA-N	351.214	3.966	50	40	FHGB	
Cc1ccc2cc([C@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)c(Cl)nc2c1C	899073	RWLIHVVVAUJXNP-HNNXBMFYSA-N	365.824	3.755	50	40	FHGB	
Cc1ccc(SCC(=O)N/N=C/c2ccc(Br)cc2)cc1	8515363	MTPKMWFRFVQHQB-VCHYOVAHSA-N	363.280	4.000	50	40	FHGB	
O=C(Cl)[C@@H]1CC(=O)N(c2ccc3oc(-c4ccccc4F)nc3c2)C1	57327070	AEESZHICODUWFU-SNVBAGLBSA-N	358.756	3.752	50	40	FHGB	
CSc1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc1	1814260	SNKNIVSJTZBPBP-VCHYOVAHSA-N	357.460	3.792	50	40	FHGB	
O=C(CSCc1ccc2ccccc2c1)N/N=C/c1ccccc1O	408725941	JLHVFTYMLJNFOW-CIAFOILYSA-N	350.443	3.929	50	40	FHGB	
C/C(=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(C(C)(C)C)cc1	4697480	YVARFFBAWNCKIR-STZFKDTASA-N	353.422	3.975	50	40	FHGB	
Cc1ccc(C(=O)N/N=C\c2ccc(-c3ccc([N+](=O)[O-])cc3C)o2)cn1	4724833	XQRYGKILLUPMPC-NHDPSOOVSA-N	364.361	3.631	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)c2ccc(N/N=C/c3ccc(C)o3)cc2)o1	6866872	DHBBADCWQYPJSB-HGEIODPWSA-N	350.378	3.699	50	40	FHGB	
CC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)cc1	408757200	VXFZRHOONYEVSX-DJKKODMXSA-N	351.189	3.683	50	40	FHGB	
CCCCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2)cc1	3101259	QEZWMMCFMCKMAB-FYJGNVAPSA-N	357.841	3.771	50	40	FHGB	
CC(C)COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccn2)cc1	5130196	HUIYOECSQGQMHV-VRCTWVPOSA-N	357.479	3.747	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)cc(Cl)c1O	14134328	SSBJIUABDHXSIE-DJKKODMXSA-N	353.205	3.862	50	40	FHGB	
O=C(N/N=C/c1cn(Cc2ccccc2)c2ccccc12)c1cccnc1	2352768	RRQGXKZWPMEIHE-ZVHZXABRSA-N	354.413	3.849	50	40	FHGB	
Cc1oc(-n2c(C)cc(/C=N/NC(=O)Cc3ccccc3)c2C)c(C#N)c1C	409360315	DTJYYNMIDFPZHU-ZMOGYAJESA-N	374.444	3.868	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C(\C)c1cccs1	408710871	ROOYROZWGXRIQI-CXUHLZMHSA-N	353.241	3.673	50	40	FHGB	
O=C(O)c1cccc(-n2cccc2/C=N\NC(=O)c2cc3ccccc3o2)c1	35145604	GVMARXTXYAUFHS-XKZIYDEJSA-N	373.368	3.686	50	40	FHGB	
COc1cc(OC)cc(C(=O)NN=Cc2cc(C(C)C)c(OC)cc2C)c1	1531374146	NXQQBVXAKOWRLL-UHFFFAOYSA-N	370.449	3.908	50	40	FHGB	
CCOC(=O)C1=C(N)SC(c2ccccc2)=C(C#N)[C@@H]1c1ccco1	1070274	LXSHUXBNXUPTPG-OAHLLOKOSA-N	352.415	3.778	50	40	FHGB	
C/C(CC(=O)Nc1ccc(C)c(Cl)c1)=N\NC(=O)Cc1ccccc1	4697851	XKESJILVCYFKRU-HYARGMPZSA-N	357.841	3.712	50	40	FHGB	
COC1=C/C(=N\c2ccc(N(CCCl)CCCl)cc2)C=CC1=O	104189335	WEZPCKABMLDZEE-ZHZULCJRSA-N	353.249	3.712	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1	12346208	WFWPBMNASPEVLW-KGENOOAVSA-N	355.507	3.916	50	40	FHGB	
Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)c1cccc(Cl)c1	667336	LBUUSPCWPDKSKZ-CIAFOILYSA-N	352.825	3.906	50	40	FHGB	
C/C(=N\NC(=O)CN1C(=O)c2cccc3cccc1c23)c1ccc(C)cc1	106824777	KKCMAVFYGLEJAT-HZHRSRAPSA-N	357.413	3.649	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1)N/N=C/c1cc([N+](=O)[O-])ccc1Cl	14003046	SEMNGTIJBCYPSJ-GIJQJNRQSA-N	352.177	3.594	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)cc1OC	1754107	IOBGKDWTTAMVHY-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
C/C(=N/NC(=O)CSc1nc2ccccc2[nH]1)c1ccc(Cl)cc1	4870769	BWNWTRDFEHRTFJ-NHDPSOOVSA-N	358.854	3.849	50	40	FHGB	
N#C/C(C(=O)CSc1ccc(Cl)cc1)=C1/NC(=O)c2ccccc2N1	101083468	DVDHXWSYVZUDCU-VKAVYKQESA-N	369.833	3.592	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(C)cc1)c1cccc(Br)c1	811469	JKOBYTCBFYHZNV-CPNJWEJPSA-N	361.239	3.677	50	40	FHGB	
CCNc1ccc(C(=O)N/N=C/C2=CC[C@H]3C[C@H]2C3(C)C)cc1[N+](=O)[O-]	103387271	WBSMJRPIWQVFPC-CSPXMVGKSA-N	356.426	3.735	50	40	FHGB	
CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccccc1	989332	LRTDOEHDELRTTC-HXUWFJFHSA-N	372.428	3.798	50	40	FHGB	
N#C/C(=C\c1ccc(OCC(=O)N2CCCC2)cc1)c1nc2ccccc2[nH]1	9187340	MMCCANYVWRIHMA-GHRIWEEISA-N	372.428	3.628	50	40	FHGB	
Cn1c2ccccc2c2cc(/C=N/NC(=O)c3ccc(O)cc3O)ccc21	15933911	ODOFSPFAMKMFLW-WSDLNYQXSA-N	359.385	3.507	50	40	FHGB	
O=C(CSCc1ccccc1Br)N/N=C/c1cccs1	408720205	VUMCXCMWIYRMQI-LZYBPNLTSA-N	369.309	3.894	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2cccc3ccccc23)ccc1OC(C)=O	408757136	XILCITLOQQXISH-LPYMAVHISA-N	362.385	3.538	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2cc(C)n(-c3ccccc3)c2C)cc1	408526241	BEIRXDYAFZOPMU-ZVHZXABRSA-N	360.461	3.965	50	40	FHGB	
COc1cccc(CO[C@@H](C)C(=O)NNc2ccccc2C(F)(F)F)c1	40093880	QHHAIVYCCYIVPT-LBPRGKRZSA-N	368.355	3.762	50	40	FHGB	
COc1ccc(-c2cc(C(F)(F)F)n3nc(C(=O)Cl)cc3n2)cc1	2521294	AUTQOYBEOUSSFW-UHFFFAOYSA-N	355.703	3.803	50	40	FHGB	
C[C@@H](I)C[C@](F)(OC(F)(F)F)C(F)(F)F	2530911	MGSMUGDXPQAOBJ-DMTCNVIQSA-N	354.003	3.965	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)cc1	59197920	USUAMSFEVZHBBT-YBFXNURJSA-N	354.387	3.559	50	40	FHGB	
O=C(N/N=C/c1cc(Cc2ccccc2Cl)ccc1O)c1ccncc1	2351626	LOBMEAKMPBHEQI-YDZHTSKRSA-N	365.820	3.795	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(Cl)c(C(=O)O)c3)o2)o1	408728554	ONSSBBNROHKNEM-AWQFTUOYSA-N	372.764	3.964	50	40	FHGB	
O=C(N/N=C\c1cc(Cl)ccc1OC(=O)c1ccco1)c1ccccc1	409217784	BPTJMIHIQMRYIN-MTJSOVHGSA-N	368.776	3.916	50	40	FHGB	
CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)cc1	5051900	MVWBBFRPVDXVFP-HNNXBMFYSA-N	352.438	3.714	50	40	FHGB	
C/C(=N/NC(=O)Cn1ccc2ccccc21)c1cccc(Br)c1	199417822	JWHKGYUNPSSTGP-MOSHPQCFSA-N	370.250	3.944	50	40	FHGB	
CCOC(=O)[C@H]1C[C@@H](Cl)[C@H](Sc2ccccc2)C[C@H]1C(=O)OCC	36550940	AUTVLJMYUKTMEB-ZJIFWQFVSA-N	370.898	3.907	50	40	FHGB	
COc1cc(Cl)cc(Cl)c1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2	659325	LKACDGFFSMODMQ-CQSZACIVSA-N	365.216	3.817	50	40	FHGB	
COc1ccc2c(c1O)-c1cccc3c1[C@H](C2)N(CCOCCCl)CC3	1570375	KNOIVLXSJQLGRZ-KRWDZBQOSA-N	373.880	3.779	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1cccc(Cl)c1	2774402	RNDDKMZMMOYDIL-KPKJPENVSA-N	357.753	3.802	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@H]1c1ccc(F)cc1	627504	UIGMUIHHUGYMCM-KRWDZBQOSA-N	364.376	3.608	50	40	FHGB	
O=Nc1ccc(O)c(/C=N/NC(=O)CSc2cccc3cccnc23)c1	35939839	LNJBFOLKPBSKLM-KEBDBYFISA-N	366.402	3.581	50	40	FHGB	
CCn1c(C)nc2cc(C(=O)N/N=C/c3ccccc3OC(F)F)ccc21	3303732	YCPYNUYSCNCIFC-SSDVNMTOSA-N	372.375	3.730	50	40	FHGB	
COC(=O)N/N=C/c1ccc(OCCCOc2ccc(Cl)cc2)cc1	4525985	QGHDZLCRURKSNG-DEDYPNTBSA-N	362.813	3.878	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2ccccc2C(C)(C)C)cc1OC	4724396	HHJKGSZIJIEFJE-LPYMAVHISA-N	370.449	3.530	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccccc2C(=O)O)o1)C(=O)NCc1ccccc1	4723449	ACHZJXREXLSCNV-FOWTUZBSSA-N	372.380	3.868	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc3ccccc3c2)ccc1OCC#N	6229924	ALWAZMHIRYBFPY-OEAKJJBVSA-N	359.385	3.515	50	40	FHGB	
BrC[C@@H]1CN=C(Nc2ccccc2Br)S1	822694	ZCGOFPRUTCUETF-SSDOTTSWSA-N	350.079	3.727	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2c(Cl)nn(-c3ccccc3)c2C)cc1	58961932	IMFMZKIRBZBOQT-CIAFOILYSA-N	368.824	3.607	50	40	FHGB	
Cc1ccc2cc(CN(C(=O)CCl)c3ccccc3)c(=O)[nH]c2c1C	13998728	IAPGXNZYHWLVFB-UHFFFAOYSA-N	354.837	3.917	50	40	FHGB	
O=C(CCl)Nc1sc2c(c1C(=O)NC1CCCCC1)CCCC2	2569095	TYQBZIQJQFLOHW-UHFFFAOYSA-N	354.903	3.867	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(Br)cc2)cc1C	59720929	ATWGYWWLJIGZJW-KEBDBYFISA-N	360.255	3.628	50	40	FHGB	
O=C(CBr)Nc1cccc(C(=O)Nc2cccc(Cl)c2)c1	35605330	BCCOVEAHLSEJKQ-UHFFFAOYSA-N	367.630	3.926	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cc(C)c(Cl)cc2OC)cc1O	3304556	ZBLKWSYHWFEEOK-NTUHNPAUSA-N	372.808	3.917	50	40	FHGB	
CCOC(=O)CSC1=C(C#N)[C@H](c2ccco2)C2=C(O)CCCC2=N1	2229398	CXWBORAZEGKGEJ-MRXNPFEDSA-N	358.419	3.845	50	40	FHGB	
O=P(c1ccccc1)(c1ccccc1)c1cc(Br)ccc1O	68600196	GQDCOXDCOMHMJX-UHFFFAOYSA-N	373.186	3.794	50	40	FHGB	biogenic
Cc1cc(/C=N/NC(=O)c2ccccc2O)c(C)n1-c1ccccc1F	1096145	OQZIKMFXXKMRFQ-WSDLNYQXSA-N	351.381	3.703	50	40	FHGB	
O=C(N/N=C\c1ccco1)c1cc(-c2ccc3c4c(cccc24)CC3)n[nH]1	11612259	OEPLHDVMDAILPZ-UUYOSTAYSA-N	356.385	3.685	50	40	FHGB	
COc1cccc(/C=N\NC(=O)COc2ccc(C(C)(C)C)cc2)c1OC	12381719	ALXSHYSGJLBONN-XKZIYDEJSA-N	370.449	3.530	50	40	FHGB	
Cc1ccccc1-c1nnc(NC(=O)[C@H](Br)C(C)C)s1	4070338	BWADFIRMTREXKT-LLVKDONJSA-N	354.273	3.872	50	40	FHGB	
COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)cc1OC	948104	LLGKPOCYCFAPQS-OQLLNIDSSA-N	363.822	3.696	50	40	FHGB	
O=C(NNc1ccnc2ccccc12)c1cccc(OCc2cccnc2)c1	106924720	XJPZPBZWWSBBDR-UHFFFAOYSA-N	370.412	3.966	50	40	FHGB	
CCCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccn2)cc1OC	1803178	HXCMWESPJVHBAK-FOWTUZBSSA-N	351.406	3.815	50	40	FHGB	
O=C(CCc1ccccc1)c1ccccc1OC[C@@H](O)CBr	22053227	PRQKSWPBFZCKPM-HNNXBMFYSA-N	363.251	3.637	50	40	FHGB	in-vitro
Cc1occc1C(=O)NNC(=O)N[C@H](c1ccc(F)cc1)c1cccs1	58292862	LNQFUGOCSCCKLG-MRXNPFEDSA-N	373.409	3.522	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2O)cc1Cl	6199569	VBTJYTGSEVJYTC-SRZZPIQSSA-N	368.824	3.612	50	40	FHGB	
COc1ccc(C(=O)CNC(=O)CCCC[C@H]2CCSS2)cc1	85878330	TYYLUAWCFFFION-HNNXBMFYSA-N	353.509	3.708	50	40	FHGB	biogenic
COc1ccc(Cl)c(C(=O)[C@@H](Br)CBr)c1	308811861	RTHLLWWBDMGKOP-QMMMGPOBSA-N	356.441	3.690	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2cc3ccccc3o2)c(C)n1-c1cccnc1	15012909	AOBWVZGSECJWKZ-FMCGGJTJSA-N	358.401	3.999	50	40	FHGB	
CCOc1ccccc1/C=N\NC(=O)c1ccc(OCC)c(OCC)c1	6355786	NSNKSBSGNWUJMI-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
CCOc1cc(/C=C2/C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)ccc1O	100251342	CHIIXBZMOIIKQT-AUWJEWJLSA-N	358.401	3.799	50	40	FHGB	
O=C(CCC(=O)OC(CCl)CCl)Nc1cccc2ccccc12	2753117	AFUSYLAQIPBDJO-UHFFFAOYSA-N	354.233	3.948	50	40	FHGB	
CC(C)N(C(=O)CCl)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1	100178135	XLTOXUILBPGDFS-CALCHBBNSA-N	366.889	3.700	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@H]1c1ccc(F)c(F)c1	6813962	ITTSUPCFZLMJGO-HNNXBMFYSA-N	350.328	3.573	50	40	FHGB	
CC(C)(OO)C1=C[C@@]23CC[C@H]4[C@@](C)(C(=O)O)CCC[C@]4(C)[C@H]2C[C@@H]1OO3	85666097	HAPYGVXWHYQMIJ-GEINJRJHSA-N	366.454	3.961	50	40	FHGB	
N#C/C(=C/c1cn(-c2ccccc2)nc1-c1cc2ccccc2o1)C(N)=O	3244320	UMAXZCCYEBRVRE-GDNBJRDFSA-N	354.369	3.678	50	40	FHGB	
N#C/C(=C\c1cccc(Oc2ccccc2)c1)C(=O)NCCCn1ccnc1	26770721	MYWZLTZYNWVOMV-XMHGGMMESA-N	372.428	3.789	50	40	FHGB	
CCCOc1c(I)cc(C=C(C#N)C#N)cc1OC	409006358	IWTNDUNVPDWRPA-UHFFFAOYSA-N	368.174	3.519	50	40	FHGB	
COc1ccc(C(=O)[C@H](Br)CBr)c(Cl)c1	308777454	AZVJMJVMBWCILD-MRVPVSSYSA-N	356.441	3.690	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CCCCC2)[C@@H]1c1ccccc1	19594797	VEVBBFJWPSYTNH-UGKGYDQZSA-N	361.445	3.854	50	40	FHGB	
COc1cc(OC)cc(C(=O)N/N=C/c2ccc(Cl)cc2Cl)c1	5512208	KJLIXPRXENDQPB-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
CCOc1c(/C=N/NC(=O)c2cc3cccc(OC)c3o2)cccc1OC	6958293	MMVGXBLUTHXXLI-CIAFOILYSA-N	368.389	3.613	50	40	FHGB	
COc1ccccc1/C=N/NC(=O)c1cccc(OC(F)(F)C(F)F)c1	681572	HOUBMUOMZNQPGW-LSHDLFTRSA-N	370.302	3.696	50	40	FHGB	
COc1ccc2cc(-c3cc(C(=O)NN)nn3-c3ccccc3C)ccc2c1	59472513	HKBBDFZZFPVKQH-UHFFFAOYSA-N	372.428	3.613	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)N/N=C/c1cn(C)c3ccccc13)c(C)n2C	5024670	BWKJLYHWTSAXBJ-FSJBWODESA-N	374.444	3.751	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)cc1[N+](=O)[O-]	4211342	WZTWANQHYDPTDN-KPKJPENVSA-N	357.753	3.802	50	40	FHGB	
O=C(CCc1ccccc1)NNC(=O)C(c1ccccc1)c1ccccc1	4426504	JJUJRTBMVQRARA-UHFFFAOYSA-N	358.441	3.599	50	40	FHGB	
C/C(CC(=O)Nc1ccccc1C(C)C)=N\NC(=O)c1ccccc1O	4691235	MCDKEVFLMCBZSA-HYARGMPZSA-N	353.422	3.650	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)cc1	5978639	AQBKHLYCMVIXPD-UHFFFAOYSA-N	360.413	3.649	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)ccc1OCC#N	408805888	IBOWLRBYHBANQS-CEWLDGSWSA-N	367.449	3.590	50	40	FHGB	
Cn1c(=O)oc2cc(N/C=C(\C#N)c3nc4cc(Cl)ccc4o3)ccc21	16363986	KPRABRLFDPIQCL-MDZDMXLPSA-N	366.764	3.903	50	40	FHGB	
Cc1cccc(COc2cccc([C@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)c2)c1	5818497	PLQTWOWHIRTLSV-FQEVSTJZSA-N	372.428	3.824	50	40	FHGB	
COc1cc2ccccc2cc1C(=O)N/N=C/c1cc(Cl)ccc1O	6453911	NXJCDHPMJGKQMV-SRZZPIQSSA-N	354.793	3.971	50	40	FHGB	
CCN1CC=C2[C@H](C1)[C@H](c1ccc(C(C)C)cc1)C(C#N)=C(N)C2(C#N)C#N	664294	YAPQBNGFTOKIEC-PZJWPPBQSA-N	371.488	3.555	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@H]1c1ccsc1	705782	XBOCHQNTSIPRQJ-OAHLLOKOSA-N	352.415	3.530	50	40	FHGB	
COc1ccc(SCC(=O)N/N=C/c2c(C)n(C)c3ccccc23)cc1	59249510	PSYOBAWECAQEPI-CIAFOILYSA-N	367.474	3.738	50	40	FHGB	
CC(C)C1=CC(=O)[C@@](C)(Cl)[C@@H](Cl)/C1=N/S(=O)(=O)c1ccccc1	105600293	DWZUIUHHYJXENG-UQDCMPHNSA-N	374.289	3.586	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)cc(Cl)c1O	409048806	UCXINMPUEWYJKW-ULBYWEGOSA-N	350.846	3.721	50	40	FHGB	
COc1cc2ccccc2cc1C(=O)N/N=C/c1cccc(OC)c1OC	33957607	OKZDTJQWDOUTQL-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
N#C/C(=C/c1cc([N+](=O)[O-])ccc1Cl)C(=O)NCCc1ccccc1	207841262	IVWKGMKORBDSGI-GDNBJRDFSA-N	355.781	3.514	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)C[C@@H]2C[C@H]3CC[C@@H]2C3)c(C)n1-c1ccccc1	8027246	LGPWCQUNYSZTDF-KSZLIROESA-N	365.477	3.681	50	40	FHGB	
O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1cccc(Cl)c1	107780377	GKGQYTYAAVWUHL-SSDVNMTOSA-N	363.804	3.604	50	40	FHGB	
O=C(NN(C(=O)c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1	2258941	XXXAJWRVZLEORV-UHFFFAOYSA-N	361.357	3.587	50	40	FHGB	
CCN(CC)c1ccc(C(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)cc1	5119595	LOXHQRONANXMPA-PXLXIMEGSA-N	369.465	3.704	50	40	FHGB	
CCOC(=O)/C(C#N)=C/Nc1cc(C)nn1-c1ccccc1C(F)(F)F	7698340	UOVXMZBAKOEBHX-ZRDIBKRKSA-N	364.327	3.582	50	40	FHGB	
O=C(Oc1ccc(Cl)cc1/C=N\NC(=O)c1ccco1)c1ccccc1	409226770	WSFMONLGRSVMKL-MTJSOVHGSA-N	368.776	3.916	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2c(Cl)nn(-c3ccccc3)c2C)cc1	408895106	TUFXYPBOZUYPSK-CIAFOILYSA-N	352.825	3.906	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)cc(OC)c1O	408814791	WFQUEPYKFLVBFI-IYSPOMMRSA-N	362.429	3.914	50	40	FHGB	
CC(C)OC(=O)c1ccc(Cl)cc1-c1ccc(/C=C(\C#N)C(N)=O)o1	409195455	USBLLUKNZKTQBV-YRNVUSSQSA-N	358.781	3.557	50	40	FHGB	
O=C(COc1cccc(Br)c1)N/N=C\c1ccc(Cl)s1	35103683	MAZXKDBQHPULRZ-APSNUPSMSA-N	373.659	3.693	50	40	FHGB	
CCCO[C@](C)(C(=O)Nc1ccc(OCCBr)cc1)C1CC1	225671586	SANONGBVPJAMOO-KRWDZBQOSA-N	370.287	3.994	50	40	FHGB	
Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1cc(Cl)ccc1Cl	226366730	KOUWDMOFJBQXCR-UHFFFAOYSA-N	362.216	3.549	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2cc3ccccc3o2)ccc1OC(C)C	9323654	IIEJLTFABYZYMG-CIAFOILYSA-N	352.390	3.993	50	40	FHGB	
Cc1ccc(C(=O)N/N=C(\CC(=O)C(F)(F)F)c2cccs2)cc1	408977127	UJYVWKCSPLIXHY-UDWIEESQSA-N	354.353	3.712	50	40	FHGB	
CCc1ccc2c(c1)/C(=N/NC(=O)c1ccc(Cl)cc1Cl)C(=O)N2	20818567	RZBSXIXAVKNOAT-UHFFFAOYSA-N	362.216	3.642	50	40	FHGB	
CCCCc1ccc(OCC(=O)N/N=C/c2cc(OC)ccc2OC)cc1	3174749	QHXNXQSDUYSOPS-HYARGMPZSA-N	370.449	3.576	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C/c1cc2c(cc1Cl)OCO2)c1ccccc1	2759545	PMJBWHGRKYYKAJ-QNKXHIPISA-N	354.793	3.853	50	40	FHGB	
Cc1ccc2nc(Cl)c([C@@H]3C(C#N)=C(N)Oc4cc(N)ccc43)cc2c1	899593	PGXJWRZSBTYYGB-GOSISDBHSA-N	362.820	3.997	50	40	FHGB	
COc1cc(/C=C(\C#N)c2nc3cc(C)ccc3[nH]2)cc([N+](=O)[O-])c1O	13554711	MEMKDJAGJLJEOO-WUXMJOGZSA-N	350.334	3.558	50	40	FHGB	
CCCOc1cccc(/C=N\NC(=O)c2ccc(OCC)c(OC)c2)c1	409322623	KZTWIRUOGKHMAU-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(Cl)cc1Cl)c1cccc(O)c1	662906	FZDPZROXXPEKJJ-VXLYETTFSA-N	353.205	3.618	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C\c1cc(Br)ccc1O)c1ccccc1	6680709	RNWICFCYANMZML-CDCQXCROSA-N	371.234	3.939	50	40	FHGB	
COc1cc(Br)c(/C=C(\C#N)c2nc(C)cs2)cc1O	8079598	QDVHXZJJJDXVCZ-XCVCLJGOSA-N	351.225	3.992	50	40	FHGB	
C=CCOc1ccc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1	408905306	WWZCCKVHJIMGCY-NDENLUEZSA-N	365.345	3.670	50	40	FHGB	
NNC(=O)c1cn(C(=O)c2ccc(-c3ccccc3)cc2)c2ccccc12	216950838	MNBJGOLNVNAFRF-UHFFFAOYSA-N	355.397	3.600	50	40	FHGB	
COc1cc(NC(=O)/C(C#N)=C/c2ccccc2OC)c(OC)cc1Cl	40865769	OQPURUGHOILDRT-MDWZMJQESA-N	372.808	3.911	50	40	FHGB	
COc1ccc(-c2cc(C(F)(F)F)n3ncc(C(=O)Cl)c3n2)cc1	2521297	GAQRZEOKZVGKRV-UHFFFAOYSA-N	355.703	3.803	50	40	FHGB	
I[C@H]1c2ccccc2[C@H]1I	100433052	NDFPAKDLGIXZHH-OCAPTIKFSA-N	355.944	3.652	50	40	FHGB	
O=C(CSSCC(=O)Nc1cccc(F)c1)Nc1cccc(F)c1	1806514	CPOIYZOMSKVGJN-UHFFFAOYSA-N	368.430	3.923	50	40	FHGB	
Cc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c(C)n1-c1ccc(O)cc1	409221573	SDRCFKXNMNFEBK-QRVIBDJDSA-N	365.408	3.632	50	40	FHGB	
O=C(N/N=C/C(c1ccccc1)c1ccccc1)[C@H]1COc2ccccc2O1	5752487	VNFRXQVSBAIFIJ-VCOZGABYSA-N	372.424	3.761	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)CSCCc2ccccc2)cc1OC	408725214	DNSYXYLTGIZNCN-RCCKNPSSSA-N	372.490	3.520	50	40	FHGB	
COC(=O)COc1c(Cl)cc(/C=C(/C#N)c2ccccc2)cc1OC	409366600	WWTJYFHCUJBBGZ-NVNXTCNLSA-N	357.793	3.965	50	40	FHGB	
C[C@H](Sc1ccccc1)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl	408857126	JRJWNSUASAOMHI-HPAYWCODSA-N	363.826	3.879	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1	255504609	YEBKQVQOKXKNQT-AQTBWJFISA-N	359.429	3.832	50	40	FHGB	
CCC[C@@H](C(=O)OCC)/C(C)=N/NC(=O)c1cc2ccccc2cc1O	4394108	HQLOGLRAQAMGKL-WMRWHDLOSA-N	356.422	3.631	50	40	FHGB	
CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccoc2)C(C#N)=C(N)S1	1073889	PIRILUYIFGBTCL-QGZVFWFLSA-N	352.415	3.821	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@H]2C[C@H]3C[C@H](CBr)[C@@H]2C3)cc1	2575336	SSOHWXRVPHYKLJ-NEBZKDRISA-N	359.285	3.510	50	40	FHGB	
COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1cc(C)ccc1C	4953207	SPMIWMMWKPGPFQ-UHFFFAOYSA-N	361.401	3.760	50	40	FHGB	
CC(C)(C)OC(=O)N/N=C/c1ccc(OC(F)F)cc1OC(F)F	3322578	RKAKYLAVMBPNPX-FBCYGCLPSA-N	352.284	3.748	50	40	FHGB	
O=C(N/N=C\c1cccn1-c1ccc(O)cc1)Nc1ccc(Cl)cc1	409022535	RMHPTUAQUUABNF-NDENLUEZSA-N	354.797	3.992	50	40	FHGB	
CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1c[nH]c2ccccc12	4103813	YWTALLZSDCEHCG-SDNWHVSQSA-N	359.385	3.890	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C\c2ccc(O)c(Cl)c2)cc1OCC	409324563	UDIHVRMPFKEHAY-JAIQZWGSSA-N	362.813	3.607	50	40	FHGB	
O=C(N/N=C\c1ccc(Br)c([N+](=O)[O-])c1)Nc1ccccc1	136958066	OVXSXXCUUNSAML-SXGWCWSVSA-N	363.171	3.513	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)c2ccccc2N)c(OC(C)C)c1	6317663	MORQXMDOOPGQGE-WSDLNYQXSA-N	355.438	3.607	50	40	FHGB	
N#CC1=C(SCc2ccccc2)NC(=O)C[C@H]1c1ccc([N+](=O)[O-])cc1	12250099	GKTKSTONYYCIMD-INIZCTEOSA-N	365.414	3.867	50	40	FHGB	
CN(C)c1cccc(C(=O)N/N=C/c2cccn2-c2ccc(Cl)cc2)c1	4740755	OWNYMNXHJZPYQJ-HYARGMPZSA-N	366.852	3.961	50	40	FHGB	
CCOC(=O)COc1ccccc1/C=C(/C#N)c1nc2cc(C)ccc2[nH]1	4705569	XFXPGJWTMNPQST-WJDWOHSUSA-N	361.401	3.877	50	40	FHGB	
C#CCOc1ccc(Cl)cc1/C=C(\C#N)C(=O)Nc1ccc(OC)cc1	408795637	CQNPLHBGKBWPSO-RVDMUPIBSA-N	366.804	3.906	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C\c2ccc(OC)c(Cl)c2)cc1OC	409326775	NZLDEWZBJWUNNM-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
CCOc1ccccc1[C@@H]1C(C#N)=C(N)Nc2onc(-c3ccccc3)c21	100616264	XYTDLUGDHRJOKJ-QGZVFWFLSA-N	358.401	3.992	50	40	FHGB	
C[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3F)[C@H]2C1	4730526	QBQKOQFOCNSULL-GYOIFBIXSA-N	350.372	3.804	50	40	FHGB	
CCOC(=O)/C(C#N)=C1/C(=O)N(Cc2ccc(Cl)cc2)c2ccccc21	409388921	OAOGAWHUZJSXPS-FBMGVBCBSA-N	366.804	3.727	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)cc1[N+](=O)[O-]	250505556	DGXSHMSRISYRIG-QQSSKNFGSA-N	359.426	3.660	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)[C@@H](C)Sc2ccccc2)cc1	831220	OCKRRWYWELQPMZ-CNRHGSOZSA-N	355.463	3.666	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)Nc1ccc(O)cc1	832434	WQYNNGRSZMRUTC-RVDMUPIBSA-N	374.352	3.896	50	40	FHGB	
C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)c1ccccc1Cl	100522994	PPWLQAPOEILXJU-LPYMAVHISA-N	372.856	3.541	50	40	FHGB	
C/C(=N\NC(=O)c1ccco1)c1ccc(NC(=O)c2cccs2)cc1	13108457	DDGFZUFDVFIHJQ-UDWIEESQSA-N	353.403	3.747	50	40	FHGB	
CCOC(=O)c1sc(=S)n(-c2ccccc2)c1NC(=O)CCl	64981054	IBEXSFPEZIMVRX-UHFFFAOYSA-N	356.856	3.622	50	40	FHGB	
O=C(N/N=C/c1ccc(Sc2nc3ccccc3[nH]2)o1)c1ccco1	1030183	IKWQPXRONLNOPH-VCHYOVAHSA-N	352.375	3.664	50	40	FHGB	
Cc1cc2c(cc1/C=N/NC(=O)c1ccncc1)[C@H](C)CC(C)(C)N2C	208214650	HYFHZCRJKSBQSL-LJGKHRNASA-N	350.466	3.876	50	40	FHGB	
CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1	6398432	SKTKMLCRLFATFR-GOSISDBHSA-N	374.396	3.800	50	40	FHGB	
C/C(N)=C(\C#N)C(=O)CSc1ncnc2scc(-c3ccccc3)c12	103068834	GRAWNLZVBLZYBR-QBFSEMIESA-N	366.471	3.776	50	40	FHGB	
N#C/C(=C/c1ccsc1)C(=O)Nc1cc(Cl)ccc1N1CCOCC1	57405815	NMTCSGUMSAVXHJ-ZROIWOOFSA-N	373.865	3.784	50	40	FHGB	
COc1cc(/C=N/NC(=O)OC(C)(C)C)ccc1OC(=O)c1ccccc1	2295510	IGEBYKYSPNTMGS-FYJGNVAPSA-N	370.405	3.773	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1OCC	4723685	SESFCOKCFMOLGP-PDGQHHTCSA-N	350.418	3.707	50	40	FHGB	
Cc1cc(Br)c(NC(=S)NC(=O)CCCCl)cc1C	32099640	HQEZSSGKGZREJN-UHFFFAOYSA-N	363.708	3.898	50	40	FHGB	
COc1cc(/C=N\NC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)ccc1O	43766953	QZKWHVKONPVSPE-PXNCGERRSA-N	354.450	3.853	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Br)cn1C)[C@@H]1C[C@H]1c1ccccc1	585145958	LLPTXZMRYOWKSX-WTQAEKLLSA-N	360.255	3.697	50	40	FHGB	
Cc1cccc(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2Cl)c1C	5419249	JIASZZBVWLBRNA-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2Cl)c(O)c1	1427525	GNYZRFKQOLNSQQ-UFWORHAWSA-N	353.205	3.537	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cccc3ncccc23)c(OC)c1	3288789	ISVRLTWGZSCWEA-RVDMUPIBSA-N	359.385	3.798	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cccc3ccccc23)c(OC)c1OC	2096295	UFXBLDFCUZOBGD-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)OCc2cc(C(C)=O)ccc2OC)cc1	7005105	UQRUQUFNJQAFIL-LICLKQGHSA-N	365.385	3.557	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2cc(Cl)c(O)c(OC)c2)cc1	111689799	MCUFVGUERLQASO-GHXNOFRVSA-N	358.781	3.608	50	40	FHGB	
COc1ccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)c([N+](=O)[O-])c1	408868053	LEVQBVMZMUBSRG-VCHYOVAHSA-N	371.374	3.689	50	40	FHGB	
N#C/C(=C/c1ccc(Sc2ccc(Cl)cc2)s1)C(=O)NC(N)=O	409233560	GIBAORNCGFLIOI-CLFYSBASSA-N	363.851	3.655	50	40	FHGB	
O=C(N/N=C(\Cc1nc2ccccc2[nH]1)c1ccccc1)c1ccccc1	822244	NFPYLTDFSMUVMH-LKUDQCMESA-N	354.413	3.940	50	40	FHGB	
COC(=O)[C@]1(C)CCC[C@]2(C)c3cc(OC)ccc3C(=O)[C@@H](Cl)[C@H]21	5004487	CAQCHCCVWVJUGY-YCEFEEMOSA-N	350.842	3.736	50	40	FHGB	
COc1ccc(C(=O)NNc2nc3cc(C)cc(C)c3s2)cc1OC	4121461	ICTSEOLDHRSRBA-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(O)O2	6232992	ZTUBQZPCAJPLQZ-SFHVURJKSA-N	374.356	3.906	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)c2cc3ccccc3cc2OC)c1O	59147232	JIANKUPCNFGADU-LPYMAVHISA-N	364.401	3.717	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)COc1cc(C)c(Cl)c(C)c1	5466857	SUJOIWUNEOUWGQ-SRZZPIQSSA-N	360.841	3.885	50	40	FHGB	
CC(=O)N/N=C/c1ccc(OCc2ccccc2F)c(Br)c1	409013918	OMRFWLWFVADCRO-DJKKODMXSA-N	365.202	3.637	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)cc(SC#N)c1O	409038696	AQKHNAQCTINDBY-SDQBBNPISA-N	369.377	3.659	50	40	FHGB	
N#C/C(=C\c1cc(Br)cc(Cl)c1O)C(=O)NC1CCCC1	409190345	XILULWDUURWXNT-BJMVGYQFSA-N	369.646	3.774	50	40	FHGB	
COc1ccccc1NC(=O)/C(C#N)=C/c1cc(Br)ccc1O	1453919	XMMQWCNEHJKROT-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2cc(Cl)c(OC)c(Cl)c2)cc1	2801962	UVVFGVQWXJSGMZ-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
Cc1ccccc1/C=N/NC(=O)c1nc(Cl)c(Cl)c(N)c1Cl	23230848	WNRFMKIZPRUAFD-KPSZGOFPSA-N	357.628	3.696	50	40	FHGB	
O=C(NNC1=Nc2cccc3cccc1c23)c1ccc(Br)cc1	4979942	YEGFDPRPLRNQKO-UHFFFAOYSA-N	366.218	3.929	50	40	FHGB	
CCC1=C(C(=O)OC)[C@@H](c2ccc(Cl)c(Cl)c2)C(C#N)=C(N)O1	8382604	HQDUAFBJLGQLSF-ZDUSSCGKSA-N	353.205	3.638	50	40	FHGB	
N#C/C(=C\c1cc2c(cc1Cl)OCO2)C(=O)Nc1sccc1C#N	17073861	YXMUGNMCJVXIGK-QDEBKDIKSA-N	357.778	3.548	50	40	FHGB	
O=C(N/N=C\c1cn(Cc2ccc(F)cc2)c2ccccc12)c1ccncc1	33453608	COTCJSDOPOODQX-MXAYSNPKSA-N	372.403	3.988	50	40	FHGB	
CCOC(=O)c1csc(NC(=O)CCCC[C@@H]2CCSS2)n1	96115698	VHEVAEXUONJSSB-SNVBAGLBSA-N	360.526	3.972	50	40	FHGB	biogenic
COc1ccc(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)cc1	704558	OTFDTUXBOMEAAP-DJKKODMXSA-N	353.205	3.531	50	40	FHGB	
O=S(=O)(N/N=C(/CCCCl)c1ccc(F)cc1)c1ccccc1	17073404	RSLZLWHWJYTYHR-MNDPQUGUSA-N	354.834	3.527	50	40	FHGB	
Cc1ccccc1N1C(S)=C(C#N)C(=O)N[C@H]1c1ccc(Cl)cc1	645037	VDZDLSMDZPGBEV-MRXNPFEDSA-N	355.850	3.948	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)NCc1ccco1	1446766	OYYJNVYMHNCYAI-GXDHUFHOSA-N	363.329	3.671	50	40	FHGB	
COc1ccc(CC(=O)N/N=C\c2cccn2-c2ccc(Cl)cc2)cc1	408952839	VZTRIBRBTRTAKW-HMAPJEAMSA-N	367.836	3.832	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)c2ccc(-c3ccccc3F)s2)s1	84205201	ZNNTZLJBFNWIGO-UHFFFAOYSA-N	360.435	3.999	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc1	2335514	ZEUYTCHDUBQGOS-UDWIEESQSA-N	369.446	3.859	50	40	FHGB	
O=C(NNC(=O)c1cc(-c2ccco2)nc2ccccc12)c1ccccc1	3307548	KZCRENSGALAUQA-UHFFFAOYSA-N	357.369	3.570	50	40	FHGB	
CCc1cccc(CC)c1NC(=O)COC(=O)/C(C#N)=C\c1ccccc1	6343534	AVNNFUPASJLABI-UYRXBGFRSA-N	362.429	3.900	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=N\NC(=O)c3ccco3)o2)cc1Cl	409063031	FSVRROMBEXQRFP-JMIUGGIZSA-N	372.764	3.744	50	40	FHGB	
COC(=O)CC[C@@H](CO[Si](C)(C)C(C)(C)C)NC(=O)OC(C)(C)C	196247446	BTKLPINUUIACIA-ZDUSSCGKSA-N	361.555	3.855	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc1	6286714	GEDMFQKQORHPOO-FOKLQQMPSA-N	365.355	3.666	50	40	FHGB	
CCOC(=O)[C@H]1C[C@@H](Cl)[C@@H](Sc2ccccc2)C[C@H]1C(=O)OCC	36550939	AUTVLJMYUKTMEB-JJXSEGSLSA-N	370.898	3.907	50	40	FHGB	
O=C(Oc1ccc2c(c1)CCCN2C(=O)C(Cl)Cl)c1ccco1	538272	SBJGFIXQRZOVTO-UHFFFAOYSA-N	354.189	3.582	50	40	FHGB	investigational
CCOC(=O)c1c(C)[nH]c(C(=O)/C(C#N)=C\c2ccc(N(C)C)cc2)c1C	43080132	ATVZFOHMJVBBSN-WJDWOHSUSA-N	365.433	3.664	50	40	FHGB	
CSC1=C(C#N)[C@H](c2ccco2)C(C(=O)Nc2ccccc2)=C(C)N1	1505040	IDKHWZRWHWBCOL-QGZVFWFLSA-N	351.431	3.977	50	40	FHGB	
CCC(CC)C(=O)Nc1ccc(/C(C)=N\NC(=O)c2cccnc2)cc1	17073054	QHKWABFXCMZIDL-UCQKPKSFSA-N	352.438	3.610	50	40	FHGB	
Cc1cccc(C(=O)N/N=C\c2cc([N+](=O)[O-])c(Cl)cc2Cl)c1	409212073	OOOLONJVUBKXDP-LSCVHKIXSA-N	352.177	3.974	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)c2ccc(Br)o2)cc1	5475358	OWQUWFFURCUHJJ-LICLKQGHSA-N	351.200	3.595	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Sc1ccc(C)cc1)c1cccc([N+](=O)[O-])c1	409121540	YJSFYMVTGYBUCZ-ITRAFESCSA-N	357.435	3.924	50	40	FHGB	
COc1cc(/C=N/NC(N)=O)ccc1OCc1ccc(Cl)c(Cl)c1	408893882	GQNWUMSVCBABSQ-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
COc1ccc(C(=O)NN=C2C=C(C(C)C)C(=O)C(C(C)C)=C2)cc1OC	5632776	HREUCGSOELAXKI-UHFFFAOYSA-N	370.449	3.537	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C/c1cccc(OC(=O)c2ccccc2)c1	830868	DNRDCAJZJJWOKP-XQNSMLJCSA-N	358.397	3.599	50	40	FHGB	
O=C(CCCC[C@H]1CCSS1)Nc1ccc(Cn2cncn2)cc1	24629854	LFBLGRHXZKUPHH-INIZCTEOSA-N	362.524	3.979	50	40	FHGB	
Cc1ccc([C@@H](Br)[C@H](Br)C(=O)[C@@]2(C)CO2)cc1	102700602	PQHOXCGXAACSQA-NTZNESFSSA-N	362.061	3.553	50	40	FHGB	
Cc1ccc(-c2nn(-c3ccccc3)cc2/C=N/NC(=O)c2ccco2)o1	52410600	MBIRCOFELFZJIO-CIAFOILYSA-N	360.373	3.798	50	40	FHGB	
Cc1nc2ccccn2c1C(=O)N/N=C/c1cc(C)n(-c2ccccc2)c1C	4091345	LTIILTJXACZBPI-OEAKJJBVSA-N	371.444	3.814	50	40	FHGB	
CCOc1cc(C)c([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1C(C)C	5444422	TUSYUHZLFPFCEY-GOSISDBHSA-N	352.438	3.767	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2cc(C)n(-c3ccccc3)c2C)c(O)c1	409392670	RFLUKLZSFGUNKY-LPYMAVHISA-N	363.417	3.572	50	40	FHGB	
CCC(=NNC(=O)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1	254868314	DCQDUBYNKGKSCP-UHFFFAOYSA-N	364.232	3.862	50	40	FHGB	
CC(=O)Nc1cccc(C(=O)N/N=C/c2ccc(Cl)cc2Cl)c1	6022573	PBFQVCDFCPETCW-DJKKODMXSA-N	350.205	3.716	50	40	FHGB	
Cc1ccccc1NCC(=O)N/N=C/C(Br)=C/c1ccccc1	2898627	XZZIGJLEBBGFLX-OQBHSHHWSA-N	372.266	3.945	50	40	FHGB	
CCCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2C)[C@H](C#N)C(O)=N1	2310116	YONWMCQRGAWENO-YOEHRIQHSA-N	369.446	3.610	50	40	FHGB	
COc1ccc(-c2cc(C(=O)N/N=C(\C)CCc3ccccc3)[nH]n2)cc1	6566836	UCLKHRYCYGAGFQ-PXLXIMEGSA-N	362.433	3.824	50	40	FHGB	
Cn1cc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c2ccccc21	16382511	HNQCBOGIPVBNSR-ATVHPVEESA-N	368.440	3.925	50	40	FHGB	
Cc1ccc(C)c(SCC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	17159073	DMTKQVBTACMOJJ-UHFFFAOYSA-N	372.534	3.759	50	40	FHGB	
Cc1cc(C(=O)N/N=C2/CC(=O)CC(C)(C)C2)c(C)n1-c1ccccc1	101756718	GEMYDLUSDLTZTK-JWGURIENSA-N	351.450	3.959	50	40	FHGB	
CC1(C)[C@]2(C(=O)Nc3ccccc3F)CC[C@@]1(C)C(=O)[C@H]2Br	7260365	SFCDVEAYTLQJKX-OAUYIBNBSA-N	368.246	3.923	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)Nc2ccccc2C)cc(OCC)c1O	107597675	YHJLSNFUXHZSFG-BKUYFWCQSA-N	353.422	3.983	50	40	FHGB	
CCN(CC)c1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N(C)C)c2C)cc1	59334515	TVNLYUOHRAYEOG-RGEXLXHISA-N	364.493	3.936	50	40	FHGB	
O=C(NNC(=O)c1ccccc1F)c1cc2c(s1)-c1ccccc1CC2	12609510	YOCWDSXIHNOJDT-UHFFFAOYSA-N	366.417	3.728	50	40	FHGB	
O=[P@@]1(N(CCCl)CCCl)NCC23C[C@@H]4CC(C[C@H](C4)C2)[C@@H]3O1	301054428	KQPFNDFZAYNYAJ-ITMSKEHESA-N	367.257	3.689	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)cc(Cl)c1O	409048803	UCXINMPUEWYJKW-OGXMHIDPSA-N	350.846	3.721	50	40	FHGB	
COc1ccc(C(=O)CNC(=O)CCCC[C@@H]2CCSS2)cc1	85878321	TYYLUAWCFFFION-OAHLLOKOSA-N	353.509	3.708	50	40	FHGB	biogenic
N#C/C(=C\c1ccc2c(c1)OCO2)C(=O)Nc1cccc(C(F)(F)F)c1	2744064	RAXDPDNUNUTFSK-WUXMJOGZSA-N	360.291	3.980	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccc(C)cc1)c1cccc([N+](=O)[O-])c1	59473585	GQAUHPALJVGPJV-XMHGGMMESA-N	357.435	3.677	50	40	FHGB	
N#CC1=C(SCC(=O)c2ccccc2)NC(=O)C[C@H]1c1ccccc1F	2366942	YNSQYYULZLNCMG-HNNXBMFYSA-N	366.417	3.780	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1cccc(C)c1C	408823581	GFRIMTXPRPNZEH-GZTJUZNOSA-N	364.401	3.946	50	40	FHGB	
CCn1nc(C)c(/C=N/NC(=O)c2cc(C3CC3)nc3ccccc23)c1C	2319433	LABPPSCSPXMQOL-WSDLNYQXSA-N	361.449	3.709	50	40	FHGB	
CC(C)Oc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1	806450	LHBICXPIPWFURE-GOSISDBHSA-N	352.434	3.925	50	40	FHGB	
CCc1ccc2nc(Cl)c([C@@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)cc2c1	1223582	YDGZUWRJBWCJAY-MRXNPFEDSA-N	365.824	3.700	50	40	FHGB	
COC(=O)c1ccc(NC(=O)[C@]23CC[C@@H]([C@H]2Br)C3(C)C)cc1	100919983	ZGDDAYBCQWSPDY-AHIWAGSCSA-N	366.255	3.611	50	40	FHGB	
Cc1ccc(C(=O)NC(NC(=O)c2ccc(C)cc2)C(Cl)Cl)cc1	851398	FJAQTJIVEOPMKJ-UHFFFAOYSA-N	365.260	3.593	50	40	FHGB	aggregator
C=CCOc1ccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1	408953886	QHXXYMXDGGUANJ-RGEXLXHISA-N	371.440	3.999	50	40	FHGB	
N#C/C(=C\Nc1ccc(F)cc1F)S(=O)(=O)c1ccc(Cl)cc1	9306014	GRFSUOIERQMCQR-UKTHLTGXSA-N	354.765	3.869	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C\c2ccc(OCC)cc2)cc1OC	409322417	WTKNDPJFYNHWJO-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
O=C(Cc1cccs1)N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1	5714435	SMYTWBHDCUSFJH-WOJGMQOQSA-N	355.375	3.609	50	40	FHGB	
N#C/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	4173341	JDXTXBRCJPCWJA-WDZFZDKYSA-N	372.724	3.702	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@H]2[C@H]3CCCC[C@]23C)cc1Br	100182268	KBHIRKVXQIODMK-PXECBZEWSA-N	365.271	3.734	50	40	FHGB	
CCOc1ccc([C@@H]2C(C#N)=C(N)N3C(=C2C#N)Nc2ccccc23)cc1	2267837	NRHOLPCJXJFZGK-LJQANCHMSA-N	355.401	3.544	50	40	FHGB	
C/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Br)s1	5289302	CYESTLAHNGZASC-OVCLIPMQSA-N	368.212	3.573	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)Cc1ccc(Br)cc1	4735359	NGBZYYYGBJVFKN-XDHOZWIPSA-N	361.239	3.541	50	40	FHGB	
C=CCOc1cccc(/C=N\NC(=O)c2ccc(OCC)c(OCC)c2)c1	409320692	QUYIPUBRCGTKFY-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl	408857131	JRJWNSUASAOMHI-VDCVXVNISA-N	363.826	3.879	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=N/NC(=O)c2ccc(Cl)cc2)cc1	408857944	NWJQPAGBMWDEPR-HYARGMPZSA-N	366.852	3.961	50	40	FHGB	
N#CCn1cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)c2ccccc21	409247469	HNGBUUQCJGOLJI-CYVLTUHYSA-N	368.440	3.821	50	40	FHGB	
CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(CC[C@@H](C)C2)[C@@H]1c1ccccc1	35193549	SPSUTBNAUGSSCK-YFYZNPQRSA-N	361.445	3.710	50	40	FHGB	
CC(=O)Nc1cccc([P@](=O)(Oc2ccccc2)c2ccccc2)c1	97951079	DHMGLYNQHOTVQI-RUZDIDTESA-N	351.342	3.953	50	40	FHGB	
C=CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)cc1OC	5916003	UYKMXHRYMFJWIB-PTNGSMBKSA-N	350.374	3.511	50	40	FHGB	
COC(=O)c1cccc([C@@H](C)Br)c1I	17378936	BBGFMZCSGKAJID-ZCFIWIBFSA-N	368.996	3.534	50	40	FHGB	
O=C(N/N=C/c1ccccc1OCc1ccc([N+](=O)[O-])cc1)c1ccco1	6495643	LCBFQWWVVWUXEA-UDWIEESQSA-N	365.345	3.531	50	40	FHGB	
CC(=O)Nc1cccc(C(=O)N/N=C/c2cccc(Cl)c2Cl)c1	6563038	RSPNCXMITZFUPC-DJKKODMXSA-N	350.205	3.716	50	40	FHGB	
Cc1cccc(C)c1OCC(=O)N/N=C/c1cccc(Br)c1	3023200	SFUVOMMXAQWQED-VXLYETTFSA-N	361.239	3.595	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)COc2ccc(C)c(C)c2)cc1	1444648	PNILJFQXCSPROY-HYARGMPZSA-N	353.466	3.679	50	40	FHGB	
COC(=O)c1c(NC(=O)CCCCl)sc2c1C[C@H](C(C)C)OC2	2303366	UCAOHXPJVGCRAR-LLVKDONJSA-N	359.875	3.590	50	40	FHGB	
O=C(CSc1cccc2cccnc12)N/N=C/c1cc(Cl)ccc1O	4825598	SJUKQPNAICEZAH-UFFVCSGVSA-N	371.849	3.836	50	40	FHGB	
CC(C)(OO)C1=C[C@@]23CC[C@H]4[C@@](C)(C(=O)O)CCC[C@@]4(C)[C@H]2C[C@@H]1OO3	85666095	HAPYGVXWHYQMIJ-GPKIVMKLSA-N	366.454	3.961	50	40	FHGB	
NC(=O)N/N=C/c1cn(Cc2ccc(Cl)c(Cl)c2)c2ccccc12	1409222	TUFDDSWZNNWBSE-ODCIPOBUSA-N	361.232	3.999	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccccc1CC	408875943	IBOFWNUVDCPHCE-QGOAFFKASA-N	360.413	3.815	50	40	FHGB	
C/C(CCc1ccco1)=N\NC(=O)CNc1cccc(Br)c1	5221624	UUSFUMSTXWGWJD-XDHOZWIPSA-N	364.243	3.579	50	40	FHGB	
O=C(CSCc1ccccc1Cl)N/N=C/c1ccc([N+](=O)[O-])cc1	3088684	BDONNGDLJOBQQL-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
CCc1ccc([C@H]2C(C#N)=C(N)Oc3n[nH]c(-c4cccc(OC)c4)c32)cc1	5163542	KPFIWUGXXDJNSO-SFHVURJKSA-N	372.428	3.866	50	40	FHGB	
Cc1ccc(C(C)C)c(OCC(=O)N/N=C/c2ccc(N(C)C)cc2)c1	2674762	RENFJMZFJCDWDW-LPYMAVHISA-N	353.466	3.714	50	40	FHGB	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cc2)c1C	10405375	KSZAQNDWHORXOI-LFIBNONCSA-N	357.841	3.950	50	40	FHGB	
O=C(NNc1ccccc1[N+](=O)[O-])c1ccccc1SC[C@H]1CCCO1	32820068	PSMCPVXRVFSWJA-CYBMUJFWSA-N	373.434	3.623	50	40	FHGB	
CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccccc1Cl)c1ccccc1	408977620	DYTCAMAFQQVFOD-RSZPVBOMSA-N	373.840	3.668	50	40	FHGB	
Cc1[nH]c2ccccc2c1CC(=O)N/N=C(/c1ccccc1)c1ccncc1	18191484	SBRAYXPLXSROQH-VYIQYICTSA-N	368.440	3.983	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N\NC(=O)Cc1ccc(F)cc1	409233343	VBSZESIHTJEIAP-IWIPYMOSSA-N	360.388	3.684	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)c(OCC)c1	408567388	MHVPMPWNJXGWFF-HYARGMPZSA-N	354.450	3.794	50	40	FHGB	
Cc1sc2nc(/C(C#N)=C\c3ccc4c(c3)OCCO4)nc(O)c2c1C	33782079	USOMUDQCBCVLLW-QPEQYQDCSA-N	365.414	3.849	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccncc2)c(C)n1-c1ccc2ncccc2c1	2175394	JGLIFOVKBURBBS-AFUMVMLFSA-N	369.428	3.801	50	40	FHGB	
N#C/C(=C/c1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(C(=O)O)c1	408545190	ZSMDMUUQNPTKKE-JYRVWZFOSA-N	360.291	3.949	50	40	FHGB	
O=C(CCCl)N1N=C(c2ccccc2)C[C@H]1c1cccc([N+](=O)[O-])c1	4897592	PWIPDJIQKNQUSA-KRWDZBQOSA-N	357.797	3.901	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cccc(N(C)C)c2)c(C)n1-c1ccccc1	408777657	FBMKWUMFUCPAPX-HZHRSRAPSA-N	360.461	3.924	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)c2c[nH]c3ccc(OC)cc23)cc(OC)c1	40139906	UKEYXYPUYMTPDZ-MKMNVTDBSA-N	362.385	3.984	50	40	FHGB	
CCOc1ccc(CCCC(=O)N/N=C/c2ccc(C)c([N+](=O)[O-])c2)cc1	5872962	JVXPOTOFVNDPNU-KGENOOAVSA-N	369.421	3.775	50	40	FHGB	
C/C(=N\NC(=O)c1cccnc1)c1cccc(NC(=O)c2cccs2)c1	5382124	HCSMBEJDEYZITG-LPYMAVHISA-N	364.430	3.549	50	40	FHGB	
Cc1c(-c2ccc(/C=N/NC(=O)c3cccnc3)o2)ccc([N+](=O)[O-])c1C	10130111	NWOPCUBVTVMHLD-SRZZPIQSSA-N	364.361	3.631	50	40	FHGB	
C[C@H](Cl)C(=O)Nc1cccc(C(=O)Nc2nnc(-c3ccccc3)o2)c1	9062116	PVXQJNICYYQYJV-NSHDSACASA-N	370.796	3.555	50	40	FHGB	
O=C(N/N=C1/CC(=O)c2ccccc21)c1ccc(COc2ccccc2)cc1	103452657	SVDOXZGJFAIAMG-FLFQWRMESA-N	370.408	3.986	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(C)c2C)cc1OC	408792734	BUINBMQFHJQMBX-LDADJPATSA-N	360.413	3.870	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccccc2)cc1OC(=O)c1ccccc1	408885940	BTXQXQACRDBVBO-HZHRSRAPSA-N	374.396	3.678	50	40	FHGB	
CC(=O)N/N=C/c1cc(Br)ccc1OCc1cccc(C)c1	409017430	ZVZUMIZXXOSYSE-VXLYETTFSA-N	361.239	3.807	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)Nc1ccc(O)cc1	408790753	YGQPFOSRSBGPNA-RVDMUPIBSA-N	374.352	3.896	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2)cc(SC#N)c1O	409056550	MRPPMDFUEPUEPN-QPEQYQDCSA-N	351.387	3.520	50	40	FHGB	
C=C(C)[C@H](O)C#CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C	195758760	YPTSXSAEYLNTBE-JOCHJYFZSA-N	364.561	3.503	50	40	FHGB	
COc1ccc(O)c(/C=N/NC(=O)c2cc(C3CC3)nc3ccccc23)c1	1085724	SRNMMTZFNHQBKJ-WSDLNYQXSA-N	361.401	3.590	50	40	FHGB	
CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)c3ccco3)c2C)cc1	8043644	ZXBDMTZQYUNRLF-FYJGNVAPSA-N	351.406	3.850	50	40	FHGB	
Cc1ccc(NC(=S)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1	16186215	CORCBLCAYUMLQX-UHFFFAOYSA-N	371.506	3.689	50	40	FHGB	
CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1	17076426	IANMOFKCFVGROL-SFHVURJKSA-N	373.412	3.535	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Br)cc2)o1)c1cccnc1	1833441	QITSQQFYOMDDCC-RGVLZGJSSA-N	370.206	3.868	50	40	FHGB	
COc1ccc(-n2c(C)cc(/C=N/NC(=O)c3ccccc3O)c2C)cc1	6961805	IWNMWNKBPOXQSB-LPYMAVHISA-N	363.417	3.572	50	40	FHGB	
CCSC1=C(C#N)[C@@H](c2ccccc2Cl)[C@H](C(=O)OC)C(O)=N1	9014935	YOYYWBVGEURTTI-OLZOCXBDSA-N	350.827	3.671	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2ccc(OC(C)C)cc2O)cc1	20197738	VZOULOLLZFMHSR-FYJGNVAPSA-N	356.422	3.732	50	40	FHGB	
CCc1[nH]nc2c1[C@@H](c1ccc(-c3ccc(F)cc3)o1)C(C#N)=C(N)O2	5130072	BIMDOACUMVBZTC-MRXNPFEDSA-N	350.353	3.589	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C\c1cc(Br)ccc1O)c1ccccc1	4465443	RNWICFCYANMZML-ZENNRRHLSA-N	371.234	3.939	50	40	FHGB	
C/C(CC(=O)Nc1cc(C)ccn1)=N\NC(=O)c1ccc(C(C)(C)C)cc1	4551151	MSWXEOMSLXIDSA-BUVRLJJBSA-N	366.465	3.822	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1O	4600627	AJHFWYRNUHARNI-VXLYETTFSA-N	353.205	3.618	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccccc1OCc1ccc([N+](=O)[O-])cc1	408777947	MTVBIEUCJDYHTJ-BOPFTXTBSA-N	365.389	3.605	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cccc(C(F)(F)F)c2)c(O)c1	408887708	QMMNJLWTKKCKBX-KPKJPENVSA-N	362.307	3.965	50	40	FHGB	
N#CC1=C(SCc2cccc([N+](=O)[O-])c2)NC(=O)C[C@H]1c1cccs1	409125906	NHLHZQOHAFBIKA-CYBMUJFWSA-N	371.443	3.928	50	40	FHGB	
CN(C)C(=O)c1ccc(N/C=C(\C=O)c2nc3cc(Cl)ccc3o2)cc1	838022	DLVOBJDMOFETGJ-JLHYYAGUSA-N	369.808	3.835	50	40	FHGB	
C[C@H]1CCc2c(sc(NC(=O)/C(C#N)=C/c3ccccc3)c2C(N)=O)C1	941897	WLIHAFPYJZFQEF-LQELWAHVSA-N	365.458	3.517	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)COc2ccc([C@@H](C)CC)cc2)c1O	1319856	SGQVEZOTVFBRII-NSMHLIOHSA-N	370.449	3.834	50	40	FHGB	
O=C(COc1ccc(C2SCCS2)cc1)N/N=C/c1ccsc1	408569288	MUFMLRPQGQFSRI-RQZCQDPDSA-N	364.517	3.756	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)c2c[nH]c3ccc(OC)cc23)cc(OC)c1	98008678	UKEYXYPUYMTPDZ-NSIKDUERSA-N	362.385	3.984	50	40	FHGB	
C/C(=N/NC(=O)[C@H](C)Nc1cccc(Br)c1)c1ccccc1	4619319	IHFAPEZNXXGKAT-RQZLXBNYSA-N	360.255	3.790	50	40	FHGB	
C/C(=N\NC(=O)Cc1cccc2ccccc12)c1ccc2c(c1)OCCO2	14922029	YBQLZHWFNYZHJJ-HZHRSRAPSA-N	360.413	3.694	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(O)O2	6232993	ZTUBQZPCAJPLQZ-GOSISDBHSA-N	374.356	3.906	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(N(C)C)o1	408996433	DRZFWOISIDHALJ-HPAYWCODSA-N	351.859	3.630	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)CCC(=O)Nc2ccccc2Cl)cc1	4691457	KXOLWBXOONCIFD-LPYMAVHISA-N	373.840	3.608	50	40	FHGB	
CCOc1cc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)cc([N+](=O)[O-])c1O	408569452	NTYMXGSCNQHENR-WZUFQYTHSA-N	368.324	3.779	50	40	FHGB	
C#CCn1c(C)c(/C=N/NC(=O)Cc2ccc(C)c(C)c2)c2ccccc21	408567022	KDPNIWAQVJRJPJ-BUVRLJJBSA-N	357.457	3.893	50	40	FHGB	
Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(-c3ccccc3)o2)n1	8336696	AZCVSIKEWIPSEZ-RGVLZGJSSA-N	366.446	3.596	50	40	FHGB	
C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	4503820	BVKUGHOFSKUFEQ-GOSISDBHSA-N	350.418	3.702	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)c2ccccc2Br)c1	7894048	ZGLKWCCDHAMKHL-XDHOZWIPSA-N	359.223	3.778	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)cc1OC	409198554	HUOIUIJSXNOKDW-FSTGKYBXSA-N	365.433	3.632	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@H]2[C@H](C=C(Cl)Cl)C2(C)C)ccc1O	4811691	HXJAIYPOVGPKRG-XGMSJMABSA-N	371.264	3.832	50	40	FHGB	
CCc1c(OC)ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)c1OC	408719543	STLFDRRJZSPXEH-CNRHGSOZSA-N	372.490	3.897	50	40	FHGB	
CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccc(F)cc1	36174413	KFZOSEABLYERFM-VXLYETTFSA-N	365.202	3.751	50	40	FHGB	
CCC1=C(C(=O)OC)[C@@H](c2ccc(Cl)cc2Cl)C(C#N)=C(N)O1	4183418	AUICQMWHJGHRSO-ZDUSSCGKSA-N	353.205	3.638	50	40	FHGB	
N#CC1=C2Nc3ccccc3N2C(=O)N[C@@]1(c1ccccc1)C(F)(F)F	4932609	IJZJQLKOTXYARZ-QGZVFWFLSA-N	356.307	3.835	50	40	FHGB	aggregator
Cc1cc(Oc2nc3ccccn3c(=O)c2C=C(C#N)C#N)ccc1Cl	2402471	CLWAMGKZMREVEY-UHFFFAOYSA-N	362.776	3.879	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C\c2c(Cl)[nH]c3ccccc23)cc1C	5071781	NBLHIRUOALTHBL-FBHDLOMBSA-N	355.825	3.967	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2cc(F)c(N3CCCC3)cc2C)c1	33725285	RSSAOGGVDXDSJF-LPYMAVHISA-N	355.413	3.507	50	40	FHGB	
O=C(N/N=C\c1cccc(O)c1)c1cc2cc(Br)ccc2o1	83331589	QMOWJXLXGDPRDA-NVMNQCDNSA-N	359.179	3.665	50	40	FHGB	
C[C@H]1CC(C)(C)N(C)c2ccc(/C=N/NC(=O)c3ccc(O)cc3)cc21	208207719	MYBJIYOHWRWHQL-KOUDTOEKSA-N	351.450	3.878	50	40	FHGB	
Cc1onc(-c2ccccc2)c1C(=O)N/N=C/c1cn(C)c2ccccc12	4710297	CDWYVXZYDVZFNN-WSDLNYQXSA-N	358.401	3.906	50	40	FHGB	
COc1ccc(-n2cccc2/C=N\NC(=O)c2cc3ccccc3o2)cc1	408942770	LEQHVNADXNKQNA-HMAPJEAMSA-N	359.385	3.996	50	40	FHGB	
CCCCCCCCCCCC[C@@H](Br)C(=O)NCC(N)=O	73372235	YLYYKUPMRFKGEZ-CQSZACIVSA-N	363.340	3.662	50	40	FHGB	
C/C=C1/C[N+]2(CCCC)CC[C@@]34C(=C(C=O)[C@H]1C[C@@H]32)Nc1c(O)cccc14	12654278	PMVPZDGAMARLPF-FCDGWIIWSA-O	365.497	3.878	50	40	FHGB	
Cc1cc(C)c2nc(NNC(=O)c3cc4ccccc4oc3=O)sc2c1	4121453	QMRGYBZNEAVOJL-UHFFFAOYSA-N	365.414	3.776	50	40	FHGB	
C[C@]12CCCC[C@@H]1[C@@H]2C(=O)N/N=C/c1ccc(-c2ccc(C(=O)O)cc2)o1	100175484	GMECDSONWHNXFI-DKQIIYKESA-N	366.417	3.921	50	40	FHGB	
O=C(N/N=C/c1cc(Cl)ccc1O)c1cccc(Br)c1	1507281	SBHZNTIRNQLVGK-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
CCOc1ccccc1C(=O)N/N=C/c1coc2ccc(Cl)cc2c1=O	15934206	MDULFVJPZRMUKX-UFFVCSGVSA-N	370.792	3.609	50	40	FHGB	
Cc1ccc(NC(=O)c2sc3nc(CCl)[nH]c(=O)c3c2C)c(C)c1	13637718	SVSVSNSBIGOVPL-UHFFFAOYSA-N	361.854	3.901	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2C)ccc1OC(C)=O	408754976	SWUXVRJYNCOHIO-GZTJUZNOSA-N	364.401	3.865	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc(C)n(-c3oc(C)c(C)c3C#N)c2C)o1	409373158	REAUASNAPUYZBO-LSHDLFTRSA-N	364.405	3.841	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(C[C@@H](C)CC2)[C@H]1c1ccccc1	35193554	AQSFJZCHQMDSTI-BANJIEJESA-N	361.445	3.710	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-]	255398358	QRFDQFGREXPQCT-WQLSENKSSA-N	357.753	3.802	50	40	FHGB	
Cc1cc(C)c(NC(=O)CN(C(=O)CCl)C2CCCCC2)c(C)c1	5534624	FVZVYGPEPJTIMX-UHFFFAOYSA-N	350.890	3.950	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(N)=O)ccc1OCc1c(F)cccc1Cl	33504488	FEYUWMQVMZHAQD-JYRVWZFOSA-N	374.799	3.849	50	40	FHGB	
C=CCc1ccccc1OCCOc1cccc(/C=N/NC(=O)OC)c1	30930099	YGHNYMWDMFUPCE-RCCKNPSSSA-N	354.406	3.563	50	40	FHGB	
CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccccc1	989333	LRTDOEHDELRTTC-FQEVSTJZSA-N	372.428	3.798	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1c(C)n(Cc2ccccc2)c2ccccc12	408805862	LWVPCGKHVGGFOY-XMHGGMMESA-N	373.456	3.668	50	40	FHGB	
CC(C)(C)c1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccnc4)c32)cc1	4163115	FCYOZHMHWVFJRT-QGZVFWFLSA-N	371.444	3.987	50	40	FHGB	
CCCOc1cccc(/C=N/NC(=O)COc2ccc3c(c2)CCCC3)c1	4544301	ZTBSJWYCHFSKGO-HZHRSRAPSA-N	366.461	3.883	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)Cc2ccc(CC)cc2)c(OCC)c1	409365741	WRZUOVCOSHTTNS-JCMHNJIXSA-N	354.450	3.739	50	40	FHGB	
CCOc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccccc4)c32)cc1	4993091	YWVUNQBNZYGISM-KRWDZBQOSA-N	358.401	3.694	50	40	FHGB	
CCOC(=O)COc1ccccc1/C=C(\C#N)c1ccc([N+](=O)[O-])cc1	1114914	QCQQDKAZRUPLOJ-LFIBNONCSA-N	352.346	3.601	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2ccc(Cl)cc2)c([N+](=O)[O-])c1	3959821	MFNLZQIFYPAJMH-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
O=C(CCNC(=O)c1cccs1)NN(c1ccccc1)c1ccccc1	32714798	UCOWKSCSSBTNDK-UHFFFAOYSA-N	365.458	3.738	50	40	FHGB	
CSc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc1	4735341	VLQMFJYQLPWTJD-WOJGMQOQSA-N	363.280	3.864	50	40	FHGB	
N#C/C(=C\c1cc([N+](=O)[O-])ccc1Cl)C(=O)N1CCc2ccccc21	41074219	IVNWQJBFQQQIIN-NTEUORMPSA-N	353.765	3.744	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2cccc(OCC)c2O)cc1	223165861	NGLYEBYPUYNLQG-QINSGFPZSA-N	352.390	3.735	50	40	FHGB	
Cc1ccc(S(=O)(=O)Oc2c(C=C(C#N)C#N)[nH]c3ccccc23)cc1	2074933	ZCTJCTPIYJKIGF-UHFFFAOYSA-N	363.398	3.675	50	40	FHGB	
O=C(N/N=C/c1cccc(OCc2ccccc2)c1)c1ccc2[nH]cnc2c1	13000452	MZXJNPLLWFTZFT-DHRITJCHSA-N	370.412	3.906	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1	408805415	JXNXMWJARHMNPN-GXDHUFHOSA-N	355.825	3.960	50	40	FHGB	
COc1cccc(/C=N/NC(N)=O)c1OCc1ccc(Cl)cc1Cl	408922087	DCHNUZKGSXPPEX-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2cc(OC)c(OC)cc2C)cc1	33792253	GVIBSJBHGUMHSO-WJDWOHSUSA-N	366.417	3.957	50	40	FHGB	
CC(C)Oc1ccc(C(=O)NNC(=O)[C@H](C)SCc2ccccc2)cc1	40142941	RVVNMWPTCHDITH-HNNXBMFYSA-N	372.490	3.557	50	40	FHGB	
O=C(CCc1ccc(O)cc1)N/N=C/C(Br)=C/c1ccccc1	2574901	SLHAGSHBWWCKSC-WGVPTNTPSA-N	373.250	3.863	50	40	FHGB	
CC(=O)Oc1ccc(/C=N/NC(=O)CSCc2cc(C)cc(C)c2)cc1	59473112	VKLLWPBGSBDGPU-SRZZPIQSSA-N	370.474	3.612	50	40	FHGB	
O=C(CCl)N1N=C(c2ccccc2)C[C@H]1c1ccc2nccnc2c1	58047322	NSNAJMIMUBGVNC-SFHVURJKSA-N	350.809	3.546	50	40	FHGB	
C/C(=N/NC(=O)CSc1nc2ccccc2s1)c1ccc(O)cc1	4646210	XFJQTEFOVOSETP-ODLFYWEKSA-N	357.460	3.634	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C/c2cc(Cl)c(O)c(OC)c2)c1	408741327	LFOWDPSHGPUUSB-NTUHNPAUSA-N	372.808	3.999	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cccc1[N+](=O)[O-]	5921558	GVMYZMLDVCBELN-QGMBQPNBSA-N	352.177	3.974	50	40	FHGB	
C/C(=N/NC(=O)CNc1ccccc1C)c1ccc(Br)s1	5390638	OEONFLKCEWEEQW-WQRHYEAKSA-N	366.284	3.771	50	40	FHGB	
CCOc1ccc([C@H](O)CCC(=O)N/N=C/c2ccccc2Cl)cc1	4535244	XJKMPANUSUHRAD-KOMLCTQHSA-N	360.841	3.703	50	40	FHGB	
CCOc1ccc(/C(C)=N\NC(=O)c2cc(-c3ccc(C)s3)n[nH]2)cc1	17307280	DTDPRZIEDKSDBW-MOSHPQCFSA-N	368.462	3.999	50	40	FHGB	
O=C(CCCSc1ccc(Cl)cc1)NNC(=O)c1ccccc1F	2644740	FOQAHODUOWVTLM-UHFFFAOYSA-N	366.845	3.813	50	40	FHGB	
CCCC[C@H](Br)C(=O)Nc1c(C(=O)OC)[nH]c2ccccc12	5093469	KJXIZLNHSMXDKN-NSHDSACASA-N	367.243	3.847	50	40	FHGB	
CC1=NN(c2ccccc2)C(=O)[C@H]1/C=N/NC(=O)c1ccc2ccccc2c1	408739852	GDZOCUWOPDVXDK-BTVXTAIASA-N	370.412	3.594	50	40	FHGB	
Cc1cc(Br)cc(/C=N\NC(=O)c2ccccc2Cl)c1O	4599291	NCNLHANUXDTAIQ-LSCVHKIXSA-N	367.630	3.880	50	40	FHGB	
CCc1ccc(-c2nc(C(=O)NNC(=O)c3cc(C)oc3C)cs2)cc1	16109996	FQDGPIQZLZQHRW-UHFFFAOYSA-N	369.446	3.657	50	40	FHGB	
COc1ccc([C@H]2CC(=O)N3CN(CCC(C)C)CSC3=C2C#N)cc1	20348005	HHAFSVPXVNFCTE-QGZVFWFLSA-N	371.506	3.756	50	40	FHGB	
Cc1ccc(C)c(NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C)c1	8733141	OCNOCGFBHQLWIP-HNNXBMFYSA-N	369.303	3.558	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)c(C(=O)OC)c2)o1	834281	JIYHSPDOSJBSPR-XYOKQWHBSA-N	359.765	3.857	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2cc(C)ccc2OC)ccc1O	408806539	JOYJWOFIXXURKJ-XNTDXEJSSA-N	352.390	3.654	50	40	FHGB	
Cc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc(C(F)(F)F)cn2)cc1	6275358	YJRIOUIQIZTWCI-UVTDQMKNSA-N	367.352	3.660	50	40	FHGB	
O=C(COc1ccccc1)N/N=C\C(Br)=C\c1ccccc1	4724611	HZFHLNYEMSADQM-HZCNULMQSA-N	359.223	3.603	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cccc(C)c1)OCO2	409108863	WQICSFKEGZEDCN-OVCLIPMQSA-N	350.374	3.668	50	40	FHGB	
CCn1c(C)cc(C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1C	95946678	XLTXIPIGAVNIQC-UHFFFAOYSA-N	359.495	3.530	50	40	FHGB	
O=C(Cl)[C@H]1CC(=O)N(c2cc(C(F)(F)F)ccc2N2CCCCC2)C1	45888125	IODPMIKMSVHQBE-NSHDSACASA-N	374.790	3.814	50	40	FHGB	
N#C/C(=C\c1cccc(Br)c1)C(=O)NCCc1ccccc1	7158675	YATXRVONOBXKCA-LFIBNONCSA-N	355.235	3.715	50	40	FHGB	
O=C(N/N=C/c1ccccc1Cl)C(=O)Nc1cc(Cl)cc(Cl)c1	6863674	LXRQOJXELCYFCL-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
Cc1ccc(NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C)cc1C	8733232	MIOBJDJRWURXNN-HNNXBMFYSA-N	369.303	3.558	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)N1CCCCC1	858286	CETDLJFZMGMQLP-NTCAYCPXSA-N	351.362	3.774	50	40	FHGB	
CCOc1cc(/C=C(\C#N)c2ccc([N+](=O)[O-])cc2)cc([N+](=O)[O-])c1O	59465458	UHWWZXSQAUNFIH-NTUHNPAUSA-N	355.306	3.671	50	40	FHGB	
C=CCOc1cccc(/C=N\NC(=O)c2ccc(OCC=C)c(OC)c2)c1	409320682	CIKIBUDYEGWSJQ-JCMHNJIXSA-N	366.417	3.589	50	40	FHGB	
C/C(=N\NC(=O)CCC(=O)Nc1cccc(Cl)c1C)c1cccs1	4523853	ATQMVMZNXWMRIU-UDWIEESQSA-N	363.870	3.969	50	40	FHGB	
C[C@@H](Sc1nc2ccccc2s1)C(=O)N/N=C/c1ccccc1O	5528739	FKFIYDPABLHZPY-VDCVXVNISA-N	357.460	3.633	50	40	FHGB	
O=C(CN1CCCc2ccccc21)N/N=C/c1ccccc1C(F)(F)F	8124762	XIHMEIDMOATHQW-FSJBWODESA-N	361.367	3.608	50	40	FHGB	
O=C(CBr)Nc1ccc(NC(=O)CCc2ccccc2)cc1	35605363	UQTWUVUGDDEVPJ-UHFFFAOYSA-N	361.239	3.591	50	40	FHGB	
C=CCOc1ccccc1/C=N\NC(=O)c1ccc(OCC=C)c(OC)c1	8113409	ZJAPHJFEQXJPQL-JCMHNJIXSA-N	366.417	3.589	50	40	FHGB	
C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1ccc(C(C)(C)C)cc1	5288843	BKICEGYVFYSNHX-VZMFNRANSA-N	352.434	3.664	50	40	FHGB	
COc1cc(/C=C/C(=O)NN)cc(Cl)c1OCc1ccc(Cl)cc1	226336217	AIYLJIBQOWHHDE-QPJJXVBHSA-N	367.232	3.584	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2ccccc2OCc2ccccc2)cc1	672306	FOYSTMHETJFGHU-LFVJCYFKSA-N	374.440	3.967	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c(C)n1-c1ccccc1	408599356	SYYDFCSBQKAFDX-FYJGNVAPSA-N	362.389	3.766	50	40	FHGB	
CCCNC(=O)/C(C#N)=C/c1ccc(OC(C)C)c(Br)c1	4592274	YJWUCOFNMNOKPO-MDWZMJQESA-N	351.244	3.669	50	40	FHGB	
Cc1cc(C)c(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)c(C)c1	408774989	DXZGTVAGIKHPAP-HKWRFOASSA-N	359.473	3.868	50	40	FHGB	
COC(=O)c1cc(/C=C(/C#N)c2nc(O)c3ccc(Cl)cc3n2)oc1C	40083252	JVXKINHEJIRNHB-YHYXMXQVSA-N	369.764	3.741	50	40	FHGB	
O=C(N/N=C/c1cccs1)C1CCN(Cc2ccc(Cl)cc2)CC1	5635995	DSIHKGXTMABSBS-UDWIEESQSA-N	361.898	3.764	50	40	FHGB	
CC(C)(C)S(=O)(=O)/C(C#N)=C\Nc1ccc(F)c(C(F)(F)F)c1	2561580	ZYRYMNDRMZCIGE-NTMALXAHSA-N	350.337	3.835	50	40	FHGB	
O=C(CNc1cccc2ccccc12)N/N=C/c1ccc(Br)o1	1445154	GRMWDKBWIVTHIP-KEBDBYFISA-N	372.222	3.758	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)c(C)n1-c1cccnc1	9010569	JSEMWXZSIIQJGW-NDENLUEZSA-N	356.429	3.713	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=N/NC(=O)c3ccccc3F)c2c1	409012113	JCRJCRWNVJYNNG-WSDLNYQXSA-N	352.365	3.760	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1-c1ccccc1	8103722	ZIOQVDUPQUCZLY-WSDLNYQXSA-N	361.401	3.587	50	40	FHGB	
O=C(OCCCCCl)/C(Cl)=C(/Cl)C(=O)OCCCCCl	5368846	SLWNXFLZTPOGHE-KTKRTIGZSA-N	366.068	3.800	50	40	FHGB	
CCN1c2ccc(/C=C(/C#N)C(=O)N3CCOCC3)cc2[C@H](C)CC1(C)C	208312920	KEUNIYFLKZHVNO-UWCCDQBKSA-N	367.493	3.564	50	40	FHGB	
COc1ccc(-c2csc(N(C[C@H]3CCCO3)C(=O)CCl)n2)cc1	929119	IMGYNBGPCLQSQF-CQSZACIVSA-N	366.870	3.570	50	40	FHGB	
COc1ccc(C(=O)NNC(=O)[C@@H](c2ccc(Cl)cc2)C(C)C)cc1	14244751	JZMMVJSRLICZSN-QGZVFWFLSA-N	360.841	3.549	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N/NC(=O)CC1(C)SCCS1	7003894	SBKVHKRDTHMLGG-LICLKQGHSA-N	358.916	3.775	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2ccc(OC)cc2)cc(Cl)c1OC	8228723	CTNSODJCDAQDCW-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
C/C(CC(=O)Nc1cccc(Cl)c1C)=N\NC(=O)c1ccc(F)cc1	4405483	FOIZSAFGELFCQN-SSDVNMTOSA-N	361.804	3.922	50	40	FHGB	
Cc1ccc(C(C)C)c(OCCOc2ccccc2/C=N/NC(N)=O)c1	4510984	SWGBSDLDESDWHI-LPYMAVHISA-N	355.438	3.578	50	40	FHGB	
C/C(=N\NC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1ccc[nH]1	19320722	QQKLXPWXZSTSFS-AFUMVMLFSA-N	355.401	3.779	50	40	FHGB	
CNC(=O)/C(C#N)=C\c1cccc(OC)c1OCc1ccc(Cl)cc1	409076600	AZDQRDXUUVULIQ-GDNBJRDFSA-N	356.809	3.581	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1cc2c(cc1C)OCO2	408799949	LXIYYAXNMOSFCO-AWNIVKPZSA-N	370.792	3.931	50	40	FHGB	
CC(C)(CC(=O)O)CC(=O)NNc1c(Cl)cc(Cl)cc1Cl	12787903	DRNSLXXAKLRBRK-UHFFFAOYSA-N	353.633	3.981	50	40	FHGB	
C/C(=N\NC(=O)c1cccc(F)c1)c1ccc(NC(=O)c2ccco2)cc1	5381941	KAFZUXXGBPFNEN-YDZHTSKRSA-N	365.364	3.825	50	40	FHGB	
CCCc1[nH]nc2c1[C@H](c1cccc(OC3CCCC3)c1)C(C#N)=C(N)O2	8382683	GSPKOJSKHSKDPM-GOSISDBHSA-N	364.449	3.902	50	40	FHGB	
CC(C)(C)OC(=O)N/N=C\c1cccc(OC(=O)/C=C\c2ccco2)c1	85884005	GWYPAWZQJIFVDB-VRKJTAHCSA-N	356.378	3.757	50	40	FHGB	
CCOc1ccc(OCC)c(N/C=C(\C#N)C(=O)Nc2ccccc2)c1	57413930	NACIQQPETMWBBR-CCEZHUSRSA-N	351.406	3.942	50	40	FHGB	
C[C@]12CC[C@H]3[C@@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@H]1CC[C@]2(O)C#N	70673127	VRSHJJXUDZAQKD-BCRJPVCJSA-N	357.494	3.947	50	40	FHGB	biogenic
C=CCOc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc1OC	6900934	NSNTTZOJRZGMTM-CEWLDGSWSA-N	354.450	3.862	50	40	FHGB	
C/C(CC(=O)Nc1ccccc1C#N)=N\NC(=O)c1cccc2ccccc12	100923160	YGLCMRBCTACMHQ-MFKUBSTISA-N	370.412	3.846	50	40	FHGB	
COc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1Cc1ccccc1Cl	408866184	GDFWNFDRPVAWPG-AWNIVKPZSA-N	361.228	3.985	50	40	FHGB	
O=C(Cc1cccs1)N/N=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1	71335789	HILICLMOTGPNTE-WQRHYEAKSA-N	355.375	3.609	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)c1O	409111121	AYLKBMYAVDHXRP-PVGUKEHMSA-N	358.463	3.730	50	40	FHGB	
N#Cc1ccc2nc([C@@](O)(CCl)c3ccc(F)cc3F)sc2c1	39052325	RAYJROQQSNQGCU-MRXNPFEDSA-N	350.777	3.921	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(-c3ccc(C#N)cc3)o2)cc1C	409021909	FJTZWJYXKXORGP-DHRITJCHSA-N	372.428	3.997	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cccc(C)c1C)OCO2	409101623	WOTLHNCUAAWUEI-VIZOYTHASA-N	350.374	3.586	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2cccc(Br)c2)o1)c1ccncc1	15008929	IOXDPFWZJQHTGF-JAIQZWGSSA-N	370.206	3.868	50	40	FHGB	
COc1ccc(Br)cc1/C=N/NC(=O)c1cccc(Cl)c1	5514062	MQLDHTDCGRXATG-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
O=C(NN=C1CCCCC1)C(=O)Nc1ccc(Oc2ccccc2)cc1	58885780	FBPWHEVNWPRXEK-UHFFFAOYSA-N	351.406	3.854	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(NC(=O)CC(C)C)cc2)cc1C	12137218	JRYKBPJWBRJNLN-LPYMAVHISA-N	367.449	3.752	50	40	FHGB	
CCN1c2ccc(/C=N/NC(=O)c3ccncc3)cc2[C@H](C)CC1(C)C	208302453	NGXOATLAOYVIHD-QKIXXSFTSA-N	350.466	3.958	50	40	FHGB	
Cc1cc(C)c(C#N)c(SC[C@@H](Br)CBr)n1	4188625	IMMNMLZEVOZHOV-VIFPVBQESA-N	364.106	3.821	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(C)c(Br)c2)cc1	408526887	DJGIOSYFIWBGCF-KEBDBYFISA-N	360.255	3.628	50	40	FHGB	
C/C(=N\NC(=O)CC1(C)SCCS1)c1ccc(Br)cc1	38534976	RRIMYTMEWXKJEG-MHWRWJLKSA-N	373.341	3.876	50	40	FHGB	
O=C(NNC(=O)[C@@H]1CC1(c1ccccc1)c1ccccc1)C1[C@H]2CCCC[C@@H]12	18158557	AZKGMFBPXAUNBU-HWPVKAJDSA-N	374.484	3.576	50	40	FHGB	
Cc1ccccc1-c1nc2cc(N3C[C@@H](C(=O)Cl)CC3=O)ccc2o1	57327043	WRKKNTSMDCRNQX-LBPRGKRZSA-N	354.793	3.922	50	40	FHGB	
CO[C@H](C(=O)N/N=C/c1cc(C)n(-c2ccccc2)c1C)c1ccccc1	58927110	QGGUKDADWWAMLH-VQYZLWMVSA-N	361.445	3.932	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OCCC(C)C	2289498	BOFWCBMQUVPMOY-GZTJUZNOSA-N	368.433	3.936	50	40	FHGB	
O=C(Oc1ccc(/C=N/NC(=O)c2ccccc2F)cc1)c1ccccc1	5772878	KLOUIKVKDSAZNM-OEAKJJBVSA-N	362.360	3.809	50	40	FHGB	
CC(=O)Oc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)cc1	409118111	NCYSOYPDVGPNGA-PVGUKEHMSA-N	356.447	3.551	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2cc(C)ccc2OC)ccc1OC	408807144	OIPACZQZHKUGGD-LFIBNONCSA-N	366.417	3.957	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=N/NC(=O)c3ccc(F)cc3)c2c1	409011955	IDOLBPVTGKEQED-WSDLNYQXSA-N	352.365	3.760	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@@H](c1c(F)cccc1F)C(C#N)=C(N)O2	659943	ZCYOFWNOLTXMBC-KRWDZBQOSA-N	364.355	3.677	50	40	FHGB	
CC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cccc(OCc2ccccc2)c1	705903	YLSJYUYCBKQQOK-NRFANRHFSA-N	360.413	3.936	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(C(=O)O)c1	408544447	WCBSWZLEWWKACL-ATVHPVEESA-N	361.401	3.531	50	40	FHGB	
Cc1ccsc1C(=O)NNC(=O)c1ccc(COc2ccccc2)cc1	6602516	OPIKCQJRQRRESQ-UHFFFAOYSA-N	366.442	3.710	50	40	FHGB	
Cc1cc(Br)cc(Br)c1OCC(=O)N=C=S	70461492	WHTXCPYPHOFHNC-UHFFFAOYSA-N	365.046	3.528	50	40	FHGB	
O=C(N/N=C\c1ccc([N+](=O)[O-])cc1)C1c2ccccc2Oc2ccccc21	30802676	LWPBKFLBLCBLGP-XKZIYDEJSA-N	373.368	3.983	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Cl)ccc1Cl)c1ccc2c(c1)CC(=O)N2	98054887	HBSFPAUXFCKJRL-ZVBGSRNCSA-N	362.216	3.642	50	40	FHGB	
Cc1ccc(COc2ccc(/C=N/NC(=O)c3ccccc3N)cc2)cc1	5363070	QDCKJCHQWYIZNP-ZVHZXABRSA-N	359.429	3.920	50	40	FHGB	
Cc1cc(C)cc(NC(=O)/C(C#N)=C2/SCC(=O)N2c2ccccc2)c1	4539877	QBNYZPKDGZSZJQ-LVZFUZTISA-N	363.442	3.757	50	40	FHGB	
Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)Cc1ccccc1	1301833	IXUGKPXUWWYEHI-FYJGNVAPSA-N	352.825	3.527	50	40	FHGB	
COc1cc(/C=N/NC(=O)[C@H](C)c2ccc(CC(C)C)cc2)ccc1O	1106699	QZKWHVKONPVSPE-IKMPRTQCSA-N	354.450	3.853	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1Cl	408967512	QPGVGMWHNRVLHF-LSHDLFTRSA-N	359.788	3.902	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccn2)c(C)n1CC(C)C	98053388	JKCYFLJAUWEPED-YDDPGSGASA-N	350.466	3.940	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)c(OC)c1	409110413	VXGQDHZYWMRQJP-MQMKENTISA-N	358.463	3.643	50	40	FHGB	
CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NC(C)C)c2C)cc1	211615977	GSABVWFPQJSVOH-PDGQHHTCSA-N	351.450	3.924	50	40	FHGB	
C=CCOc1c(Br)cc(/C=N/NC(=O)CC(C)C)cc1OC	6325221	LHDIIDJLMILSNL-VCHYOVAHSA-N	369.259	3.519	50	40	FHGB	
CC(=O)N/N=C/c1cccc(OCCOc2ccc(C(C)(C)C)cc2)c1	4510975	HHUNCIJEAIUAQQ-PXLXIMEGSA-N	354.450	3.912	50	40	FHGB	
O=C(CBr)Nc1cccc(NC(=O)c2cccc(Cl)c2)c1	4506996	QPQLTZCTKOJHBG-UHFFFAOYSA-N	367.630	3.926	50	40	FHGB	
N#C/C(=C/c1c[nH]nc1-c1ccc(Cl)cc1)C(=O)NCc1ccco1	4631363	FNAUZEJEZMFIPH-JYRVWZFOSA-N	352.781	3.546	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CCSc2ccc(C)cc2)cc1[N+](=O)[O-]	409120102	RPTNXFROYBYNBW-XDHOZWIPSA-N	373.434	3.544	50	40	FHGB	
C#CCn1c(C)c(/C=N/NC(=O)Cc2cc(C)ccc2C)c2ccccc21	409366042	SKIISRPQWBLKPQ-BUVRLJJBSA-N	357.457	3.893	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C/c2ccc(Br)s2)cc1	3174924	LITOFOYHGVQEPC-LICLKQGHSA-N	365.252	3.839	50	40	FHGB	
Cc1cccc(C(=O)N/N=C/c2ccc(OC(=O)c3ccccc3)cc2)c1	1052465	GFEGZJJXHDFHRR-HZHRSRAPSA-N	358.397	3.978	50	40	FHGB	
C[C@H](Sc1ccccn1)C(=O)N/N=C/c1c(O)ccc2ccccc12	1099834	DZWDGOXPFSIQSY-XMOVILSBSA-N	351.431	3.571	50	40	FHGB	
C=CCc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)cc(OCC)c1O	59250333	WJDJQBKJNCTJRM-CIAFOILYSA-N	358.825	3.937	50	40	FHGB	
CCNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc(OC)cc1	26967664	IPUBLDYJZMOJEK-GHRIWEEISA-N	372.428	3.591	50	40	FHGB	
O=C(Cc1ccc([N+](=O)[O-])cc1)NN=C1CCC(c2ccccc2)CC1	4144862	QNOQTZPSBRZDPC-UHFFFAOYSA-N	351.406	3.967	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)CSCc2ccccc2C)cc1	408875150	DLRXAYYZIBFZAU-PXLXIMEGSA-N	369.490	3.727	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)[C@@H](C)Sc2ccccc2)c1	831072	DCQIEHDFFRRMCT-CNRHGSOZSA-N	355.463	3.666	50	40	FHGB	
CN1CN(c2ccccc2)C2(CCN(CCCCCCCl)CC2)C1=O	1664548	KWUJSNJMNVIUCQ-UHFFFAOYSA-N	363.933	3.556	50	40	FHGB	
Cc1ccc([C@@H](Br)[C@@H](Br)C(=O)[C@@]2(C)CO2)cc1	2352950	PQHOXCGXAACSQA-NQBHXWOUSA-N	362.061	3.553	50	40	FHGB	
N#C/C(=C\c1ccc(-c2nc3ccccc3s2)o1)C(=O)N=c1cc[nH]cc1	95452283	OZAYFVHLULAEIY-ACCUITESSA-N	372.409	3.919	50	40	FHGB	
CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(Cl)ccc2O)cc1	408897326	RMOOKHSOONGFEZ-NTEUORMPSA-N	370.792	3.768	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N\NC(=O)c3ccccc3N)o2)c([N+](=O)[O-])c1	32116938	JPXKHINZXIOVMW-NHDPSOOVSA-N	364.361	3.509	50	40	FHGB	
CCCOc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1Br	409367740	KCIGLMQIGFSSNJ-GXDHUFHOSA-N	363.255	3.767	50	40	FHGB	
CC(C)N(C[C@H]1CCCCN1C(=O)CCl)C(=O)OCc1ccccc1	79412039	LQDYAEDKPVRVJR-QGZVFWFLSA-N	366.889	3.654	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@H]2C[C@H]3C[C@@H](CBr)[C@H]2C3)cc1	256575751	SSOHWXRVPHYKLJ-VIRABCJISA-N	359.285	3.510	50	40	FHGB	
CCOc1cc(C=C(C#N)C#N)cc(I)c1OCC	2770701	FLIFIXRAGFZKPY-UHFFFAOYSA-N	368.174	3.519	50	40	FHGB	
COc1ccc(C(=O)NNc2ccnc3cc(Cl)ccc23)cc1OC	9118018	SMRVCNLFZKZILG-UHFFFAOYSA-N	357.797	3.662	50	40	FHGB	
CCOC(=O)c1sc(CC(=O)/C(C#N)=C/c2cccs2)c(C#N)c1C	408547477	XKWADOXHEOMBEC-KPKJPENVSA-N	370.455	3.885	50	40	FHGB	
O=C(CCn1c2c(c3ccccc31)CCCC2)NN=Cc1ccc(O)cc1	28466861	INZUMENFTOXRJQ-UHFFFAOYSA-N	361.445	3.766	50	40	FHGB	
O=C(CCCCl)Nc1nnc(-c2ccc(Br)cc2)s1	4072418	HANWUAHWCLONNX-UHFFFAOYSA-N	360.664	3.925	50	40	FHGB	
O=C(N/N=C/c1ccccc1Cl)C(O)(c1ccccc1)c1ccccc1	1083240	IQXHJQNJEJGIIO-HZHRSRAPSA-N	364.832	3.726	50	40	FHGB	
O=N[C@H]1[C@@H]2C[C@@H]([C@H]1Cl)[C@H]1C[C@H](Br)[C@H](Br)[C@H]21	100498134	RTOAGUKGFNBCKI-CJBKRGIUSA-N	357.473	3.542	50	40	FHGB	
O=C(Cc1cccc2ccccc12)NNC(=O)c1cc(Cl)ccc1F	8728816	JVHLNDICJFZIQO-UHFFFAOYSA-N	356.784	3.636	50	40	FHGB	
Cc1ccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1[N+](=O)[O-]	408950983	KPJMPYBZMGDIQY-YVLHZVERSA-N	374.400	3.650	50	40	FHGB	
COc1cc(/C=C(/C#N)c2ccc(C(=O)O)cc2)c(Br)cc1O	408542052	JQYOXZQSSISVOM-MLPAPPSSSA-N	374.190	3.926	50	40	FHGB	
Cc1ccc(N2Cc3ccc(C(=O)N/N=C\c4ccc(O)cc4)cc3C2)cc1	83318416	KXSAQXKGQALHAX-CFRMEGHHSA-N	371.440	3.985	50	40	FHGB	
O=C(Cc1cn2ccsc2n1)NN=C(c1ccccc1)c1ccccc1	10054401	ONXOFJWFNKDPPA-UHFFFAOYSA-N	360.442	3.507	50	40	FHGB	
COc1ccccc1NC(=O)/C(C#N)=C\c1ccc(OC(F)F)c(OC)c1	6679720	QMQHHFIFWMCGQR-LCYFTJDESA-N	374.343	3.851	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@@H](C)Nc2ccc(Cl)c(Cl)c2)cc1	850507	KFJXNECKGVLKQE-JZOCJUILSA-N	366.248	3.953	50	40	FHGB	
O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(Cl)c(Cl)c1	34737904	HLCJVIOKJBJPQL-NVMNQCDNSA-N	352.177	3.594	50	40	FHGB	
COc1cc(/C=C/C(=O)NN)ccc1OCc1ccc(Cl)c(Cl)c1	226336555	WWDDRYSYPKJCFI-QPJJXVBHSA-N	367.232	3.584	50	40	FHGB	
COc1cccc(CC(=O)N/N=C\c2cccn2-c2ccc(Cl)cc2)c1	408857285	NMHGPFLOYJBKST-HMAPJEAMSA-N	367.836	3.832	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2ccc(-c3ccccc3C#N)o2)cc1	20764021	DSUKTXFBWKGARE-OEAKJJBVSA-N	359.385	3.981	50	40	FHGB	
COc1ccc(-n2c(C)cc(/C=N/NC(=O)Cc3cccs3)c2C)cc1	409193877	GTINOKQLRCNILW-FYJGNVAPSA-N	367.474	3.857	50	40	FHGB	
COc1cc(Cl)c(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc1OC	408798929	JIKCKFMQGUVFTF-XVDJGBJWSA-N	362.857	3.959	50	40	FHGB	
Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)c1ccccc1F	1084763	VSMQSUVRUZWDCC-SRZZPIQSSA-N	356.788	3.737	50	40	FHGB	
COc1cc(OC)c(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)c(OC)c1	15012574	GOBNWZZHZQJZBQ-ZROIWOOFSA-N	352.390	3.567	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(C[C@@H](C)CC2)[C@@H]1c1ccccc1	35193558	AQSFJZCHQMDSTI-DVXDUOKCSA-N	361.445	3.710	50	40	FHGB	
C/C(=N\NC(=O)Cc1nc(C)cs1)c1sc(C(C)(C)C)nc1C	41700311	VHRRNOBJZJWSTH-YBFXNURJSA-N	350.513	3.597	50	40	FHGB	
CC(C)C1=CC(=O)[C@](C)(Cl)[C@@H](Cl)/C1=N/S(=O)(=O)c1ccccc1	105600296	DWZUIUHHYJXENG-NTSOGCMCSA-N	374.289	3.586	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2ccc(OCC)c([N+](=O)[O-])c2)cc1	20198211	CDFCITXRJUERPG-DEDYPNTBSA-N	371.393	3.546	50	40	FHGB	
COc1ccccc1OCC(=O)N/N=C(\C)CC(C)(C)c1ccccc1	408861622	TXHWASBIXIGJMS-CJLVFECKSA-N	354.450	3.934	50	40	FHGB	
COC(=O)c1sccc1NC(=O)/C(C#N)=C/c1ccc2[nH]ccc2c1	49549374	RRFGTNGMNPWASE-UKTHLTGXSA-N	351.387	3.562	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2ccc(C(C)C)cc2)c([N+](=O)[O-])c1	13847811	JJGPUEVVDJKJEN-RGVLZGJSSA-N	355.394	3.556	50	40	FHGB	
CCN1C(=O)C(C#N)=C(C)/C(=C\Nc2cccc(Cl)c2Cl)C1=O	9341789	XBUPAUVDEIZWGF-DHZHZOJOSA-N	350.205	3.518	50	40	FHGB	
C#CCn1cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)c2ccccc21	409245132	NWRSRBIYXQFGFO-SILNSSARSA-N	367.452	3.930	50	40	FHGB	
C[C@H](CNC(=O)c1ccccc1)[C@@](C)(Br)CBr	3124304	IGCDMOGIHHXANY-MFKMUULPSA-N	363.093	3.601	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)cc1	5513668	QBIPBUFRCHJWSW-LFVJCYFKSA-N	374.440	3.967	50	40	FHGB	
O=P(C(=S)N[C@H]1C[C@H]2C=C[C@@H]1C2)(c1ccccc1)c1ccccc1	2577602	FGUUHJBPQVYOOT-FCEWJHQRSA-N	353.427	3.840	50	40	FHGB	
CC(C)(C)OC(=O)CCOCCOCCSSc1ccccn1	888086788	NFTUEHOZCVWJPT-UHFFFAOYSA-N	359.513	3.587	50	40	FHGB	
COc1ccc(N2C(S)=C(C#N)C(=O)N[C@H]2c2ccc(Cl)cc2)cc1	818299	XOWDKKMTFGZWTP-MRXNPFEDSA-N	371.849	3.649	50	40	FHGB	
O=C(NNc1nc(-c2ccc(Br)cc2)cs1)c1ccco1	708622	MAPXRAPQHDKUQF-UHFFFAOYSA-N	364.224	3.923	50	40	FHGB	
Cc1ccc(Cl)cc1NC(=O)CCC(=O)N/N=C/c1ccc(F)cc1	3101351	HTXQUBLHIHMGHN-SRZZPIQSSA-N	361.804	3.657	50	40	FHGB	
CC/C(=N\NC(=O)CNc1cccc(Br)c1)c1ccccc1	6646099	AEZGULTYEYMQRO-CAPFRKAQSA-N	360.255	3.792	50	40	FHGB	
CCn1cc(/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)c2ccccc21	6948094	HXDKXXJKQDGFKR-KGENOOAVSA-N	364.405	3.652	50	40	FHGB	
Cc1cc(OCc2ccc(C(=O)N/N=C/[C@H]3CCOC3)cc2)ccc1Cl	84090165	SMYYNZZWRWMKOK-CNPYVQQSSA-N	372.852	3.980	50	40	FHGB	
COc1cccc(/C=C(\C#N)C(=O)Nc2ccc(Br)cc2)c1O	408744868	NUAPRPYTTLMQIB-FMIVXFBMSA-N	373.206	3.709	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2cccc(O)c2)c(C)n1-c1ccc(F)cc1	408784153	SUBGQKDVNIQLDP-UUYOSTAYSA-N	351.381	3.703	50	40	FHGB	
CCc1[nH]nc2c1[C@H](c1ccc(OC3CCCC3)cc1)C(C#N)=C(N)O2	4631723	FDMVLNZTQIIFJS-QGZVFWFLSA-N	350.422	3.512	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@@H]2[C@@H](C=C(Cl)Cl)C2(C)C)ccc1O	4811694	HXJAIYPOVGPKRG-YPSCNYPQSA-N	371.264	3.832	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(Br)cc2)c(C)n1C	2736072	XETXZNNFUHQPIS-NTEUORMPSA-N	358.239	3.950	50	40	FHGB	
COc1cc(/C(C)=N\NC(=O)c2cccc(Cl)c2)cc(OC)c1OC	59488946	DIFTVOKUKHAIKH-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
Cc1cccc(C)c1OCC(=O)NNC(=O)Nc1cccc2ccccc12	11007267	IWGLTBSGYQQJAW-UHFFFAOYSA-N	363.417	3.688	50	40	FHGB	
COc1ccc(Cl)c(C(=O)[C@H](Br)CBr)c1	308811860	RTHLLWWBDMGKOP-MRVPVSSYSA-N	356.441	3.690	50	40	FHGB	
C/C(=N\NC(=O)CCc1ccccc1)c1ccc(Br)s1	5381510	MMVPCEVIHRIBCI-GZTJUZNOSA-N	351.269	3.984	50	40	FHGB	
CCCCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)NC)o2)cc1	409067498	YJUWMRJTKZVISS-FOWTUZBSSA-N	352.390	3.556	50	40	FHGB	
CCN(CC)c1ccc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)c(O)c1	34857663	DEARGDAGBUNNSE-VBKFSLOCSA-N	365.433	3.793	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)cc1Cl	33794140	KTNJLIUSTQSGQT-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
C/C(=N\NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1cccnc1	9218332	ZHTZQFRSMNVRBS-OEAKJJBVSA-N	350.397	3.782	50	40	FHGB	
COc1cc(OC)cc(C(=O)NNc2nc3c(C)c(C)ccc3s2)c1	4121423	HCRFDKGRNHDREP-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
COc1c(Cl)cc(Cl)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2	856159	GYQGFYWVCGNFOK-CQSZACIVSA-N	365.216	3.817	50	40	FHGB	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1/C=N/NC(=O)c1ccccc1	2654564	YJHPCZSLPBAWCS-SSDVNMTOSA-N	370.815	3.796	50	40	FHGB	
N#CC1=C(N)Oc2oc3cc(Cl)ccc3c(=O)c2[C@H]1c1ccccc1	1070244	ZIVLQBGWHQHVTC-HNNXBMFYSA-N	350.761	3.665	50	40	FHGB	biogenic,in-vitro
Cc1ccc(OCC(=O)N/N=C/c2ccc(Br)cc2)cc1C	1435361	DJCDVFVQIVPRQL-VXLYETTFSA-N	361.239	3.595	50	40	FHGB	
Cc1ccc([C@H](NC(=O)N2C[C@H](C)O[C@@H](C)C2)C(Cl)Cl)cc1F	103242638	HVZZCOGLJCDBBM-MJVIPROJSA-N	363.260	3.798	50	40	FHGB	
COc1cccc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)c1OC	409136882	YUIWQPGVXHLORQ-MQMKENTISA-N	358.463	3.643	50	40	FHGB	
O=C(N/N=C\c1cn(Cc2ccccc2)c2ccccc12)c1cccnc1	33362454	RRQGXKZWPMEIHE-OYKKKHCWSA-N	354.413	3.849	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2cccc3ccccc23)cc(OC)c1OC	5175909	GXLOWFUXFPZTJW-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)s1	17395984	BJHUMLOJAZLFQZ-UHFFFAOYSA-N	366.870	3.639	50	40	FHGB	
C[C@@H]1CC(C)(C)N(C)c2ccc(/C=N\NC(=O)c3ccccc3O)cc21	208201910	YYUSXMIUGKSDNY-BXSODOALSA-N	351.450	3.878	50	40	FHGB	
COc1cc(C(=O)Oc2ccc([N+](=O)[O-])cc2F)ccc1OC(F)F	102785216	GVCRAJCYLAFREL-UHFFFAOYSA-N	357.240	3.563	50	40	FHGB	
CCN(CC)c1ccc(C=NNC(=O)[C@@H](C)Oc2ccc(C)cc2)cc1	23397221	SEVMINYPAMYNSN-QGZVFWFLSA-N	353.466	3.759	50	40	FHGB	
O=C(N/N=C\c1ccc([N+](=O)[O-])cc1)C(c1ccccc1)c1ccccc1	33335673	SOIFAJIJSUMQCP-JCMHNJIXSA-N	359.385	3.877	50	40	FHGB	
C/C(=N\NC(=O)[C@H]1Oc2ccccc2O[C@@H]1c1ccccc1)c1ccncc1	33533987	GXMPUDGJNOMCAZ-WGROYBIQSA-N	373.412	3.503	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(Br)cc2)cc1	193793964	TVRFNHOWILTEMF-GDNBJRDFSA-N	371.234	3.681	50	40	FHGB	
CCCOc1ccccc1/C=N\NC(=O)COc1ccc(CCC)cc1	18996746	HPSDDFHMQKDJQK-JCMHNJIXSA-N	354.450	3.957	50	40	FHGB	
O=C(CNc1cccc(Br)c1)N/N=C/c1cccc(Cl)c1	2744420	YKOVNHKBJBLVFY-DJKKODMXSA-N	366.646	3.665	50	40	FHGB	
COc1ccccc1NC(=O)N/N=C\c1ccc(N2CCCC2)cc1C	408960825	OKVFGLGGOBKMMC-STZFKDTASA-N	352.438	3.759	50	40	FHGB	
COc1cc(/C=C(\C#N)c2nnc3n2CCCCC3)cc(Cl)c1OC	7159068	DHPMJMWCNCDPBK-MDWZMJQESA-N	358.829	3.739	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)n2nc(C)cc2C)c(OC)c1	408978919	ORFRVZTZNQJYMI-GZTJUZNOSA-N	352.438	3.602	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c(C)n1C(C)C	408540577	ADDADCUHXXREQC-MFOYZWKCSA-N	351.406	3.930	50	40	FHGB	
CN(CCC#N)c1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1	5737926	YZVICBVOAORCDK-BUVRLJJBSA-N	372.428	3.659	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C\c2ccccc2OC)cc1OCC	6324648	VPMDUCGKSYSZPQ-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
CCOc1ccc(O)c(/C=N/NC(=O)CNc2ccc3ccccc3c2)c1	1435095	ISJBWAJSKFPBDK-YDZHTSKRSA-N	363.417	3.506	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccccc2Cl)o1)[C@H](O)c1ccccc1	1248508	KBIJEORWNUZLRL-AGKWGAAGSA-N	354.793	3.784	50	40	FHGB	
CCOc1cccc(-c2n[nH]c3c2[C@@H](c2cccs2)C(C#N)=C(N)O3)c1	6621307	YQBOGWDPZBOWKW-OAHLLOKOSA-N	364.430	3.755	50	40	FHGB	
Cc1ccc(C)c2[nH]c(=O)c(CN(Cc3ccccc3)C(=O)CCl)cc12	13566555	CPXBRVXFMRXWBL-UHFFFAOYSA-N	368.864	3.913	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1Cl	7385771	CWYCYVHLPMJTQF-FYJGNVAPSA-N	357.841	3.713	50	40	FHGB	
Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc1C	5546978	KYDRUIVHECDJHM-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)COc2cc(C)cc(C)c2)cc1	904033	INKWMMYHGFBRLQ-HYARGMPZSA-N	353.466	3.679	50	40	FHGB	
N#C/C(=C\c1cccc(Br)c1)C(=O)Nc1cccc([N+](=O)[O-])c1	59133447	KJKWZJIAQJGGRJ-KPKJPENVSA-N	372.178	3.903	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)cc1)c1ccccc1OC(F)F	1087630	BZBDUVOBYSKJAH-DJKKODMXSA-N	369.165	3.814	50	40	FHGB	
CC1(C)c2ccccc2-n2c1c(Cl)c(O)c(C(=O)C(Cl)Cl)c2=O	2570522	UMVSXBQMRVVYGO-UHFFFAOYSA-N	372.635	3.822	50	40	FHGB	
Cc1cccc(OCC(=O)N/N=C\c2cccc(Br)c2)c1C	30838726	IEMNWVFFWVMYNZ-GRSHGNNSSA-N	361.239	3.595	50	40	FHGB	
CC(C)Oc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1	806449	LHBICXPIPWFURE-SFHVURJKSA-N	352.434	3.925	50	40	FHGB	
CC1(C)[C@@]2(C)CC[C@@]1(C(=O)Nc1ccccc1)[C@H](Br)C2=O	100868227	JLKGVIGPYYRFHH-DQYPLSBCSA-N	350.256	3.784	50	40	FHGB	
COc1cc(OC)c(OC)cc1/C=C(/C#N)C(=O)Nc1ccc(C)cc1	59335826	GIENIOUPSMTTES-DHDCSXOGSA-N	352.390	3.567	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)c2ccccc2C(F)(F)F)ccc1O	408783113	NGAMODIPTJLXPJ-FBHDLOMBSA-N	352.312	3.574	50	40	FHGB	
COc1ccc(-c2n[nH]cc2/C=C(/C#N)C(=O)NCc2ccc(C)cc2)cc1	5728570	NFAQIHFPVDQJBV-WQRHYEAKSA-N	372.428	3.617	50	40	FHGB	
C=CCc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(Br)c1OC	408785063	FRSUKPYAZNMVHO-ZSOIEALJSA-N	363.255	3.618	50	40	FHGB	
O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(-c2ccc(F)cc2)o1	409048305	SIDKSFNCQQJMKK-CIAFOILYSA-N	367.336	3.687	50	40	FHGB	
C/C(=N/NC(=O)c1cc(-c2ccc(Cl)cc2)n[nH]1)c1cccc(O)c1	1468357	VIZFIOWQPKIHPQ-JAIQZWGSSA-N	354.797	3.590	50	40	FHGB	
COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3c2ccc2ccccc32)cc1	4680354	CCGKDWATTIAHEI-LJQANCHMSA-N	356.381	3.845	50	40	FHGB	
CC(C1=NO[C@@H](CNc2ncc(C(F)(F)F)cc2Cl)C1)=C(C#N)C#N	20404928	VOIJGOHXOUSZLD-LLVKDONJSA-N	369.734	3.674	50	40	FHGB	
O=C(NNC(=O)c1ccnc2ccccc12)Nc1cccc(C(F)(F)F)c1	26780093	GZDYCDPIHQWWTA-UHFFFAOYSA-N	374.322	3.720	50	40	FHGB	
O=C(COc1ccccc1Cl)N/N=C/c1cccn1-c1ccccc1	4106929	AOLPWNXKSKKNNS-FYJGNVAPSA-N	353.809	3.660	50	40	FHGB	
C[C@H](Cl)C(=O)Nc1ccccc1C(=O)Nc1nnc(-c2ccccc2)o1	39758226	QKYLVQFWUHNNSY-NSHDSACASA-N	370.796	3.555	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Br)cn1C)[C@H]1C[C@H]1c1ccccc1	585145957	LLPTXZMRYOWKSX-UALMWKMKSA-N	360.255	3.697	50	40	FHGB	
O=c1ccc2c([C@H](O)CBr)ccc(OCc3ccccc3)c2[nH]1	98087983	GNFMSZCSSUZAGV-OAHLLOKOSA-N	374.234	3.535	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1	1063882	LEZGUXHXKOUQGZ-UDWIEESQSA-N	368.780	3.803	50	40	FHGB	
Br[C@H]1C=CC=CN1C/C=C/CN1C=CC=C[C@H]1Br	5004528	SSAJWEKHEUXTEL-DLPZHFSESA-N	372.104	3.756	50	40	FHGB	
O=C(CCCC[C@H]1CCSS1)Nc1cnn(CC2CCOCC2)c1	218230782	ITUDGMKPDIGQRN-INIZCTEOSA-N	369.556	3.962	50	40	FHGB	
Cc1cc(OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1C(C)C	6221012	USMKUHJLMWARLK-UHFFFAOYSA-N	360.841	3.612	50	40	FHGB	
C#CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccc(C)cc1	2080946	AZICWQTZPBHFEV-UDWIEESQSA-N	371.234	3.533	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)cc1OC	408797886	UEQCPYJACCCUMH-XNTDXEJSSA-N	366.804	3.906	50	40	FHGB	
CCCCc1sc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1[N+](=O)[O-]	5421426	RGWHIXHIXYZUKQ-KRWDZBQOSA-N	371.418	3.923	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Br)cc1)=N/NC(=O)c1ccccc1	16136636	KCAKVSJRKCAEEK-NDENLUEZSA-N	374.238	3.584	50	40	FHGB	
Cn1c(=O)oc2cc(N/C=C(\C=O)c3nc4cc(Cl)ccc4o3)ccc21	16363992	QSHCOMCCSSVKIA-CSKARUKUSA-N	369.764	3.578	50	40	FHGB	
O=C(Cc1ccccc1)NNC(=O)Cc1coc2ccc3ccccc3c12	16778606	WLFRHBJXJQDMEI-UHFFFAOYSA-N	358.397	3.519	50	40	FHGB	
Cc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccccc1OCC(=O)O	7210446	IXQOJKOMEBJRAF-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
CC(C)c1ccc([C@H]2[C@H]3CSCC=C3C(C#N)=C(N)C2(C#N)C#N)cc1	1438269	DOQZLYHJAPRIQA-OALUTQOASA-N	360.486	3.967	50	40	FHGB	
O=C(Cl)[C@H]1CC(=O)N(c2ccc3oc(-c4ccc(F)cc4)nc3c2)C1	57327098	FUEKRQMXCQYQCL-NSHDSACASA-N	358.756	3.752	50	40	FHGB	
CCOc1ccc(NC(=O)C(=O)NN=C2CCC(C(C)(C)C)CC2)cc1	59435601	FIXQUQIRVPQRAM-UHFFFAOYSA-N	359.470	3.732	50	40	FHGB	
CN1CC2=C(OC(N)=C(C#N)[C@@H]2c2cccs2)/C(=C/c2cccs2)C1	20528771	HICPRZRMTPGVDW-UEICXMAYSA-N	367.499	3.900	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1O)c1ccc(N2CCCCC2)c(F)c1	58634078	NNDCDAVUUKAHCF-HYARGMPZSA-N	355.413	3.676	50	40	FHGB	
COc1ccc(C2=C[C@@H](c3ccccc3)C(C#N)(C#N)C(N)=C2C#N)cc1	4663858	GAACJNIOAZJWFX-FQEVSTJZSA-N	352.397	3.646	50	40	FHGB	
C[C@@H]1CCCC[C@H]1NC(=O)/C(C#N)=C/c1cc(Br)ccc1O	408804162	CQDOFLNLXSXAFE-YFVDUCKESA-N	363.255	3.757	50	40	FHGB	
Cc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=N/NC(=O)c2ccco2)c1C	408999483	LIIBUFXOWOCCKK-RGVLZGJSSA-N	366.377	3.668	50	40	FHGB	
C[C@@H](Oc1ccccc1Br)C(=O)N/N=C/c1cccc(F)c1	1085448	MDHVVNYVILULEH-VURRPDKYSA-N	365.202	3.506	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(-c3ccccc3C(=O)O)o2)cc1	409364600	OBSTXIAZOUKXSG-LPYMAVHISA-N	362.385	3.646	50	40	FHGB	
CC(=O)N/N=C/c1c(Br)c(C)n(-c2cc(C)cc(C)c2)c1C	20243819	AXBSQQZRXCSTBP-DJKKODMXSA-N	362.271	3.943	50	40	FHGB	
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc(OC)cc1	3477110	ODXKTRHBWSMCBO-FOWTUZBSSA-N	359.385	3.628	50	40	FHGB	
CC(C)N(C[C@H]1CCCN(C(=O)OCc2ccccc2)C1)C(=O)CCl	79392729	TYHRHTACRUPLDG-KRWDZBQOSA-N	366.889	3.511	50	40	FHGB	
O=C(N/N=C/c1ccccc1C(F)(F)F)Nc1cccc2nsnc12	4558160	GZBFYHMDEQJSEF-UFWORHAWSA-N	365.340	3.866	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc1	4863692	RXWWKWSIJHKHBI-FSJBWODESA-N	365.355	3.666	50	40	FHGB	
O=C(NN=C1CCCCCCC1)C(=O)Nc1cccc(Br)c1	59515755	KUMUEYNJTPVAJS-UHFFFAOYSA-N	366.259	3.604	50	40	FHGB	
COC(=O)/C(C#N)=C/c1nc(-c2ccc(Cl)cc2)nn1-c1ccccc1	27562394	JXMWYBAWRWPILI-SDNWHVSQSA-N	364.792	3.668	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C\c1cc2c(cc1Cl)OCO2)c1ccccc1	4470905	PMJBWHGRKYYKAJ-CUTJPZLCSA-N	354.793	3.853	50	40	FHGB	
CC1(C)C(C#N)=C(SCCCC(=O)c2ccc(F)cc2)NC(=O)[C@H]1C#N	14231603	RMSXLCUPLUHSLR-CQSZACIVSA-N	371.437	3.553	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1	4723454	JFJLLXJDKCQDFU-YRNVUSSQSA-N	359.769	3.940	50	40	FHGB	
C=C1CC(C(=O)N/N=C/c2ccc(OCc3ccc([N+](=O)[O-])cc3)cc2)C1	408729715	IOSDZKXRXFCVIP-CIAFOILYSA-N	365.389	3.590	50	40	FHGB	
CN(C)c1ccc(/C=C(/C#N)C(=O)Nc2ccc(Br)cc2)o1	39127477	IPUZYWQDGBOJKS-LUAWRHEFSA-N	360.211	3.654	50	40	FHGB	
COc1ccc(C(=O)N/N=C2\C(=O)c3c(C)cc(C)cc3CC2(C)C)cc1	18128146	JLXKWJGTZIPHBG-BSYVCWPDSA-N	364.445	3.863	50	40	FHGB	in-vitro
O=C(Cl)[C@H]1CC(=O)N(c2ccc3oc(-c4cccc(F)c4)nc3c2)C1	57327090	YDQBEHQFRWSVCL-NSHDSACASA-N	358.756	3.752	50	40	FHGB	
CCOc1ccc(C=NNC(=O)[C@H](C)Oc2cc(C)cc(C)c2)cc1OC	11582379	RBMSJJQFZBQKRO-INIZCTEOSA-N	370.449	3.628	50	40	FHGB	
CC[C@H](C)c1ccc(NC(=O)CCNC(=O)[C@H](Br)CC)cc1	8733025	KXZNNHPWYAYLKK-SWLSCSKDSA-N	369.303	3.818	50	40	FHGB	
CC/C(=N\NC(=O)c1ccc2c(c1)nc(C)n2CC)c1cc(F)ccc1O	57556787	KYSHOAZTLJNUDJ-XQNSMLJCSA-N	368.412	3.753	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl)c1cccc(N)c1	4045935	HBNCQSYTJQYWEY-JYQBEENSSA-N	366.248	3.883	50	40	FHGB	
COc1ccc2ccccc2c1/C=N\NC(=O)COc1cccc(C)c1C	17118693	FIVQCDOOLYCXFQ-QRVIBDJDSA-N	362.429	3.994	50	40	FHGB	
COc1cccc(/C=C(/C#N)C(=O)NCc2ccccc2)c1OC(C)C	213902241	ULYJQTONOOMJOG-PDGQHHTCSA-N	350.418	3.706	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Nc1cccc(Br)c1)c1ccccc1	662770	IHFAPEZNXXGKAT-DZUMZMOTSA-N	360.255	3.790	50	40	FHGB	
COC(=O)[C@@]1(C)CCC[C@@]2(C)c3cc(OC)ccc3C(=O)[C@@H](Cl)[C@@H]12	5004488	CAQCHCCVWVJUGY-JZGRTCEGSA-N	350.842	3.736	50	40	FHGB	
C#CCOc1ccc(/C=C(/C#N)C(=O)N[C@@H](C)c2ccccc2)cc1OCC	207829033	NOEWINKMVIUUPL-PNWWAVQQSA-N	374.440	3.882	50	40	FHGB	
N#CC1=C(N)n2c(nc3ccccc32)N[C@H]1c1ccc(OC(F)(F)F)cc1	20086181	FRZCYOVQGRVVAI-HNNXBMFYSA-N	371.322	3.753	50	40	FHGB	
O=C(N/N=C/C=C/c1cccc([N+](=O)[O-])c1)c1cc2ccccc2cc1O	4893902	HZSXCFFUGIVIIU-RQVUTRMESA-N	361.357	3.883	50	40	FHGB	
Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)c1	59459578	HOQJTQUUCQHKOZ-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
Cc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1cccc(OCC(=O)O)c1	408805922	IJGNBRAOXPXAHR-VGOFMYFVSA-N	370.792	3.658	50	40	FHGB	
CC1=C(C#N)[C@H](c2cccc([N+](=O)[O-])c2)C(C(=O)OC(C)(C)C)=C(C)N1	68605248	ISIVNZCTFWPSEH-KRWDZBQOSA-N	355.394	3.695	50	40	FHGB	biogenic
COc1ccccc1/C=C\C=N\NC(=O)CSc1nc2ccccc2o1	5880540	LAOAEDSPNNHFBB-UARQRVSZSA-N	367.430	3.744	50	40	FHGB	
COC(=O)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2ccc2ccccc32)cc1	4680355	CCGKDWATTIAHEI-IBGZPJMESA-N	356.381	3.845	50	40	FHGB	
CC(=O)Nc1ccc2nc(NC(=O)[C@H](Br)C(C)C)sc2c1	20133522	HFVGEJFVOQCLFW-GFCCVEGCSA-N	370.272	3.613	50	40	FHGB	
CCC[C@H](Br)C(=O)Nc1nc2ccc(C(=O)OC)cc2s1	20132745	REPVFSSCSDNBGO-VIFPVBQESA-N	371.256	3.585	50	40	FHGB	
Cc1occc1C(=O)N/N=C/c1ccc(OC(F)F)cc1OC(F)F	2657588	LMXZLUCKGBFMJR-IFRROFPPSA-N	360.263	3.555	50	40	FHGB	
Cc1cccc(OCCC(=O)NNC(=O)c2cc(Cl)ccc2Cl)c1	6208225	ZVHMIKSKRIQKNM-UHFFFAOYSA-N	367.232	3.532	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2c(O)ccc3oc4c(c23)CCCC4)cc1	727511	ZJWJBTNYBRQAFV-WSDLNYQXSA-N	364.401	3.790	50	40	FHGB	
CC1=CC(=O)[C@@](Cl)(C(C)C)[C@@H](Cl)/C1=N/S(=O)(=O)c1ccccc1	105600305	AMXLKTIEMKDGJB-NTSOGCMCSA-N	374.289	3.586	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccc(-c2cc(C(=O)O)ccc2Cl)o1	408778206	QYVCBZFCQIWCFA-GHXNOFRVSA-N	358.781	3.730	50	40	FHGB	
COCc1cccc(C(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1	14226302	KIEDTUGNXRGFFZ-UHFFFAOYSA-N	369.299	3.517	50	40	FHGB	
O=C(CCCOc1ccc(Cl)cc1Cl)N/N=C/c1ccccn1	5705230	CZCOSLKUOACCQB-RGVLZGJSSA-N	352.221	3.698	50	40	FHGB	
COc1cc(C)ccc1C(=O)N/N=C/c1ccc(N2CCCCC2)cc1	408962286	YAOLTLGJUOOBLG-PXLXIMEGSA-N	351.450	3.758	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2C)c1	409063551	CCMMZASXMZMBPD-RGEXLXHISA-N	361.445	3.686	50	40	FHGB	
COc1cc(/C=N/NC(=O)[C@H](C)Nc2ccc3ccccc3c2)ccc1O	1095707	UKDNSXLVUNCBGL-KOUDTOEKSA-N	363.417	3.505	50	40	FHGB	
CCOC(=O)c1c(NC(=O)[C@H](Cl)CC)sc2c1CC(C)(C)OC2	2229576	HKIRYUJKQRZZQK-SNVBAGLBSA-N	359.875	3.732	50	40	FHGB	
Cc1ccnc(Sc2ccc(/C=C(\C#N)C(=O)NC3CCCCC3)o2)n1	409274740	XFVDEPUWFFMSSU-SDNWHVSQSA-N	368.462	3.885	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N/NC(=O)CC3(C)OCCO3)o2)cc1Cl	408953600	MEIGFQISZSXJLA-RGVLZGJSSA-N	362.813	3.512	50	40	FHGB	
O=C(CCSc1ccccc1)N/N=C/c1cccc(OC2CSC2)c1	408832486	UGDLOKCLNGDMDA-UDWIEESQSA-N	372.515	3.813	50	40	FHGB	
C#CCn1c(C)c(/C=N/NC(=O)CC2(C)SCCS2)c2ccccc21	409258308	WEAAXBSMPDUZQX-DEDYPNTBSA-N	371.531	3.619	50	40	FHGB	
COc1cc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)c([N+](=O)[O-])cc1OC	408565758	ACLXKQCCUYIASO-WZUFQYTHSA-N	368.324	3.692	50	40	FHGB	
CC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccc(OCc2ccccc2)cc1	1444667	MWZVLZVIEVZQBI-OAQYLSRUSA-N	360.413	3.936	50	40	FHGB	
CCCCOc1ccc(/C=C(\C#N)C(=O)Nc2cccnc2)cc1OC	1803236	RDDBRHOOAUCAIG-LFIBNONCSA-N	351.406	3.815	50	40	FHGB	
CN(NC(=O)c1ccc(OCc2cn3ccccc3n2)cc1)c1ccccc1	15832527	AVFWFWSFKATSFJ-UHFFFAOYSA-N	372.428	3.695	50	40	FHGB	
COc1ccc(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)cc1OC	33329976	YXUGWJUJXADXOX-JLPGSUDCSA-N	374.440	3.986	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccc(C)cc1)c1ccc(Br)s1	1188962	BBWZFQCTWVXIJC-WOJGMQOQSA-N	366.284	3.771	50	40	FHGB	
O=C(N/N=C\c1ccc(OC(=O)c2cccs2)cc1)c1ccc(F)cc1	30822025	NVCZGFYFWYNHFF-MTJSOVHGSA-N	368.389	3.870	50	40	FHGB	
CCOC(=O)c1c(NC(=O)[C@H](C)Br)sc2c1CCCC2	1465975	BIDTZNOHNKSCAQ-QMMMGPOBSA-N	360.273	3.526	50	40	FHGB	
CC[C@H](Br)C(=O)NCCC(=O)Nc1ccc([C@@H](C)CC)cc1	8733027	KXZNNHPWYAYLKK-WFASDCNBSA-N	369.303	3.818	50	40	FHGB	
C#CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccc(OCCC)cc1	20197814	LMVWHOOPJDBJEA-HYARGMPZSA-N	370.836	3.905	50	40	FHGB	
O=C(N/N=C/c1cn(Cc2ccccc2)c2ccccc12)c1ccncc1	860505	MWRQHPQDTWMPLQ-ZVHZXABRSA-N	354.413	3.849	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1-c1ccccc1Cl	58917785	VTWDWQBMGIMUSJ-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
COC(=O)c1c(NC(=O)CCCCl)sc2c1C[C@@H](C(C)C)OC2	2303367	UCAOHXPJVGCRAR-NSHDSACASA-N	359.875	3.590	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1OCc1cccc(F)c1	408897846	ZUWBXTDTEYYLQA-MKMNVTDBSA-N	374.799	3.849	50	40	FHGB	
O=C(N/N=C/c1ccc(F)cc1)C1CCN(Cc2ccc(Cl)cc2)CC1	5634087	DOBSTBXCINKKAS-YDZHTSKRSA-N	373.859	3.841	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2Br)o1	3153334	XKTQVCGTTZAFTL-REZTVBANSA-N	371.618	3.533	50	40	FHGB	
Cc1ccc(CNC(=O)/C(C#N)=C/c2cc3c(cc2Cl)OCO3)cc1	2759219	KOFBVFREBGLKAE-GIDUJCDVSA-N	354.793	3.601	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2)cc(Br)c1O	12418322	BPWXNIUDWRMEPO-GHXNOFRVSA-N	373.206	3.709	50	40	FHGB	
O=C1OC(=O)[C@H]2[C@H]1[C@@]1(c3ccccc3)O[C@]2(c2ccccc2)c2ccccc21	8385198	LXGWNCJNLUFEQL-DVJXIFHOSA-N	368.388	3.533	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)N2CCOCC2)c(C)n1-c1ccc(Cl)cc1	9234293	ZDTRSXYZVCMYFK-SFQUDFHCSA-N	369.852	3.513	50	40	FHGB	
CCc1ccc(/C(C)=N/NC(=O)CNc2ccc(Br)cc2)cc1	409348080	OYHOZPJBDIIHGX-FYJGNVAPSA-N	374.282	3.964	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)c(Cl)c2)c1	408792854	CSLHBOYWFQFPQV-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
CCOc1ccccc1/C=C(\C#N)c1nc(N)nc(Nc2ccccc2)n1	11296465	PKQFOSIJZWJIPH-NTCAYCPXSA-N	358.405	3.660	50	40	FHGB	
CCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(-c3ccc(F)cc3)o2)C1=O	16741518	ZUTHOGPAXAIJJP-YBEGLDIGSA-N	350.349	3.698	50	40	FHGB	
CCC1=C(C(=O)OC)[C@H](c2ccc(Cl)cc2Cl)C(C#N)=C(N)O1	4183417	AUICQMWHJGHRSO-CYBMUJFWSA-N	353.205	3.638	50	40	FHGB	
O=C(CNc1cccc2ccccc12)N/N=C/C=C/c1ccc2c(c1)OCO2	4663698	KKSOTTWSZOUOET-NPVQLUHYSA-N	373.412	3.796	50	40	FHGB	
O=C(CCSc1ccccc1)N/N=C/c1ccc(Br)o1	408997414	OKCAJBRWULSODN-MHWRWJLKSA-N	353.241	3.675	50	40	FHGB	
CC(C)N(C[C@@H]1CCCN(C(=O)OCc2ccccc2)C1)C(=O)CCl	79392727	TYHRHTACRUPLDG-QGZVFWFLSA-N	366.889	3.511	50	40	FHGB	
Cc1cc2c(cc1/C=N/NC(=O)c1ccccn1)[C@@H](C)CC(C)(C)N2C	208215241	GHXVCXMTNYFOJO-LUILSVGHSA-N	350.466	3.876	50	40	FHGB	
Cc1ccc([C@H](Br)[C@@H](Br)C(=O)[C@]2(C)CO2)cc1	4953609	PQHOXCGXAACSQA-LOWVWBTDSA-N	362.061	3.553	50	40	FHGB	
COc1cc(C(=O)/C(C#N)=C2\Nc3ccccc3S2)cc(OC)c1OC	100564035	UPUSTWQLTMQCSH-XDHOZWIPSA-N	368.414	3.848	50	40	FHGB	
CN(C)c1ccc([C@H](O)P(=O)(c2ccccc2)c2ccccc2)cc1	1064473	YGZOJJVDSWQLDW-OAQYLSRUSA-N	351.386	3.758	50	40	FHGB	
CCOC(=O)NNC(=O)c1cc(-c2ccc(C)cc2C)nc2ccccc12	21770589	NMBHDZNIILJREC-UHFFFAOYSA-N	363.417	3.910	50	40	FHGB	
C=CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(O)cc1	408815607	XIXZJFYAMGYEDY-RVDMUPIBSA-N	350.374	3.511	50	40	FHGB	
CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(C[C@@H](C)CC2)[C@@H]1c1ccccc1	35193556	AQSFJZCHQMDSTI-OSGPJOMKSA-N	361.445	3.710	50	40	FHGB	
CC(C)N(C[C@H]1CCCN(C(=O)CCl)C1)C(=O)OCc1ccccc1	79412048	DFMLXMAHFFHGKC-KRWDZBQOSA-N	366.889	3.511	50	40	FHGB	
COc1cc(/C=N/NC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)ccc1O	1106701	QZKWHVKONPVSPE-NSMHLIOHSA-N	354.450	3.853	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1cc([N+](=O)[O-])ccc1Cl	2603426	TZLPCXJHSZSNTD-HNNXBMFYSA-N	373.796	3.699	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)CCCC(=O)Nc2cccc(Cl)c2C)o1	59488455	ZCASQYCJHPCCED-RGVLZGJSSA-N	361.829	3.809	50	40	FHGB	
O=C(COc1ccc2ccccc2c1)N/N=C/c1ccc(Br)o1	1449526	RWWQYHYDLYERAR-VXLYETTFSA-N	373.206	3.724	50	40	FHGB	
CCN(CC)CCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(C)cc2)o1	2274486	RYYRYGMIIMTQLU-NBVRZTHBSA-N	351.450	3.620	50	40	FHGB	
CCC[C@@H](C(=O)NNC(=O)c1cc(-c2ccccc2)on1)c1ccccc1	14141696	XPFIESZIGPUBAX-QGZVFWFLSA-N	363.417	3.687	50	40	FHGB	
O=C(N/N=C/c1ccccc1[N+](=O)[O-])C(c1ccccc1)c1ccccc1	4575946	HQYKDMMPBIEWFK-PXLXIMEGSA-N	359.385	3.877	50	40	FHGB	
CCOC(=O)N[C@H](CC(=O)N/N=C/C=C/c1ccccc1)c1ccccc1	409332215	CPYNRPQIIQNQDH-AJHVMHSASA-N	365.433	3.679	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C\c2ccc(OC)c(OC(F)F)c2)c1	97990507	IYEVKCGNENJGOW-JYRVWZFOSA-N	374.343	3.851	50	40	FHGB	
N#C/C(=C\c1coc2ccccc2c1=O)C(=O)Nc1nc2ccccc2s1	2206890	DPHJLRMIRVNWSM-FMIVXFBMSA-N	373.393	3.948	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)CSCc2ccc(Cl)cc2)cc1	5328467	JCOCSKLYUVMTBW-RGVLZGJSSA-N	361.898	3.790	50	40	FHGB	
Cc1cc(N2CCC(NC(=O)CCCC[C@@H]3CCSS3)CC2)n[nH]1	225751047	ANIPYKJKFROJRK-OAHLLOKOSA-N	368.572	3.517	50	40	FHGB	
O=C(CCl)N1N=C(c2ccccc2)C[C@@H]1c1ccc2nccnc2c1	58047327	NSNAJMIMUBGVNC-GOSISDBHSA-N	350.809	3.546	50	40	FHGB	
N#C/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCCc1ccccc1	3395754	FWAAVOCWENUCPK-XNTDXEJSSA-N	355.781	3.514	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)CCSc2ccccc2)c1	5205755	FHQUARXZMZLZHI-KGENOOAVSA-N	355.463	3.668	50	40	FHGB	
CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1cccc([N+](=O)[O-])c1	408804295	XDIBEUHDGZDVBS-NTEUORMPSA-N	367.361	3.548	50	40	FHGB	
O=C(CCl)Nc1ccc(S(=O)(=O)Nc2cccc3ccccc23)cc1	408907240	NHGXAWRXYFSDJV-UHFFFAOYSA-N	374.849	3.818	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(N3CCCCC3)cc2)cc1C	408959515	AEKANVDNHBGAOL-BUVRLJJBSA-N	364.493	3.856	50	40	FHGB	
CC(C)n1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])c2ccccc21	34745806	TYABLVIMNFFGTC-MTJSOVHGSA-N	364.405	3.823	50	40	FHGB	
CC/C(Cc1ccccc1)=N/NC(=O)CCC(=O)Nc1ccc(OC)cc1	13882063	PBNUOZNYYQDHNG-QJOMJCCJSA-N	367.449	3.539	50	40	FHGB	
COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)c2ccccc2C)o1	9201030	XBDOHFLIDTVFQY-LPYMAVHISA-N	362.385	3.806	50	40	FHGB	
CCOc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1OC	714589	UKRUJPZKGPNGNL-SFHVURJKSA-N	368.433	3.545	50	40	FHGB	
O=C(N/N=C/c1cn(Cc2ccccc2F)c2ccccc12)c1ccncc1	2198382	OCPMTXZOGPSSBD-DHRITJCHSA-N	372.403	3.988	50	40	FHGB	
C[C@H]1CCCCN1C(=S)SCC(=O)C(C#N)=C1Nc2ccccc2N1	5690838	YZWVAGHMJUVBKH-LBPRGKRZSA-N	372.519	3.721	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)cc1Br	16185478	KBHIRKVXQIODMK-YQNMCNGNSA-N	365.271	3.734	50	40	FHGB	
O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(-c2cccc(F)c2)o1	33429208	ILWOINFQDJMGRS-MTJSOVHGSA-N	367.336	3.687	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1O)c1ccc(NC(=O)c2ccccc2)cc1	15894581	PJHHIPIWLLENDZ-BUVRLJJBSA-N	373.412	3.799	50	40	FHGB	
CCn1c2ccccc2c2cc(/C=C/C(=O)NNc3ncccn3)ccc21	46577241	JUHPWGWFOYWUTG-PKNBQFBNSA-N	357.417	3.761	50	40	FHGB	
O=C(N/N=C\c1ccccc1O)[C@@H]1Cc2ccccc2[C@H]1C(Cl)Cl	104215929	HUGRKRXTSNUAFA-YYUCUKARSA-N	363.244	3.602	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccc(O)cc2)c(C)n1-c1ccc(F)cc1	9265572	RYCJZHWUFKCODF-WSDLNYQXSA-N	351.381	3.703	50	40	FHGB	
CCCc1[nH]nc2c1[C@@H](c1c(OC)ccc3ccccc13)C(C#N)=C(N)O2	6664704	VGIQRIQAQIEBJT-GOSISDBHSA-N	360.417	3.742	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1C)c1ccc(NC(=O)c2ccco2)cc1	5620110	JAMZMQARSNNOBW-HZHRSRAPSA-N	361.401	3.994	50	40	FHGB	
Cn1cc(C(=O)N/N=C\c2ccc(Br)cc2)c2ccccc21	33330389	YSFNEVLZCREYHA-GRSHGNNSSA-N	356.223	3.705	50	40	FHGB	
C[C@H]1C[C@@H]2[C@H]3CCC4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@@H](O)C[C@@]2(C)/C1=C(\O)C=O	504395221	TYYMPHSFTLTHRI-ZUYZDUSJSA-N	374.452	3.614	50	40	FHGB	
O=C(N/N=C/C1=C(c2ccncc2)Oc2ccccc2O1)c1ccccc1	1087623	ZZBUUOFMZMRXTA-OEAKJJBVSA-N	357.369	3.637	50	40	FHGB	
COC(=O)[C@@]1(C)CCC[C@]2(C)c3cc(OC)ccc3C(=O)[C@@H](Cl)[C@@H]12	5004489	CAQCHCCVWVJUGY-OPNNQBFTSA-N	350.842	3.736	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C\c2cn(CC#N)c3ccccc23)c1	16228051	PRNUNEYESMGMKA-PTNGSMBKSA-N	356.385	3.719	50	40	FHGB	
O=C(Cc1cccc2ccccc12)N/N=C/c1ccc(O)c2ncccc12	3095341	CMJCHEVXZCKZKS-ZVHZXABRSA-N	355.397	3.786	50	40	FHGB	
CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1	6398424	SKTKMLCRLFATFR-SFHVURJKSA-N	374.396	3.800	50	40	FHGB	
CCOc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)ccc1O	948221	OOSHARBKTXPLSV-OQLLNIDSSA-N	363.822	3.783	50	40	FHGB	
CCc1[nH]nc2c1[C@H](c1ccc(-c3ccc(F)cc3)o1)C(C#N)=C(N)O2	5130073	BIMDOACUMVBZTC-INIZCTEOSA-N	350.353	3.589	50	40	FHGB	
Cc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C(/C#N)C(=O)NC(C)C)c1C	408791518	ZNFFMAFSHZYUNJ-YVLHZVERSA-N	366.421	3.742	50	40	FHGB	
Cc1ccccc1/C=N/NC(=O)c1ccn(Cc2ccc(Cl)cc2)n1	1086844	KLORRTYCVCZFIT-CIAFOILYSA-N	352.825	3.657	50	40	FHGB	
C[C@@H](I)C[C@@](F)(OC(F)(F)F)C(F)(F)F	16159355	MGSMUGDXPQAOBJ-QWWZWVQMSA-N	354.003	3.965	50	40	FHGB	
CCN1c2ccc(/C=N/NC(=O)c3cccnc3)cc2[C@H](C)CC1(C)C	208302585	DJEWPXQAMUKCGH-LJGKHRNASA-N	350.466	3.958	50	40	FHGB	
Cn1/c(=N\NC(=O)c2cc(Cl)sc2Cl)sc2ccccc21	4063208	VPVYYXLSZYUUSG-GHRIWEEISA-N	358.275	3.854	50	40	FHGB	
Cc1cccc(C(=O)Oc2ccc(/C=N/NC(=O)c3ccccc3N)cc2)c1	4595202	ZTUVJMPJZAOWDB-ZVHZXABRSA-N	373.412	3.560	50	40	FHGB	
C#CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccc(OCC)cc1	20764510	PTJYIPFTDWWECI-FYJGNVAPSA-N	356.809	3.515	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)cc1)C(=O)Nc1ccc2ccccc2c1	4199131	MORQNXKUDKQHJQ-CIAFOILYSA-N	351.793	3.582	50	40	FHGB	
N#CC1=C(SCc2ccccc2)NC(=O)C[C@@H]1c1ccc2c(c1)OCO2	4170825	GFIXWTMTZREHDP-OAHLLOKOSA-N	364.426	3.687	50	40	FHGB	
C[C@H]1CCC/C(=N\NC(=O)c2ccc(C(=O)N/N=C3\CCC[C@H](C)C3)o2)C1	6253305	PDXPWQNXVXYGHX-ASEDNAPISA-N	372.469	3.871	50	40	FHGB	
Cc1ccccc1CSCC(=O)N/N=C/c1ccc(Br)o1	408987956	CDKPNXPTAFEAAN-CAOOACKPSA-N	367.268	3.734	50	40	FHGB	
C[Sn](C)(Br)CCCCBr	195778045	ONAAYKKUFQIINL-UHFFFAOYSA-M	364.697	3.762	50	40	FHGB	
Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2Cl)c1	6796607	REDRLYPLIYCQFU-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
Cc1ccc(-n2cccc2/C=N/NC(=O)c2ccc(C#N)cc2F)c(C)c1	4106986	YLHUTCAQNJONBD-ZMOGYAJESA-N	360.392	3.869	50	40	FHGB	
COc1ccc(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)cc1OC	408565888	CESURSSDMOYDJE-HYARGMPZSA-N	354.450	3.694	50	40	FHGB	
CCc1ccc(/C=C(\C#N)C(=O)Nc2ccc(N3CCOCC3)cc2)cc1	2632663	GYTCYQYTBYCXSR-XDJHFCHBSA-N	361.445	3.631	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@@H]2C[C@H]3C=C[C@H]2C3)cc(OCC)c1OCC	102123927	ZNEHIIAWOIPSAR-VJHPBPLYSA-N	372.465	3.811	50	40	FHGB	
Cc1nc(Cl)c(C[C@@H](Br)CBr)c(Cl)n1	2254697	PBRBWLPPSRTUND-RXMQYKEDSA-N	362.880	3.793	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)cc1Br	101358560	KBHIRKVXQIODMK-IBPFJVHJSA-N	365.271	3.734	50	40	FHGB	
N#C/C(=C\c1ccccc1[N+](=O)[O-])c1nc2cc(Cl)ccc2c(=O)[nH]1	25583075	SREHSQGJXWQPOF-YRNVUSSQSA-N	352.737	3.549	50	40	FHGB	
CC(=O)N/N=C/c1ccc(OCc2cccc(C)c2)c(Br)c1	409008729	CPDPRGWDHVURJF-VXLYETTFSA-N	361.239	3.807	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(-c2cc(C(=O)OC)ccc2Cl)o1	408997863	OLJYQMBLSVLMRE-XYOKQWHBSA-N	359.765	3.857	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1	409002837	WRKSVCXQPOFHCQ-KGENOOAVSA-N	366.421	3.657	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-]	5942709	KWMVJRIFDPFQCU-QGMBQPNBSA-N	352.177	3.974	50	40	FHGB	
Cc1cc(Cl)ccc1OCC(=O)N/N=C/c1cn(C)c2ccccc12	57476845	AKAFFWONXILZLX-UFFVCSGVSA-N	355.825	3.669	50	40	FHGB	
COc1ccccc1NC(=O)N/N=C\c1ccc(N2CCCC2)c(F)c1	409095195	HNCKTLKJSYDOPD-BKUYFWCQSA-N	356.401	3.590	50	40	FHGB	
COc1ccc(-c2ccc(C(=O)NNC(=O)c3ccccc3C)cc2)cc1	4550915	PIDSGGQKCIECNK-UHFFFAOYSA-N	360.413	3.745	50	40	FHGB	
Cc1c(COc2ccccc2)cccc1NC(=O)NNC(=O)C1CCC1	95467136	OSSLDMGAKYXCDA-UHFFFAOYSA-N	353.422	3.527	50	40	FHGB	
CCC[C@H](C)c1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])o2)cc1	1085502	PIRNLNUHVNBFJD-MDBUFAAASA-N	359.382	3.621	50	40	FHGB	
Cc1cccc(COc2ccc([C@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)cc2)c1	5941767	JRWQNWJBFRBXIU-FQEVSTJZSA-N	372.428	3.824	50	40	FHGB	
N#CC(C#N)=C/C=C(/c1ccc(Br)cc1)N1CCSCC1	2388787	XWOMZUKTBAMCJK-SOFYXZRVSA-N	360.280	3.812	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccncc1	4721736	GQKQZGARZFFSIG-JMIUGGIZSA-N	370.752	3.667	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C\c2ccc(OC)cc2)cc1OCC	409331535	DOCKPQABVWMSSV-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
O=C(Cn1c2c(c3ccccc31)CCCC2)N/N=C/c1ccc(F)s1	252487049	HRFXJFCVBDTCOF-SRZZPIQSSA-N	355.438	3.871	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)cc1C	2375680	UUVAJNYQPSYMGI-DNTJNYDQSA-N	367.232	3.845	50	40	FHGB	
C/C(=N\NC(=O)c1ccoc1C)c1ccc(NC(=O)c2ccccc2)cc1	5921632	SKWSFTYIOJZQGA-OEAKJJBVSA-N	361.401	3.994	50	40	FHGB	
Cc1ccc2cc([C@H]3C(C#N)=C(N)Oc4cc(N)ccc43)c(Cl)nc2c1	876402	GBFKNMXZDGVPSY-SFHVURJKSA-N	362.820	3.997	50	40	FHGB	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2C1	3322390	ZTBXZAXWFABUPO-LLVKDONJSA-N	362.882	3.530	50	40	FHGB	
NC(=O)N/N=C/c1cn(Cc2ccc(Cl)cc2Cl)c2ccccc12	4083314	AOCNICKFUZSDDR-ODCIPOBUSA-N	361.232	3.999	50	40	FHGB	
C[C@H]1CCC/C(=N\NC(=O)c2ccc(C(=O)N/N=C3\CCC[C@@H](C)C3)o2)C1	6249944	PDXPWQNXVXYGHX-MTKLTTPZSA-N	372.469	3.871	50	40	FHGB	
CCN(NC(=O)c1cc(C2CC2)nc2onc(C)c12)c1ccc(C)cc1	65538683	QIWOFKOAJUAGFN-UHFFFAOYSA-N	350.422	3.888	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1)NNC(=O)CC12CC3CC(CC(C3)C1)C2	5578969	WYLYMHYTVXZNRI-UHFFFAOYSA-N	360.885	3.636	50	40	FHGB	
Cn1cc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c2ccccc21	408905419	YLDRVIGICHRAAL-JMIUGGIZSA-N	362.345	3.597	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C/c2c(O)ccc3ccccc23)cc1	1101691	QTQKVPYFACZFND-SFQUDFHCSA-N	358.397	3.777	50	40	FHGB	
Cc1ccc(S(=O)(=O)N2C[C@@H](CCl)Sc3ccccc32)cc1	5545574	LUJVYRBRCLXFFN-CYBMUJFWSA-N	353.896	3.903	50	40	FHGB	
Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2Cl)cc1C	3072739	UDSSTTMMKSCFRR-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
Cc1noc(CCCC(=O)NNc2c(Cl)cc(Cl)cc2Cl)n1	56061214	YOIXJFXJPQNWDF-UHFFFAOYSA-N	363.632	3.804	50	40	FHGB	
C/C(=N\NC(=O)CN[C@@H](C)c1ccccc1)c1ccc2ccccc2c1O	38333552	KUDLKJUFPYSPQD-HXNWEGJNSA-N	361.445	3.736	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc(OCC)c1O	409069784	WOVBCOONFLWTCE-LFIBNONCSA-N	364.401	3.771	50	40	FHGB	
O=C(CCc1ccccc1)c1ccccc1OC[C@H](O)CBr	22053232	PRQKSWPBFZCKPM-OAHLLOKOSA-N	363.251	3.637	50	40	FHGB	in-vitro
COc1ccc(OC)c(/C=N/NC(=O)COc2cc(C(C)C)ccc2C)c1	3167073	QMDKDPOXDSQTFA-WSDLNYQXSA-N	370.449	3.665	50	40	FHGB	
COc1ccc(N2C(S)=C(C#N)C(=O)N[C@H]2c2ccccc2Cl)cc1	818297	LJZBJRJEKSGVBL-MRXNPFEDSA-N	371.849	3.649	50	40	FHGB	
CCOC(=O)N/N=C/c1cn(Cc2ccc([N+](=O)[O-])cc2)c2ccccc12	1305159	VBBOVTALXMYIHM-RGVLZGJSSA-N	366.377	3.678	50	40	FHGB	
CCc1ccccc1NC(=O)C(=O)N/N=C/c1c(Cl)cccc1Cl	3131963	DXRMEWGSZKEZNQ-KEBDBYFISA-N	364.232	3.645	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2cc3cccc(C)c3nc2Cl)cc1	8228888	KSVWRPZRWNCHQV-SRZZPIQSSA-N	353.809	3.969	50	40	FHGB	
C/C(CCc1ccco1)=N/NC(=O)CCC(=O)Nc1cccc(Cl)c1	13138468	XFPBAUGOFBOZRQ-BKUYFWCQSA-N	361.829	3.777	50	40	FHGB	
COC(=O)c1ccc(NC(=O)[C@@]23CC[C@@H]([C@@H]2Br)C3(C)C)cc1	16739494	ZGDDAYBCQWSPDY-GDZNZVCISA-N	366.255	3.611	50	40	FHGB	
COc1ccc(N(Cc2cccnc2)C(=O)CCl)cc1C(F)(F)F	199755267	YQPZMEWABQBLEM-UHFFFAOYSA-N	358.747	3.881	50	40	FHGB	
C[C@]1(C(=O)N/N=C/c2ccccc2)NC2(CCCCC2)Cc2ccccc21	408734013	COEAUJVRQDICIU-ZRZWOPFXSA-N	361.489	3.901	50	40	FHGB	
Cc1cc(SC#N)ccc1NC(=O)C[C@@H](C(=O)O)c1ccc(F)cc1	25207113	JBTBJEJQPMPOAA-OAHLLOKOSA-N	358.394	3.904	50	40	FHGB	
C#CCn1c(C)c(/C=N/NC(=O)Cc2ccc(C)cc2C)c2ccccc21	20194557	WCUJVRXTZPUBNJ-BUVRLJJBSA-N	357.457	3.893	50	40	FHGB	
O=C(CCl)Nc1sc2c(c1C(=O)NCc1ccccc1)CCCC2	2569097	NNWVQRCCPFHCKO-UHFFFAOYSA-N	362.882	3.734	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cc(C)cc(C)c1	408882066	PWKRLZIBHKHHPB-VCHYOVAHSA-N	350.418	3.673	50	40	FHGB	
Cc1ccc(CNC(=O)/C(C#N)=C\c2c[nH]nc2-c2ccc(C)cc2)cc1	5728567	OHAMOGRNLQJNSU-ODLFYWEKSA-N	356.429	3.917	50	40	FHGB	
CC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2cc([N+](=O)[O-])ccc2C)o1	408797082	FSIXAARBXKVOND-OZYJXZHSSA-N	353.378	3.985	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2)c1C	211257707	ARNRABMTFFHOBJ-RGEXLXHISA-N	361.445	3.686	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccccc2OC(=O)c2ccccc2)cc1	710814	MYBFDUPGZKPUMZ-HZHRSRAPSA-N	374.396	3.678	50	40	FHGB	
O=C(Cc1cccc(C(F)(F)F)c1)N/N=C/c1cc(Cl)ccc1O	4499570	NAEAOWLPYSTMRB-ZVBGSRNCSA-N	356.731	3.757	50	40	FHGB	
COc1ccc(-c2nc3cc(NC(=O)CCl)cc(C)c3o2)cc1OC	226327942	VEWOMJJKQLVDEZ-UHFFFAOYSA-N	360.797	3.998	50	40	FHGB	
CC1=C(C#N)C(=O)N(C)C(=N\Cc2ccccc2)/C1=C/NCc1ccccc1	100945505	VHXJPQLRMFVJSB-LZKSQXKRSA-N	370.456	3.571	50	40	FHGB	
O=[P@@]1(N(CCCl)CCCl)NCC2(O1)C1CC3CC(C1)CC2C3	1869803	DAMHTNXBIHCYPW-WFFSFOGOSA-N	367.257	3.689	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]	59473273	PAIZWAIKHFUDDZ-HPAYWCODSA-N	363.826	3.879	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2C#N)ccc1OC(C)C	1453891	KTEBTXKERXMEDG-LICLKQGHSA-N	361.401	3.900	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N/NC(=O)[C@H](O)c3ccccc3)c2C)cc1	408589297	LFSVFQWINRFBRE-KURUZVKSSA-N	361.445	3.586	50	40	FHGB	
N#CCn1cc(/C=N\NC(=O)c2ccc(-n3cccc3)cc2)c2ccccc21	409377836	KELYOHRUGJTYFA-IWIPYMOSSA-N	367.412	3.719	50	40	FHGB	
C=CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)N1CCCC1	409372296	KMTHEXODVSMWQL-GXDHUFHOSA-N	361.239	3.543	50	40	FHGB	
CC(C)N(CC1CCN(C(=O)OCc2ccccc2)CC1)C(=O)CCl	79392730	ZAKVCBIQIQPVEI-UHFFFAOYSA-N	366.889	3.511	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1	5543657	QBCDRTCKDWOGOK-LLVKDONJSA-N	367.232	3.530	50	40	FHGB	
O=C(N/N=C/c1ccc(N2CCCCC2)o1)c1ccc(N2CCCC2)cc1	7384945	QNIQEAQLGKELDO-CJLVFECKSA-N	366.465	3.634	50	40	FHGB	
CCOC(=O)[C@H]1C[C@H](Sc2ccccc2)[C@H](Cl)C[C@@H]1C(=O)OCC	15079825	AUTVLJMYUKTMEB-JONQDZQNSA-N	370.898	3.907	50	40	FHGB	
Cc1cccc(C(=O)NNC(=O)[C@@H]2CC2(c2ccccc2)c2ccccc2)c1	788173	NBQXVSNGSOAYRK-NRFANRHFSA-N	370.452	3.762	50	40	FHGB	
C=CCn1c([P@@](=O)(c2ccccc2)N2CCCCC2)nc2ccccc21	3179580	PRHVVAJGGCRDGR-SANMLTNESA-N	365.417	3.937	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2cn(CC(=O)O)c3ccccc23)cc1	4710682	FSISHMPIUICZMR-XNTDXEJSSA-N	359.385	3.580	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2cccc(Cl)c2C)cc(OC)c1O	211522067	YLOCKSXXFSFBTH-QPEQYQDCSA-N	372.808	3.917	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)[C@@H]2[C@H](C=C(Cl)Cl)C2(C)C)ccc1O	83292561	HXJAIYPOVGPKRG-OTIIAYFSSA-N	371.264	3.832	50	40	FHGB	
N=C(CSc1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1	2512156	AILCLLARPAEPGO-UHFFFAOYSA-N	354.262	3.997	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)n2nc(C)cc2C)ccc1OCC(C)C	408976001	DMDJSQVDGUTWNL-RQZCQDPDSA-N	353.422	3.791	50	40	FHGB	
CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(O)c(Cl)c2)cc1	214132546	LOFBJAMVCVQOOY-NTEUORMPSA-N	370.792	3.768	50	40	FHGB	
COc1ccc(-c2nc3cc(NC(=O)CSC#N)cc(C)c3o2)cc1	216856156	DXSKGWDNZQEBJK-UHFFFAOYSA-N	353.403	3.965	50	40	FHGB	
CC[C@@H](Nc1ccc(C)cc1C)C(=O)N/N=C/c1ccc(N(C)C)cc1	1001446	UMAXDXVDYLSOLQ-VZMFNRANSA-N	352.482	3.710	50	40	FHGB	
O=C(N/N=C/c1cc([N+](=O)[O-])ccc1Cl)c1cc2ccccc2cc1O	670264	OKQNUJXOTUKULT-KEBDBYFISA-N	369.764	3.871	50	40	FHGB	
CCC(=O)NNc1nc(SC)nc2sc3c(c12)C[C@](C)(CC)OC3	5266676	RBIYOOPQVCAVMH-INIZCTEOSA-N	366.512	3.508	50	40	FHGB	
CS(=O)(=O)/C(C#N)=C/c1ccc(-c2ccc(Br)cc2)o1	7714109	KUKCATVAUFOUGI-MDWZMJQESA-N	352.209	3.618	50	40	FHGB	
N#C/C(=C/c1ccccc1OCc1cccc2ccccc12)C(=O)NC(N)=O	409249146	SKHIZSBHVKSJHR-PDGQHHTCSA-N	371.396	3.521	50	40	FHGB	
COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(Cl)ccc2OC)cc1	408792674	BVTJQUZLGSOFBL-NTEUORMPSA-N	370.792	3.681	50	40	FHGB	
N#Cc1ccc2nc([C@](O)(CCl)c3ccc(F)cc3F)sc2c1	39052328	RAYJROQQSNQGCU-INIZCTEOSA-N	350.777	3.921	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1	5721171	PEGUEDGJORUILF-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
CCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc1	3127152	OZBAAKUEXYGZBP-KEBDBYFISA-N	364.232	3.645	50	40	FHGB	
CCOC(=O)C1=C(N)OC(c2ccccc2)=C(C#N)[C@@H]1c1ccc(C)cc1	1579668	VQQOUYSIDIGHJX-SFHVURJKSA-N	360.413	3.777	50	40	FHGB	
C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1Cl	2502646	UJRPALJQDCUDDK-SFHVURJKSA-N	354.793	3.829	50	40	FHGB	
CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)cc1	705818	NRPOMOAXGQADLS-FQEVSTJZSA-N	356.429	3.961	50	40	FHGB	
CC[C@H](C)c1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])s2)cc1	1319580	YHBGJPYHAVRGSZ-NNLQFVHNSA-N	361.423	3.699	50	40	FHGB	
CC(C)OC(=O)COc1ccc(/C=C(/C#N)c2nc3ccccc3[nH]2)cc1	4678901	PRHFNBXPNRGPOU-WJDWOHSUSA-N	361.401	3.957	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)N2CCCC2)cc(OCC)c1OCC	409367664	HRJQUDMKLMSSTH-QGOAFFKASA-N	354.450	3.742	50	40	FHGB	
CCc1cccc(CC)c1NC(=O)C(=O)N/N=C/c1cccc(Cl)c1	409004600	XRLYPJHZOFCJKY-CIAFOILYSA-N	357.841	3.554	50	40	FHGB	
Cc1ccc(C)n1-c1ccc(C(=O)N/N=C/c2ccc(N(C)C)o2)cc1	408997530	HASYHRTZTKDTTR-FYJGNVAPSA-N	350.422	3.517	50	40	FHGB	
C[C@@H]1C[C@@H]2[C@H]3CCC4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@@H](O)C[C@@]2(C)/C1=C(\O)C=O	504395220	TYYMPHSFTLTHRI-VMPFJBLJSA-N	374.452	3.614	50	40	FHGB	
N#C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Br)cc1	5765878	BRHPULFGPDOJOA-XFXZXTDPSA-N	372.178	3.903	50	40	FHGB	
CC[C@H](C)Oc1c(Cl)cc(/C=N/NC(=O)c2ccncc2)cc1OC	6168453	QMFLWTUIOVIDAF-OVMKCGGTSA-N	361.829	3.685	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1Cl	2797343	SRBZBBQKFIFBHC-MDWZMJQESA-N	356.765	3.592	50	40	FHGB	
Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1ccc(C(C)C)cc1	59515533	YPFGJLCZVNWWPL-SRZZPIQSSA-N	357.841	3.861	50	40	FHGB	
CCc1ccc(/C(C)=N/NC(=O)c2cc(Br)ccc2O)cc1	59922409	YLPQSRVTCYXNSX-YBFXNURJSA-N	361.239	3.871	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)c(C)n1-c1ccccn1	409241250	SJYXWFBHPLQHPK-MOSHPQCFSA-N	356.429	3.713	50	40	FHGB	
CCc1sc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)cc1C	5364706	NTHICEZQZGSTFM-UHFFFAOYSA-N	367.430	3.618	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)ccc1OCC#N	215796995	KQDHYAOGAWAGLJ-UVTDQMKNSA-N	367.792	3.797	50	40	FHGB	
O=C(CCl)N[C@@H](CC(=O)OC1CCCCC1)c1ccc(F)cc1F	1615055490	AAYJBOFSDWJKJE-HNNXBMFYSA-N	359.800	3.627	50	40	FHGB	
C=C(C)[C@@H]1CC=C(C)/C(=N/NC(=O)c2cc(OC)c(OC)c(OC)c2)C1	672476	KGCNHFPDEHZEAH-HDOZFUISSA-N	358.438	3.731	50	40	FHGB	
C[C@H]1[C@H](c2ccc3c(c2)OCO3)C[C@H](Cl)C[C@@]12C=C1OCOC1=CC2=O	5664283	IDIAWFXBAIWWNZ-MJAJYPSFSA-N	374.820	3.877	50	40	FHGB	
COc1ccc(/C(C)=N\NC(=O)c2cc(-c3ccc(Cl)s3)n[nH]2)cc1	9334417	PQLHSEFITSDIMB-GRSHGNNSSA-N	374.853	3.954	50	40	FHGB	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2cc(C)ccn2)c1C	41817800	NHOGPKPHXRYFAZ-ZNBBLSJYSA-N	352.438	3.561	50	40	FHGB	
O=C(N/N=C/c1cccc(OC(=O)c2cccc(F)c2)c1)c1ccccc1	408895828	VYMWRTKABVTSCD-OEAKJJBVSA-N	362.360	3.809	50	40	FHGB	
Cc1c(/C=N/NC(=O)NC2CCCCC2)c(Cl)nn1-c1ccccc1	4546996	DBLBWZGYKNEADZ-UDWIEESQSA-N	359.861	3.800	50	40	FHGB	
C/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Br)c1	13476577	CVPHLVAZAABVIF-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
O=C(N/N=C\c1ccccc1O)[C@H]1Cc2ccccc2[C@H]1C(Cl)Cl	104215916	HUGRKRXTSNUAFA-DPGUEWGQSA-N	363.244	3.602	50	40	FHGB	
N#CC1=C(SCC(=O)c2ccccc2)NC(=O)C[C@@H]1c1cccs1	5515492	OPJMFDOCAPOZAP-ZDUSSCGKSA-N	354.456	3.703	50	40	FHGB	
COc1cc(/C(C#N)=C/c2ccc(N(C)C)cc2)c([N+](=O)[O-])cc1OC	4728663	JWTMMXCEWSKSFJ-NTEUORMPSA-N	353.378	3.742	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccc(-c2ccc(C(=O)O)c(Cl)c2)o1	408786574	SLIYCVRQYKYDHC-GHXNOFRVSA-N	358.781	3.730	50	40	FHGB	
C=CCOc1ccc([C@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1Cl	409132804	RLUGVJMCSKOAJC-SFHVURJKSA-N	369.852	3.635	50	40	FHGB	
COc1ccc(/C=C\C(=N/NC(=O)c2ccccc2)[C@@H](C)CN(C)C)cc1	17175041	ZWXRBVGZBVIQPO-YYSCWWQCSA-N	365.477	3.692	50	40	FHGB	
O=P(C(=S)N[C@H]1C[C@@H]2C=C[C@@H]1C2)(c1ccccc1)c1ccccc1	169809254	FGUUHJBPQVYOOT-MDZRGWNJSA-N	353.427	3.840	50	40	FHGB	
Cc1ccccc1[C@@H]1CC(=O)N2CN(Cc3ccco3)CSC2=C1C#N	20237962	CRVWJPAAJIIWMS-KRWDZBQOSA-N	365.458	3.803	50	40	FHGB	
COc1cc(OC)cc(C(=O)N/N=C/c2ccc(-c3ccc(F)cc3)o2)c1	8811007	UNWOTELTPAHCSZ-WSDLNYQXSA-N	368.364	3.867	50	40	FHGB	
Cc1cccc(-n2cccc2/C=N/NC(=O)c2ccc(C#N)cc2F)c1C	408965881	JPWSGTOIOPRCMT-ZMOGYAJESA-N	360.392	3.869	50	40	FHGB	
C/C(=N\NC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccncc1	8083836	LNSYIMAHLFILDN-CVKSISIWSA-N	367.412	3.846	50	40	FHGB	
CC(C)(C)OC(=O)N/N=C\c1cccc(OC(=O)/C=C/c2ccco2)c1	38161321	GWYPAWZQJIFVDB-FGKKRVJFSA-N	356.378	3.757	50	40	FHGB	
Cn1c(CCNC(=O)CCCC[C@H]2CCSS2)nc2ccccc21	96114511	PKOAOQKPJUOYQV-AWEZNQCLSA-N	363.552	3.946	50	40	FHGB	biogenic
Cc1cc(C)nc(NNC(=O)c2ccc(-c3nc4ccccc4s3)o2)n1	58377757	MUMOVGMZVLRBLQ-UHFFFAOYSA-N	365.418	3.720	50	40	FHGB	
CCOC(=O)c1sc(NC(=O)Cc2ccccc2)c(SC#N)c1C	4088264	CMEHILNSJVRQQW-UHFFFAOYSA-N	360.460	3.988	50	40	FHGB	
CC[C@H](C)Oc1c(Cl)cc(/C=N/NC(=O)c2cccnc2)cc1OC	9973979	IGOGIASXUBPAGG-SQWLXVSWSA-N	361.829	3.685	50	40	FHGB	
CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccccc2OCC)cc1	2800997	XZXDYGYOBYWBQO-GHRIWEEISA-N	364.401	3.808	50	40	FHGB	
Cc1cc(/C=N/NC(=O)CN2CCCCC2)c(C)n1-c1ccc(Cl)cc1	28216586	CSYMFNIWFJAXMG-LPYMAVHISA-N	372.900	3.684	50	40	FHGB	
COCCn1c(C)cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)c1C	4544626	ABSUDSBDHOMLLW-SSDVNMTOSA-N	367.371	3.534	50	40	FHGB	
Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)Cc1cccs1	8446680	SUSBHKKHLOEVEW-YBFXNURJSA-N	358.854	3.588	50	40	FHGB	
Cc1ccc(CN(C)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	9793850	VKASITSAWBXSDR-CQSZACIVSA-N	371.506	3.668	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	408865595	BJYNATLHSBIWFK-YBFXNURJSA-N	361.785	3.801	50	40	FHGB	
CCc1ccc(NC(=O)/C(C#N)=C\c2ccc(O[C@H](C)C(=O)O)cc2)cc1	408853460	TVPDDJWOMOCNJM-MTOJCTJASA-N	364.401	3.647	50	40	FHGB	
O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(N2CCCCC2)c(F)c1	409234500	LDPCVIHLNOUGBM-UCQKPKSFSA-N	357.404	3.648	50	40	FHGB	
Cc1ccccc1/C=N/NC(=O)Cn1c2ccccc2c(=O)c2ccccc21	408763900	PTXHUCSRLOLRFU-ZVHZXABRSA-N	369.424	3.613	50	40	FHGB	
CCCCCC(=O)Nc1ccc(C(=O)N/N=C/c2ccccc2OC)cc1	3083567	SJZOCUBTSPYWMP-PXLXIMEGSA-N	367.449	3.978	50	40	FHGB	
Cc1ccc(OCC(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1	1083972	JMOLUHVGIBIUIL-UHFFFAOYSA-N	374.849	3.703	50	40	FHGB	
CCOc1cccc(-c2n[nH]c3c2[C@H](c2cccs2)C(C#N)=C(N)O3)c1	6621311	YQBOGWDPZBOWKW-HNNXBMFYSA-N	364.430	3.755	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)OC(C)(C)C)c(C)n1CC(C)C	14897472	SFWSZKDBYKKWGC-RQZCQDPDSA-N	360.454	3.553	50	40	FHGB	
Cc1cc(N2CCC(NC(=O)CCCC[C@H]3CCSS3)CC2)n[nH]1	225751076	ANIPYKJKFROJRK-HNNXBMFYSA-N	368.572	3.517	50	40	FHGB	
N#CC1=C(N)OC2=C(C(=O)CCC2)[C@@H]1c1cc2ccccc2nc1Cl	804017	XWZFVFZWDLCTBG-MRXNPFEDSA-N	351.793	3.703	50	40	FHGB	
COc1c(Cl)cc(/C=N\NC(=O)Cc2ccc(F)cc2)cc1Cl	409230400	CYWFHLUHPLLAQJ-UKWGHVSLSA-N	355.196	3.834	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=N\NC(=O)Cc3ccc(F)cc3)c2c1	409237705	BGXZIYPRWRYNJG-QRVIBDJDSA-N	366.392	3.689	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2cccc(OC)c2OC)cc1	210631907	SKVRZBLRHXYPLX-QINSGFPZSA-N	352.390	3.648	50	40	FHGB	
CO[C@@H](c1cc2c(cc1Br)OCO2)[C@@H](C)Br	1602878	CXJZDLJNUKOMEA-KSBSHMNSSA-N	352.022	3.649	50	40	FHGB	
COc1ccc(-c2ccc(/C=N/NC(=O)c3ccccc3N)o2)cc1Cl	2744260	QEFJTZLBKVGXPJ-SSDVNMTOSA-N	369.808	3.955	50	40	FHGB	
CCOc1c(Cl)cc(/C=N/NC(=O)c2ccc(OC)cc2)cc1OC	657824	XKMHARFDVMNRFX-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
Cc1ccc(NNC(=O)C(O)(c2cccc(C)c2)c2cccc(C)c2)cc1	825222	CPYNSTJSAAFKQX-UHFFFAOYSA-N	360.457	3.991	50	40	FHGB	
Cc1ccccc1OCC(=O)N/N=C/c1cc(Cl)cc(Cl)c1O	3075186	FMZUMEUZQQBHJA-UFWORHAWSA-N	353.205	3.537	50	40	FHGB	
CCn1cc(/C=N/NC(=O)COc2cccc3cccnc23)c2ccccc21	2359354	BUSDYEGZRWBEOU-ZMOGYAJESA-N	372.428	3.739	50	40	FHGB	
Cc1ccc(C)c(OCC(=O)N/N=C/C=C/c2cccc([N+](=O)[O-])c2)c1C	12859352	HJSJYGQYOCGGTH-LCISEVAWSA-N	367.405	3.714	50	40	FHGB	
CN(NC(=O)c1cccnc1Cl)c1ncc(C(F)(F)F)cc1Cl	2561808	WQPUQRNJZMGKDU-UHFFFAOYSA-N	365.142	3.583	50	40	FHGB	
CCOC(=O)N/N=C/c1ccccc1OCCOc1cc(C)cc(C)c1	4525981	FEMIQRNHEHFWHA-KGENOOAVSA-N	356.422	3.841	50	40	FHGB	
COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1	4646516	CJWUQRQWXKFRGT-FQEVSTJZSA-N	372.428	3.716	50	40	FHGB	
CC(C)Oc1ccc(C(=O)NNC(=O)CCCSc2ccccc2)cc1	9885079	WBSWINMPXUXJQB-UHFFFAOYSA-N	372.490	3.807	50	40	FHGB	
CC(=O)N/N=C/c1ccc(OCc2cccc(F)c2)c(Br)c1	409020477	PSBHIIPZVQDCIK-DJKKODMXSA-N	365.202	3.637	50	40	FHGB	
CCN1c2ccc(/C=C(/C#N)C(=O)N3CCOCC3)cc2[C@@H](C)CC1(C)C	223531442	KEUNIYFLKZHVNO-JIHKLPAASA-N	367.493	3.564	50	40	FHGB	
CCc1ccc(OCC(=O)N/N=C/c2ccc(Br)s2)cc1	1444737	HIDOZHGTXDAFHS-RQZCQDPDSA-N	367.268	3.602	50	40	FHGB	
COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(C)o2)sc2c1CCCC2	1453396	SKPMBXSLIJAEOM-FMIVXFBMSA-N	370.430	3.861	50	40	FHGB	
N#CC(C#N)=Cc1cn(CCOc2ccc3c(c2)OCO3)c2ccccc12	920407	HHKMAMBQHABYRG-UHFFFAOYSA-N	357.369	3.880	50	40	FHGB	
COc1cc(C(=O)[C@H](C)Br)ccc1OC(=O)c1ccccc1	1679120	RNWCQJRROAWTEQ-NSHDSACASA-N	363.207	3.881	50	40	FHGB	
CC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])s2)cc1	1319575	YHBGJPYHAVRGSZ-SGEFVQMOSA-N	361.423	3.699	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1)c1ccco1	408723253	SCUANQSLMXOKLX-GIJQJNRQSA-N	359.725	3.865	50	40	FHGB	
O=C(CCC(=O)Nc1ccccc1Br)NN=C1CCCCC1	5946039	SOBAZSBROIXIMU-UHFFFAOYSA-N	366.259	3.604	50	40	FHGB	
COc1cccc(C(=O)N/N=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1	408870157	VPKZEGFRHJGCSK-NDENLUEZSA-N	365.345	3.627	50	40	FHGB	
CC(=O)NNc1nc(-c2ccccc2)c(NC(=O)c2ccccc2)s1	72238718	XMLJEOGBGYOHGP-UHFFFAOYSA-N	352.419	3.525	50	40	FHGB	
CC(C)(C)OC(=O)N/N=C(\N)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	43769301	ZEZHXOHZUCWNRN-UHFFFAOYSA-N	371.281	3.869	50	40	FHGB	
COC(=O)N/N=C/c1cn(CCCOc2ccccc2)c2ccccc12	2237772	HFIDHOBZRQXZEX-KGENOOAVSA-N	351.406	3.800	50	40	FHGB	
CCN(CC)c1ccc(/C=N\NC(=O)c2cc3ccccc3o2)c(O)c1	408851940	BYDVLHPIJJNJLG-BKUYFWCQSA-N	351.406	3.749	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NC2CCOCC2)c(C)n1C1CCCCC1	98055056	VZTLITDDKBNFEW-QGOAFFKASA-N	355.482	3.812	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)c(OCC)c1	408747526	PEQFBQZGXFXASR-PDGQHHTCSA-N	350.418	3.707	50	40	FHGB	
Cc1ccc(C(=O)Oc2ccc(/C=N\NC(=O)c3ccc(C)nc3)cc2)cc1	39402877	SMMMSHJIJLWXLT-CFRMEGHHSA-N	373.412	3.682	50	40	FHGB	
N#C/C(=C\c1ccccc1Br)C(=O)c1ccc2c(c1)OCO2	44028786	JBNOGJZQRKLMGV-NTUHNPAUSA-N	356.175	3.968	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)ccc2C)cc1	3664987	PVTGGTIARAUMNZ-HYARGMPZSA-N	367.449	3.571	50	40	FHGB	
COc1ccc(C(=O)NNc2nc3c(C)cc(C)cc3s2)c(OC)c1	4121447	VXWPUUDRVFROPW-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)CSCc2ccc(C)cc2)cc1	59474284	VTBSYIYLJOLFAD-PXLXIMEGSA-N	369.490	3.727	50	40	FHGB	
COc1ccc2c(c1)c(/C=N/NC(=O)[C@H]1C[C@@H]1c1ccccc1)c(C)n2C	5516578	YJGGKLWBJJATKJ-ORSZOYQMSA-N	361.445	3.749	50	40	FHGB	
Cc1[nH]c2ccccc2c1C(=O)/C(C#N)=C/c1ccc(N(C)CCO)cc1	5687930	MNMMTXACOJEKFR-GHRIWEEISA-N	359.429	3.695	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2cc(Cl)c(OC)cc2OC)cc1	408793330	OLFJGHILGFUSDH-MDWZMJQESA-N	372.808	3.911	50	40	FHGB	
Cn1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(-c2ccccc2)n1	253408357	XNQOBEBFKCLQBZ-SFHVURJKSA-N	374.444	3.538	50	40	FHGB	
C=C1C(C)(C)[C@@H]2CC[C@]1(C(=O)NNC(=O)[C@@]13CC[C@H](C1)C(C)(C)C3=C)C2	102448412	HFZJKRKZPFNURH-DJDZNOHASA-N	356.510	3.899	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C\c2ccc(O[C@H](C)C(=O)O)cc2)c1C	59679797	JNVNZVLPVOFUNW-QJISPJEISA-N	364.401	3.701	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccc(C(N)=O)cc2)o1)c1nc2ccccc2[nH]1	13471238	KHBCXRYKWNMBRW-PTNGSMBKSA-N	354.369	3.986	50	40	FHGB	
C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)/C1=C(\O)C=O	118914193	TYYMPHSFTLTHRI-NIQJDLCESA-N	374.452	3.614	50	40	FHGB	in-vitro
NC(=O)N/N=C\c1cn(-c2ccccc2)nc1-c1ccc2ccccc2c1	6496290	HHBGZSLPNBBUMU-QRVIBDJDSA-N	355.401	3.695	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)c2cccc(Br)c2)Nc2ccccc21	11617374	OWDSTWIACXYNRZ-GHRIWEEISA-N	354.207	3.929	50	40	FHGB	
Cc1cccc(-n2c(C)cc(/C=N/NC(=O)COc3ccccc3)c2C)c1	58926864	MJQITDOKVGWZAE-OEAKJJBVSA-N	361.445	3.932	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@H]1c1cccc(F)c1	2272620	YXVLNIYJPCALHM-QGZVFWFLSA-N	364.376	3.608	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1Br	408812200	CQCNQFUIWFBKLB-GRSHGNNSSA-N	373.206	3.968	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(COc2ccccc2)o1)c1nc2ccccc2[nH]1	7675539	OOGQSPBPSJGFCB-ZVHZXABRSA-N	374.400	3.889	50	40	FHGB	
COc1cccc2cc(C(=O)N/N=C/c3ccc(Cl)c([N+](=O)[O-])c3)oc12	409097853	HPPJVEMPTXRSRZ-DJKKODMXSA-N	373.752	3.767	50	40	FHGB	
N#C/C(=C\c1cc2c(cc1Br)OCO2)c1ccc2c(c1)OCO2	409365756	RVXGEJJSGZPBPQ-KGVSQERTSA-N	372.174	3.971	50	40	FHGB	
O=C(N/N=C/c1cccc(Oc2nc(Cl)ncc2F)c1)c1ccccc1	409065528	SYBPOEYLCNTKPW-LSHDLFTRSA-N	370.771	3.825	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c(C)n1-c1ccncc1	33676202	AMAKSEFGSWVISP-ATVHPVEESA-N	358.401	3.740	50	40	FHGB	
C/C(CC(=O)Nc1ccc(C)c(Cl)c1)=N\NC(=O)c1cccc(C)c1O	5343708	FSUIUULPNQEAHI-LPYMAVHISA-N	373.840	3.797	50	40	FHGB	
C=CCc1cccc(/C=N/NC(=O)CNc2ccc3ccccc3c2)c1O	1081924	GBVPPQAJLGOMAT-ZVHZXABRSA-N	359.429	3.836	50	40	FHGB	
C=CCn1cc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)c2ccccc21	6158804	MJAZPLLHUUCPOP-LPYMAVHISA-N	360.417	3.550	50	40	FHGB	
ICC1CCC(CI)CC1	100434289	CADHELUGADNHSF-UHFFFAOYSA-N	364.008	3.663	50	40	FHGB	
Cn1cc(/C=N/NC(=O)Cc2ccc(Br)cc2)c2ccccc21	9203201	NLGCOEMDGQTOMW-RGVLZGJSSA-N	370.250	3.634	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2ccc(Br)cc2)c(C)c1	6189764	IFVGJYGQLVNKHG-VXLYETTFSA-N	361.239	3.595	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccc(OC)cc1O	409393214	VRYIIOCPTIXPCZ-LPYMAVHISA-N	364.401	3.717	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)s2)c(C)n1-c1ccccc1	8027056	ZCSADMAUEOJOPT-UHFFFAOYSA-N	373.865	3.884	50	40	FHGB	
CCCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(N(C)C)cc2)C1=O	16806504	BFZLXFSQYPYKHE-AQTBWJFISA-N	351.450	3.535	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c2ccco2)s1	408996817	JZUKRJHLXRMGOD-YBFXNURJSA-N	353.403	3.666	50	40	FHGB	
CC(C)Oc1cccc(NC(=O)/C(C#N)=C\c2ccccc2[N+](=O)[O-])c1	408782109	VSULTAXYFZKXST-GDNBJRDFSA-N	351.362	3.928	50	40	FHGB	
CCCCc1ccc(NC(=O)C(=O)N/N=C/c2ccccc2Cl)cc1	3101267	GIBGIFZKCITARM-FYJGNVAPSA-N	357.841	3.771	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)COc2cc(C)ccc2C(C)C)c1	3167845	MKSUYFZTFFNONK-WSDLNYQXSA-N	370.449	3.665	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccc(OC(F)F)cc2)c2ccccc2n1	3292163	IRYKIGKHFLVHLW-SSDVNMTOSA-N	355.344	3.909	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc(Cl)c1O	14134575	WZTFILIWCKQUAZ-SRZZPIQSSA-N	360.841	3.754	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C\c2cccc(Br)c2)c(C)c1	30843086	GHMJHPJQIZZBIL-GRSHGNNSSA-N	361.239	3.595	50	40	FHGB	
CCOC(=O)c1c(N/C(C)=C(/C#N)C(N)=O)sc(-c2ccccc2)c1C	105145356	BISSOWCBOGNEJQ-OWBHPGMISA-N	369.446	3.595	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2cccc(Cl)c2)o1)C(=O)Nc1ccccc1	14009953	BEPMVIKXMNNFJB-MTJSOVHGSA-N	367.792	3.689	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)c1ccccn1	4935830	JDRKQVZFBRQTPM-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(CCC[C@H]2C)[C@@H]1c1ccccc1	35193580	BECKUTVKDLBRRL-YFYZNPQRSA-N	361.445	3.710	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1OC	8497342	DMNVHXABXNVHQR-LPYMAVHISA-N	370.449	3.630	50	40	FHGB	
N#CC1=C(N)N(c2ccccc2C#N)C2=C(C(=O)CCC2)[C@H]1c1ccsc1	707187	BIGUCKFIBBSIFQ-IBGZPJMESA-N	372.453	3.925	50	40	FHGB	
CC(C)COC(=O)c1ccc(NC(C#N)=C2C(=O)c3ccccc3C2=O)cc1	959635	IZCLFTLIDKMGEZ-UHFFFAOYSA-N	374.396	3.768	50	40	FHGB	
C[C@@H](Oc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2Cl)cc1)C(=O)O	59247991	JYNDIZXKZGDZFI-XTCQQWIJSA-N	370.792	3.738	50	40	FHGB	
Cc1ccc(C)n1-c1cccc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c1	3666118	GCMZVFGBKUNWJX-FYJGNVAPSA-N	362.389	3.766	50	40	FHGB	
C[C@]12CC[C@@H]3[C@]1(C)CO[C@]3(P(c1ccccc1)c1ccccc1)C2=O	100746571	VVUKNXGGDLPMKO-PSWRPDDJSA-N	350.398	3.851	50	40	FHGB	
O=C(CCSc1ccc(Cl)cc1)N/N=C/c1ccc2c(c1)OCO2	20248767	MBXHZKSSNAGZDF-VXLYETTFSA-N	362.838	3.701	50	40	FHGB	
CC(C)=CNNC(=O)COc1cc(C)c(Br)cc1C(C)C	2292759	UHGRKSBRGXPQIE-UHFFFAOYSA-N	355.276	3.804	50	40	FHGB	
CCCCn1nc(C)c(NC(=O)c2ccc(NC(=O)CCl)cc2)c1C	14405312	ZDHKHOXUNMSHOT-UHFFFAOYSA-N	362.861	3.730	50	40	FHGB	
COc1cc(OC)cc(C(=O)N/N=C/c2c(OC)ccc3ccccc23)c1	8339576	OYEPDRQPIWOTPJ-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
O=C(N/N=C\c1ccccc1[N+](=O)[O-])C(c1ccccc1)c1ccccc1	5602411	HQYKDMMPBIEWFK-JCMHNJIXSA-N	359.385	3.877	50	40	FHGB	
O=C(CCl)N1c2ccccc2S(=O)(=O)c2cc3ccccc3cc21	1705768	YYNFUOWLEJSGHJ-UHFFFAOYSA-N	357.818	3.890	50	40	FHGB	
COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)c(OC)c1	948102	FAYHRJLYBQLZMB-CXUHLZMHSA-N	363.822	3.696	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)/N=c2/sc3cc(C)ccc3n2C)cc1	105897361	SZMMSUCBAZJSPI-JJWCMTGFSA-N	363.442	3.591	50	40	FHGB	
CCSc1ccccc1C(=O)NNC(=O)c1ccc(OC(C)C)cc1	12752486	FIVLBWZVFWYNLW-UHFFFAOYSA-N	358.463	3.661	50	40	FHGB	
C/C(CC(=O)Nc1ccccc1C(C)C)=N\NC(=O)c1ccc(O)cc1	4690563	YDXQBUWLIPNSDV-HYARGMPZSA-N	353.422	3.650	50	40	FHGB	
COc1cccc(SCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c1	31817585	YNEUWLGVDVQBIS-UHFFFAOYSA-N	365.458	3.678	50	40	FHGB	
O=C(C/C(=N/NC(=O)c1ccccc1F)C(F)(F)F)c1cccs1	5678869	GGZDXPIKRIQBGS-MOSHPQCFSA-N	358.316	3.808	50	40	FHGB	
Cc1cc(-c2ccc(/C=N\NC(=O)c3ccncc3)o2)c([N+](=O)[O-])cc1C	16268051	FUUIGKHJPIIKRS-NHDPSOOVSA-N	364.361	3.631	50	40	FHGB	
O=C(N/N=C/c1ccc(F)cc1)c1ccc(CSc2ncccn2)cc1	654631	DWXUUWRGELWVSG-FSJBWODESA-N	366.421	3.672	50	40	FHGB	
CCOC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@H]2c1ccc(F)cc1	1428100	BZYDUJLMNAUQCV-CQSZACIVSA-N	358.394	3.591	50	40	FHGB	
Cc1c(/C=C(/C#N)C(=O)N(C)C)c2ccccc2n1Cc1ccccc1C#N	59334567	GBXJUEHDGBEACF-UNOMPAQXSA-N	368.440	3.865	50	40	FHGB	
COc1cc(/C=C(/C#N)c2cccc(C#N)c2)cc(Cl)c1OCC(=O)O	408566897	JAJYRHYMZXAESS-UUASQNMZSA-N	368.776	3.748	50	40	FHGB	
C/C(=N\NC(=O)c1ccc2c(c1)OCO2)c1cc(Cl)cc(Cl)c1O	7785230	GBLWOINANINWIN-UFWORHAWSA-N	367.188	3.582	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(N)=O)c(OCc2cccc3ccccc23)c1	408872979	QEHNHKHHVGITBX-WOJGMQOQSA-N	358.397	3.820	50	40	FHGB	
COC1(C(=O)Nc2ccc(OCCBr)cc2)CCCCC1	225628146	LNCARHJPPOTLQY-UHFFFAOYSA-N	356.260	3.748	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CCC(=O)Nc2ccc(C)c(C)c2)cc1	5953562	MMBDJSDHHCKOFR-HYARGMPZSA-N	367.449	3.571	50	40	FHGB	
C#CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccccc1C	13586120	GAVALALFDYADAX-UDWIEESQSA-N	371.234	3.533	50	40	FHGB	
COc1ccc(Cl)cc1-c1ccc(/C=N/NC(=O)c2cccnc2)o1	409039344	GIXZINLTSPGTOH-SRZZPIQSSA-N	355.781	3.768	50	40	FHGB	
O=C(CSc1nc2ccccc2s1)N/N=C1\CCc2c(O)cccc21	70038982	WLVRAIGUOLXRMF-DEDYPNTBSA-N	369.471	3.561	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C\c2ccc(N3CCCC3)o2)c1	408851879	GWTXRMGPZZCTEU-QINSGFPZSA-N	351.406	3.824	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)cc(OC)c1O	195287953	LXTBICSZGSBRFV-XNTDXEJSSA-N	352.365	3.814	50	40	FHGB	
CCCCN1C(=O)/C(=C(\C#N)C(=O)NC2CCCCC2)c2ccccc21	198123040	LFWJLNCDLMRPIP-HTXNQAPBSA-N	351.450	3.559	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)c(Cl)c2)o1	5879620	JKSPZLWUMKQXOO-XYOKQWHBSA-N	365.216	3.923	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)s1)C(O)(c1ccccc1)c1ccccc1	5871677	GIKSWYHUETVQIJ-FYJGNVAPSA-N	370.861	3.788	50	40	FHGB	
CO[C@@H]1CC[C@H](/C=C(/C#N)C2CCC([N+](=O)[O-])CC2)C[C@@H]1Br	5328146	OKDIJYAIKUNQCW-LGDBYJEOSA-N	371.275	3.850	50	40	FHGB	
COc1ccc([C@@H](O)P(=O)(c2ccccc2)c2ccccc2)cc1OC	2168897	DKBNQYFVQDKKPR-NRFANRHFSA-N	368.369	3.709	50	40	FHGB	
CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N/N=C/C=C\c1ccccc1	12401323	PDDDDYPEJDNCMW-JYTKTXRFSA-N	363.461	3.647	50	40	FHGB	
FC(F)(F)C(F)(F)C(F)(F)[C@H](Br)CBr	103527534	BTZKXQHJFPEDEC-UWTATZPHSA-N	355.873	3.978	50	40	FHGB	
COc1ccc(P(=O)(Oc2ccccc2O)c2ccc(OC)cc2)cc1	104822513	AKMVORTYBQVHQK-UHFFFAOYSA-N	370.341	3.717	50	40	FHGB	
O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)N/N=C/c1cccs1	2134271	QUXNFMZQFKFLHP-GIJQJNRQSA-N	370.261	3.924	50	40	FHGB	
COc1ccc(Br)cc1/C=C(\C#N)c1nnc2n1CCCCC2	5069640	YRBKMKBUTPMXHJ-UKTHLTGXSA-N	373.254	3.840	50	40	FHGB	
CC[C@H](C)c1ccc(OCC(=O)N/N=C/c2ccc(C(=O)OC)cc2)cc1	1319781	FQOMIYWKTCNDSJ-NSMHLIOHSA-N	368.433	3.516	50	40	FHGB	
NNC(=O)/C=C/c1ccc(OCc2ccc(F)cc2Cl)c(Cl)c1	226334387	NUOFBAXABHEFLH-QHHAFSJGSA-N	355.196	3.715	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccccc2Cl)o1)C(=O)NC[C@@H]1CCCO1	26964689	GBQMBZKFRHZHPZ-WVUXNXBLSA-N	356.809	3.802	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(F)cc3)o2)c(OC)c1	60512588	MJHBEZOIVNYVQP-WSDLNYQXSA-N	368.364	3.867	50	40	FHGB	
Cc1ccc(/C=C/C(=O)N/N=C\c2cccn2-c2ccc([N+](=O)[O-])cc2)cc1	409059908	YMUWYPJRJWEKAN-AMZDHWMSSA-N	374.400	3.857	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cc(C)ccc2OC)c(OC)c1	408812420	LUVZJXVWCBFDOA-XNTDXEJSSA-N	352.390	3.567	50	40	FHGB	
C[C@@H](Oc1cccc2ccccc12)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]	1434108	LJADSYQIHPWSAL-CNRHGSOZSA-N	363.373	3.666	50	40	FHGB	
C/C(=N/NC(=O)c1cc(-c2ccc(C)s2)n[nH]1)c1ccc([N+](=O)[O-])cc1	12462539	JCXCWYUVNFXKDA-WQRHYEAKSA-N	369.406	3.509	50	40	FHGB	
C/C(CC(=O)Nc1c(C)cc(C)cc1C)=N\NC(=O)Cc1ccccc1	4410957	FDYLJANESMNERE-HAVVHWLPSA-N	351.450	3.675	50	40	FHGB	
COc1cc(Cl)c(/C=N/NC(=O)Cc2ccc(C)cc2C)cc1OC	20194735	MAJFYIQSQGYQPI-SRZZPIQSSA-N	360.841	3.667	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(OCc2cc(OC)ccc2OC)cc1	408984078	DVYXFFIAVZDRDU-LFIBNONCSA-N	367.401	3.753	50	40	FHGB	
CCOc1ccccc1NC(=O)/C(C#N)=C/c1cc(OC)ccc1OC	6951448	GNRLTHJARGLEHZ-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)CC2(C)SCCS2)cc1Br	409219197	NWXDYRDNGMAUCV-CXUHLZMHSA-N	373.341	3.794	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)N[C@H](C)c2ccccc2)c(OC)c1C	409235764	QJSQJKXGQUCYQX-PWDRBQJJSA-N	350.418	3.797	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(-c3ccccc3C#N)o2)cc1	408532579	QJLNTESTBVGTRX-ZMOGYAJESA-N	358.401	3.689	50	40	FHGB	
C=CCOc1c(Cl)cc(/C=C(/C#N)C(=O)N(C)C)cc1Br	59334043	DGJSRGRLXRSZTM-WDZFZDKYSA-N	369.646	3.662	50	40	FHGB	
CC(C1=NO[C@H](CNc2ncc(C(F)(F)F)cc2Cl)C1)=C(C#N)C#N	20404930	VOIJGOHXOUSZLD-NSHDSACASA-N	369.734	3.674	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N\NC(=O)COc1cccc(Cl)c1	409107822	QZAURNNBNNBEQX-JMIUGGIZSA-N	367.232	3.921	50	40	FHGB	
CN1C(=C(C#N)C(=O)c2cc([N+](=O)[O-])ccc2Cl)N(C)c2ccccc21	9338780	OLWWRHRPINAKLL-UHFFFAOYSA-N	368.780	3.752	50	40	FHGB	
Cc1ccc(-n2c(C)c(Br)c(/C=N/NC(=O)CC#N)c2C)cc1	20243769	WZVSXEODMRRDFX-KEBDBYFISA-N	373.254	3.529	50	40	FHGB	
C/C(=N\NC(=O)CCSc1ccc(C)cc1)c1ccc([N+](=O)[O-])cc1	409124002	JPWPJTSPLPPNCY-XMHGGMMESA-N	357.435	3.926	50	40	FHGB	
C=CCOc1ccccc1/C=N/NC(=O)CSc1nc2ccccc2o1	408761176	CATXTVNWVCAOSZ-UDWIEESQSA-N	367.430	3.635	50	40	FHGB	
C#CCOc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C)c2)cc1OCC	213090978	PNCVXYFMZSBNEH-AQTBWJFISA-N	360.413	3.951	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2c(C)cccc2C)cc(OC)c1OC	211472771	VTWZFBJFVKVWEZ-SXGWCWSVSA-N	366.417	3.875	50	40	FHGB	
O=C(CCl)NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1	1319674048	BLNYKYQEINVTNI-UHFFFAOYSA-N	359.853	3.626	50	40	FHGB	
COc1cc([N+](=O)[O-])c(/C(C#N)=C\c2ccc(C)cc2)c([N+](=O)[O-])c1OC	5745134	LFHYVKVOVQKSGK-JYRVWZFOSA-N	369.333	3.893	50	40	FHGB	
CCOC(=O)C1=C(C)OC(n2cccc2)=C(C#N)[C@H]1c1cccc(OC)c1	4751326	NXVHRNMDTGBVJL-LJQANCHMSA-N	364.401	3.840	50	40	FHGB	
Cc1ccc([C@H]2CC(=O)N3CN(Cc4ccco4)CSC3=C2C#N)cc1	20348330	JLBLZNGEXKXTTM-QGZVFWFLSA-N	365.458	3.803	50	40	FHGB	
N#C/C(=C\c1ccc(Br)s1)c1nc2ccccc2c(=O)[nH]1	12772139	QVXAGOXUMBOJGL-VQHVLOKHSA-N	358.220	3.811	50	40	FHGB	
CCOc1ccc2ccc(OCC)c(/C=N/NC(=O)c3ccco3)c2c1	409067822	ZRTKQBUNZPVNLK-FYJGNVAPSA-N	352.390	3.994	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)CSCc2ccccc2C)c1	4409038	ACSXOFKQZKDKEO-PXLXIMEGSA-N	369.490	3.727	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl)c1ccccn1	4646714	KYGKCUYZMPIVIZ-KKBVUKDESA-N	352.221	3.696	50	40	FHGB	
COC(=O)c1ccc(NC(=O)[C@@]23CC[C@@H]([C@H]2Br)C3(C)C)cc1	35982074	ZGDDAYBCQWSPDY-OGHNNQOOSA-N	366.255	3.611	50	40	FHGB	
COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1cc2c(cc1C)OCO2	408801621	WKOHNMRTWYOGAO-OVCLIPMQSA-N	350.374	3.586	50	40	FHGB	
C[C@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	1092209	KLYKECGTRHWTAO-HADWXUJASA-N	362.389	3.699	50	40	FHGB	
N#C/C(=C/Nc1ccc(O)c(C(=O)O)c1)c1nc2cc(Cl)ccc2o1	5338025	LSBOOKONQZQYME-HJWRWDBZSA-N	355.737	3.862	50	40	FHGB	
COc1cccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2C)c1	1444791	BULPIESGDAWLCC-LPYMAVHISA-N	354.450	3.830	50	40	FHGB	
CC[C@@H](Nc1ccc(OC)cc1)C(=O)N/N=C/c1c[nH]c2ccccc12	673228	OBAQDQGGGZOZQH-MNOULKQQSA-N	350.422	3.517	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)C23CC4CC(CC(C4)C2)C3)cc1OC	5908092	MXJZEPAKEGWBCZ-LPYMAVHISA-N	356.466	3.760	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1cccc(Cl)c1	16678653	NZXYESASOCLBQD-UDWIEESQSA-N	374.828	3.858	50	40	FHGB	
Cc1nc(COc2ccc(C(=O)NN(C)c3ccccc3)cc2)cs1	8358593	YWEXHZWYEYMOAP-UHFFFAOYSA-N	353.447	3.812	50	40	FHGB	
COc1cc(/C=C(/C#N)c2ccc(C#N)cc2)cc(Cl)c1OCC(=O)O	409369176	GMODFUNJZYZMFL-UUASQNMZSA-N	368.776	3.748	50	40	FHGB	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1C	12906238	TZEKCGABFGZDMT-UHFFFAOYSA-N	374.440	3.810	50	40	FHGB	
Cc1ccc(C(=O)N/N=C\c2cc([N+](=O)[O-])c(Cl)cc2Cl)cc1	8372098	SLWJRMZTJPPALQ-LSCVHKIXSA-N	352.177	3.974	50	40	FHGB	
CCOc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1OC	714590	UKRUJPZKGPNGNL-GOSISDBHSA-N	368.433	3.545	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)c2ccc(OC)c(OC)c2)cc1Cl	409327424	TUFARQOSCNAUFS-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
CC[C@H](C)Oc1ccc(/C=N\NC(=O)Cc2ccc(F)cc2)cc1OC	409250310	QLPGLTXBUIJPLD-CRRPLPBISA-N	358.413	3.704	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)c1	409112554	DXHJPIWSDCWLTI-QQHUYRGFSA-N	369.490	3.974	50	40	FHGB	
COc1ccc2nc(/C(C#N)=C\c3cc(OC)c(OC)c(OC)c3)[nH]c2c1	409393539	YFBVLJHVMFFKGB-QPEQYQDCSA-N	365.389	3.661	50	40	FHGB	
BrC[C@@H]1CN=C(N2CCS/C2=N\c2ccccc2)S1	5600823	OADFGEJHVYNVLW-KDUNNAQNSA-N	356.314	3.589	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)cc1	2753771	YZJVBBKNILJMFL-KEBDBYFISA-N	360.797	3.621	50	40	FHGB	
Cc1c(C(=O)NNC(=O)[C@H]2C[C@@H]2c2ccccc2Cl)oc2ccccc12	8727960	VGGARVOSCHHKSS-CABCVRRESA-N	368.820	3.959	50	40	FHGB	
Cc1ccc(-c2n[nH]cc2/C=C(/C#N)C(=O)NCCc2ccccc2)cc1	5728613	SEUVPZXBDSTPRF-UYRXBGFRSA-N	356.429	3.651	50	40	FHGB	
N#C/C(=C\c1ccc(OCC(=O)O)c(Br)c1)c1ccccc1	409049457	WYELEDKFMXLVMG-RIYZIHGNSA-N	358.191	3.977	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])c(Cl)c2)o1)c1cccnc1	408973421	MTURADVENQPVRG-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
CCOc1cc2c(cc1/C=N\NC(=O)c1cccc3ccccc13)OCO2	409094661	FONWSWAMBONTBQ-UUYOSTAYSA-N	362.385	3.731	50	40	FHGB	
O=C(CCCl)N1N=C(c2ccccc2)C[C@@H]1c1ccccc1[N+](=O)[O-]	256027869	HFROCFXDPXFAFB-QGZVFWFLSA-N	357.797	3.901	50	40	FHGB	
COC(=O)N/N=C/c1cn(CCOc2ccc(C)cc2)c2ccccc12	1252068	WMAHPDSFCOTLEY-FYJGNVAPSA-N	351.406	3.719	50	40	FHGB	
O=C(O)c1ccnc([C@@H]2CCCC/C2=N\NC(=O)c2ccccc2Cl)c1	16778489	ODDQEWDZHIGXPT-TYIKUYDASA-N	371.824	3.877	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1	59250080	OIXDRSFCASPHGJ-UDWIEESQSA-N	368.780	3.803	50	40	FHGB	
COc1ccc(N2C(S)=C(C#N)C(=O)N[C@@H]2c2ccc(Cl)cc2)cc1	818298	XOWDKKMTFGZWTP-INIZCTEOSA-N	371.849	3.649	50	40	FHGB	
COc1cc(/C=N/NC(C)=O)ccc1OCCCOc1ccc(C)c(C)c1	27837675	RSLRVTZAIDYSRF-HYARGMPZSA-N	370.449	3.630	50	40	FHGB	
N#C/C(=C\c1cccc(F)c1)c1nnc(NC(=O)c2ccccc2)s1	4478127	IKGHGIAUOGPTIW-NTEUORMPSA-N	350.378	3.994	50	40	FHGB	
CCn1cc(/C=N/NC(=O)CNc2ccc(Cl)cc2)c2ccccc21	409359742	BVBHVTOIWSWKBC-SSDVNMTOSA-N	354.841	3.877	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-]	408844903	XEDPXOYSDWOAEA-AWQFTUOYSA-N	351.284	3.686	50	40	FHGB	
CCOC(=O)COc1ccccc1/C=C(/C#N)c1nc2ccc(F)cc2[nH]1	408570924	ZNODWVFGBJUBJP-ZROIWOOFSA-N	365.364	3.708	50	40	FHGB	
C[C@H](NC(=O)c1cccc(NC(=O)CBr)c1)c1ccccc1	35605433	OAEKEUFRGKJOEB-LBPRGKRZSA-N	361.239	3.511	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C/c2ccc(-c3ccccc3C#N)o2)cc1	10475794	LWPVUNUOCXWVKZ-BUVRLJJBSA-N	373.412	3.910	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@@H]1c1ccc(F)cc1F	1444412	XNMHRJCIPHCEOX-CYBMUJFWSA-N	356.357	3.635	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccccc1Cl	408800745	PCNRCBHWTSVCRP-RVDMUPIBSA-N	366.804	3.906	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CSc2ccccc2)cc1OCC	408863921	VLSXKARSDFQMNA-KGENOOAVSA-N	370.474	3.893	50	40	FHGB	
C=CCOC(=O)C1=C(C)NC(SCC)=C(C#N)[C@@H]1c1ccccc1OC	40486416	GTJKBIPJNIWVPW-SFHVURJKSA-N	370.474	3.873	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C/c1cc(Br)ccc1O)c1ccccc1	3326156	RNWICFCYANMZML-KMHUVPDISA-N	371.234	3.939	50	40	FHGB	
O=C(CNC1CCCCC1)N/N=C/c1ccc(-c2cccc(Cl)c2)o1	409388763	WEPHHIKIZTXHKB-WSDLNYQXSA-N	359.857	3.972	50	40	FHGB	
CCCOc1ccc(/C=C(\C#N)c2nc3ccccc3c(=O)[nH]2)cc1OC	13150462	JCPPFJIMEQMMGD-RVDMUPIBSA-N	361.401	3.785	50	40	FHGB	
O=C(NNC(=S)NCCCc1ccccc1)c1cccc2ccccc12	408585836	JWOYQHOIPACKSD-UHFFFAOYSA-N	363.486	3.582	50	40	FHGB	
Cc1c(/C=N/NC(=O)c2cnccn2)c2ccccc2n1Cc1ccccc1	67194082	SOUFLKWGPUWHDN-DHRITJCHSA-N	369.428	3.552	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Br)cn1C)[C@H]1C[C@@H]1c1ccccc1	98055457	LLPTXZMRYOWKSX-ACIMENLPSA-N	360.255	3.697	50	40	FHGB	
CCOc1ccc([C@H](O)CCC(=O)N/N=C/c2cccc(Cl)c2)cc1	6351384	ZQNWUEWCRQMKPN-KOMLCTQHSA-N	360.841	3.703	50	40	FHGB	
O=C(N/N=C\c1ccc(OC(F)F)cc1OC(F)F)c1cccs1	33377055	FEWUBOPCGJYBDN-GXHLCREISA-N	362.304	3.715	50	40	FHGB	
COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1ccc(C(C)(C)C)cc1	694750	HLXZLKOIRDPKSF-LPYMAVHISA-N	370.449	3.774	50	40	FHGB	
COc1cccc(OCC(=O)NN=C2c3ccccc3-c3ccccc32)c1	657639	BPPSCQJJTZDEFU-UHFFFAOYSA-N	358.397	3.623	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(F)cc2F)o1)c1cccc([N+](=O)[O-])c1	408604649	VXHOHHSJESVZAZ-UFFVCSGVSA-N	371.299	3.897	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1O)c1cccc(NC(=O)c2ccccc2)c1	4502805	RBNLUDGIPPYJIO-BUVRLJJBSA-N	373.412	3.799	50	40	FHGB	
C/C(=N\NC(=O)c1ccncc1)c1cccc(NC(=O)c2cccs2)c1	5895773	DFNUGOMUGJJKFJ-LPYMAVHISA-N	364.430	3.549	50	40	FHGB	
Cc1ccc(-c2nnc(NC(=O)[C@H](Br)C(C)C)s2)cc1	4070336	OAJKBTVBEVAEST-LLVKDONJSA-N	354.273	3.872	50	40	FHGB	
Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)NNc1ccc(F)cc1	45970950	UVSBHHSXWFQZCZ-CMDGGOBGSA-N	350.825	3.797	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(C)c(Cl)c2)c1C	408805583	GZRIAKUVUIBBMZ-LICLKQGHSA-N	371.868	3.726	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccc(OC)cc1	409273295	WYBVFSFJSMGAMZ-HZHRSRAPSA-N	358.397	3.624	50	40	FHGB	
C[C@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc([N+](=O)[O-])s1	1081812	DQCDDUONGDZAND-MKFNJMOCSA-N	368.418	3.760	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)cc1)c1ccc(NC(=O)c2ccco2)cc1	6334162	GTRZQDPSCXTPGW-CIAFOILYSA-N	367.792	3.949	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)c2cc(C)nc3ccccc23)cc1OC	6048807	RMGXAPQXDXWIER-OEAKJJBVSA-N	363.417	3.714	50	40	FHGB	
CN(C)c1ccc(/C=C(\C#N)c2nc3ncc(Br)cc3[nH]2)cc1	4675679	LWXXOVXRMHQGBX-KPKJPENVSA-N	368.238	3.851	50	40	FHGB	
CN1/C(=C\C=C(/C#N)C(=O)Nc2nccs2)C(C)(C)c2ccccc21	7166854	MLRZYDYVLZBFDD-DLZYAPHWSA-N	350.447	3.843	50	40	FHGB	
N#C/C(=C\c1cc(Br)c(N2CCOCC2)o1)c1ccccc1	408855092	BWCWIERGENFZIT-GXDHUFHOSA-N	359.223	3.943	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CC[C@@H](C)C2)[C@H]1c1ccccc1	35193547	SPSUTBNAUGSSCK-WTGRHJARSA-N	361.445	3.710	50	40	FHGB	
C=C1C(C)(C)[C@@H]2CC[C@]1(C(=O)NNC(=O)[C@]13CC[C@H](C1)C(C)(C)C3=C)C2	135845070	HFZJKRKZPFNURH-AJAKECSLSA-N	356.510	3.899	50	40	FHGB	
C[C@H]1C[C@H]2[C@@H]3CC/C(=C(/O)C=O)[C@@]3(C)C[C@@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12	1570003322	XYGYYRSXRDASPZ-BTWRCXSRSA-N	356.462	3.522	50	40	FHGB	
C/C(CC(=O)NC12CC3CC(CC(C3)C1)C2)=N\NC(=O)c1cccc(C)c1	4713765	XTIJKLNWNUWEMF-BUVRLJJBSA-N	367.493	3.576	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1OC	59401473	CJCCXTJQFLYNMF-FYJGNVAPSA-N	370.474	3.644	50	40	FHGB	
CCN(CC)C1=N[P@@](=O)(c2ccccc2)NC(c2ccccc2)=C1C#N	102138963	REZWIBUIMOVLHH-AREMUKBSSA-N	364.389	3.783	50	40	FHGB	
C=CCNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1cccs1	5668015	HTSQIHHCUYPOOO-QINSGFPZSA-N	360.442	3.810	50	40	FHGB	
Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)c2cccc(F)c2)o1	408960239	KBDRTTVDNXPEMI-SSDVNMTOSA-N	366.348	3.856	50	40	FHGB	
O=S(=O)(c1ccccc1)n1cc(CBr)c2ccccc21	2513735	SUJXGYBNXSVALG-UHFFFAOYSA-N	350.237	3.773	50	40	FHGB	
O=C(COc1ccccc1-c1ccccc1)N/N=C/c1ccc(C(=O)O)cc1	1103498	ZTRJIIZRDMRKIE-OEAKJJBVSA-N	374.396	3.581	50	40	FHGB	
C=CCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(C(=O)OC)cc1	408809278	KXBWYDVFIRIXNA-GHRIWEEISA-N	362.385	3.584	50	40	FHGB	
O=C(CCl)N(C(=O)CCl)C1=CC2(CCCC2)Cc2ccccc21	4772782	DMMNQVANDPLATK-UHFFFAOYSA-N	352.261	3.977	50	40	FHGB	
COc1cccc2cc(C(=O)N/N=C/c3cc([N+](=O)[O-])ccc3Cl)oc12	409100983	WHFLCEMNPVXMNG-DJKKODMXSA-N	373.752	3.767	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2cc(F)c(N3CCCC3)cc2C)cc1	6389942	KPRKVWPBJFCOOK-LPYMAVHISA-N	355.413	3.507	50	40	FHGB	
CCCCCCCCCCNC(=S)NNC(=O)c1ccc(OC)cc1	100980463	QIQWNRAUNSYTBT-UHFFFAOYSA-N	365.543	3.945	50	40	FHGB	
O=C(N/N=C/C=C/c1ccccc1)C(O)(c1ccccc1)c1ccccc1	2275618	VPINZUCWRRSDEY-JERWTEEISA-N	356.425	3.738	50	40	FHGB	
COc1ccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(N)=S)cc1	2329059	ZHXFXSRSBUPGGT-RVDMUPIBSA-N	360.442	3.741	50	40	FHGB	
Cc1ccc(C(C)C)c(OCCOc2cccc(/C=C(/C#N)C(N)=O)c2)c1	13899366	YTLLYFVNNFYIKM-PDGQHHTCSA-N	364.445	3.969	50	40	FHGB	
COc1ccccc1/C=C/C=C(\C#N)c1nc(N)nc(Nc2ccccc2)n1	14093295	WUPDNSXKFPMANU-QCPPYIPPSA-N	370.416	3.826	50	40	FHGB	
N#C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	408879102	CLOUYZUZIHXZMQ-YRNVUSSQSA-N	372.724	3.702	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)cc1[N+](=O)[O-]	250505550	DGXSHMSRISYRIG-GNRCFQDZSA-N	359.426	3.660	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)NC2CCCCC2)cc1Br	13382089	OKEVLHGJVPDWFD-LCYFTJDESA-N	363.255	3.814	50	40	FHGB	
CC(=O)[C@@]1(O)[C@@H](Cl)C[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C	4083353	FCNFDODVDQKBAV-KWHHLLRUSA-N	368.945	3.927	50	40	FHGB	biogenic
CCC[C@H](Br)C(=O)Nc1nc2ccc(N(C)C)cc2s1	20132789	CUPDYTPJSWEKCZ-JTQLQIEISA-N	356.289	3.864	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(N3CCCC3)c(F)c2)cc1C	409068181	HQLNRYKIYAFNQT-ZMOGYAJESA-N	368.456	3.605	50	40	FHGB	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@](C)(C#N)CCOC(C)C)c1C	98059557	TVAIAKWSJYLSEH-SRKIZSPNSA-N	370.497	3.636	50	40	FHGB	
C[C@]12CC[C@@H]3[C@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@H]1CC[C@]2(O)C#N	70673135	VRSHJJXUDZAQKD-XUDSTZEESA-N	357.494	3.947	50	40	FHGB	biogenic
Cc1ccc(C)n1/C(C#N)=C(\C#N)NC(=O)c1cccc(C(F)(F)F)c1	1384360	SEGIWMQERARWPN-FOCLMDBBSA-N	358.323	3.770	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1c1c(F)cccc1F	6813965	AYVLMJGLWYPTDI-AWEZNQCLSA-N	350.328	3.573	50	40	FHGB	
C[C@@H]1CCCC[C@@H]1NC(=O)/C(C#N)=C/c1cc(Br)ccc1O	408804161	CQDOFLNLXSXAFE-XLFIVMGGSA-N	363.255	3.757	50	40	FHGB	
C/C(=N/NC(=O)[C@@H]1C[C@H]1c1ccccc1)c1cccc(NC(=O)C2CC2)c1	17074417	KDHORHKPXUVVTA-FFSVQTDXSA-N	361.445	3.679	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)c2cc3ccccc3n2Cc2ccccc2)n1	40145256	JQRHPGPWDVAXAN-UHFFFAOYSA-N	371.444	3.853	50	40	FHGB	
Cc1nn(C2CCCC2)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	253408925	YZKJMPVZDXDIGN-GOSISDBHSA-N	366.465	3.758	50	40	FHGB	
Cc1ccccc1COc1c(Cl)cc(C(=O)NN)cc1Br	226340462	KRKOERZMHGLFIZ-UHFFFAOYSA-N	369.646	3.593	50	40	FHGB	
C=CCOc1ccccc1/C=N/NC(=O)Cc1ccc(Br)cc1	9204113	AULXDTQONGZVCO-DEDYPNTBSA-N	373.250	3.707	50	40	FHGB	
N#C/C(=C\c1cc(Br)ccc1Cc1cccc(F)c1)C(N)=O	408876607	PHRPZZSABPAINT-RIYZIHGNSA-N	359.198	3.571	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2cc3c(cc2Cl)OCO3)cc1	7068922	HHSBIAOCISXVPR-WUXMJOGZSA-N	356.765	3.623	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)[C@H](C)Oc2ccccc2Br)cc1	994253	IGQQNPFAPDYVIC-MDBUFAAASA-N	361.239	3.675	50	40	FHGB	
O=C(COc1ccccc1Cl)N/N=C\c1ccc(N2CCCCC2)cc1	408959507	ABUZPFGJAZSGSU-HMAPJEAMSA-N	371.868	3.859	50	40	FHGB	
Cc1cccc(OCC(=O)N/N=C\c2cc(Cl)cc(Cl)c2O)c1C	13945615	HGNBFBAABCZUML-ZBKNUEDVSA-N	367.232	3.845	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc(SC#N)c1O	409041624	KEFUHUUWIJGKDD-AUWJEWJLSA-N	365.414	3.828	50	40	FHGB	
Cc1ccc(CN(C)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	9793845	VKASITSAWBXSDR-AWEZNQCLSA-N	371.506	3.668	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=C(\C#N)C(=O)NC1CCCCC1	409003142	YFXPKYUCHBZVCS-FOWTUZBSSA-N	370.453	3.797	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc(OC)c1O	408816441	YUCGOIOCQMJLLR-ODUXRLQMSA-N	354.450	3.731	50	40	FHGB	
COc1cc(C)c(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1C(C)C	33660383	ZCJGSSHJXXMBSU-MTJSOVHGSA-N	369.421	3.728	50	40	FHGB	
N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3/C[C@H]4C=CC[C@H]34)cc2)cc1	96708555	HXGHNTSONLLCSQ-LVHDKLLUSA-N	357.413	3.672	50	40	FHGB	
O=C(CCC(=O)Nc1cccc(Cl)c1)N/N=C/c1ccccc1Cl	3083923	JNTVBYIOVXNNDD-RGVLZGJSSA-N	364.232	3.862	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Cl)cc1Cl)=N\NC(=O)c1ccco1	100775016	WZKYPXHZDYACAD-DJKKODMXSA-N	354.193	3.721	50	40	FHGB	
O=C(N[C@@H](CSc1ccccc1)C(=O)CCl)OCc1ccccc1	75629699	GHOXYLYITXKSDS-INIZCTEOSA-N	363.866	3.882	50	40	FHGB	in-vitro
CCCOc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1OCC	7893652	ZNOBQHALKWCZBC-DEDYPNTBSA-N	371.393	3.546	50	40	FHGB	
CCN(CC)C(=O)C1(P(=O)(c2ccccc2)c2ccccc2)CCC1	721340	MGWNSTPKSZCDFT-UHFFFAOYSA-N	355.418	3.792	50	40	FHGB	
COc1ccc(-c2ccc(/C=N/NC(=O)c3ccncc3)o2)cc1Cl	3106937	POLFYRMOLHXYJI-SRZZPIQSSA-N	355.781	3.768	50	40	FHGB	
Cc1cc(=O)oc(C)c1C(=O)NNc1c(Cl)cc(Cl)cc1Cl	2296560	UBNHXYVFVOYGEK-UHFFFAOYSA-N	361.612	3.974	50	40	FHGB	
COc1ccc(C)cc1NC(=O)C/C(C)=N/NC(=O)c1ccc(Cl)cc1	4410083	DRBHPFFNDFEYJW-LPYMAVHISA-N	373.840	3.792	50	40	FHGB	
COc1ccc(/C=N\NC(=O)COc2ccc(C(C)(C)C)cc2C)cc1	33341682	NFAYSRMFBCEVHV-XKZIYDEJSA-N	354.450	3.830	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Br)ccc1O)c1ccc(C)c(C)c1	5684078	FLHSCPOIMRVNHC-XDHOZWIPSA-N	361.239	3.926	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@@H]2CC=CCC2)cc(OCC)c1OCC	695257	DFBYNJYNYSHIIE-HFITWMCCSA-N	360.454	3.955	50	40	FHGB	
COC(=O)[C@]12CC[C@@H](C1)C(C)(C)[C@]2(Br)CBr	100749321	XXGJBUQJCZYXKR-KPXOXKRLSA-N	354.082	3.514	50	40	FHGB	
Cc1ccc(O)c(/C=N/NC(=O)COc2ccc(Cl)cc2Cl)c1	3027325	UTDBIXSYPJLORU-UFWORHAWSA-N	353.205	3.537	50	40	FHGB	
C/C(=N\NC(=O)CSCc1cc(C)cc(C)c1)c1ccc([N+](=O)[O-])cc1	4482305	RKWXPXOJRWFQHQ-HMMYKYKNSA-N	371.462	3.985	50	40	FHGB	
CCCCOc1ccc(/C=C(\C#N)C(=O)NCCOC)c2ccccc12	408806124	AKMPAXJAZIOVDD-SAPNQHFASA-N	352.434	3.688	50	40	FHGB	
COc1ccc(Br)cc1/C=C(\C#N)C(=O)Nc1ccc(O)cc1	408797696	SZCJPNFTMCPQMP-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(OC)cc3OC)cc2c1	409183616	DXMWGYPKRXHEDE-MTJSOVHGSA-N	368.389	3.613	50	40	FHGB	
O=S(=O)(c1ccccc1)n1c(CBr)cc2ccccc21	2506126	SYYPBRKVYRCLJS-UHFFFAOYSA-N	350.237	3.773	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccoc2C)ccc1OCc1ccccc1	1244828	PAANOHMGZUTJTI-LPYMAVHISA-N	364.401	3.940	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)cc2)o1)[C@@H](O)c1ccccc1	1299318	YKOSGJAHVYYIMQ-IUOVYFEOSA-N	354.793	3.784	50	40	FHGB	
CCc1c(/C(C)=N/NC(=O)Cc2nc3ccccc3n2C)oc2ccccc12	58664528	KIWYARHDCKPTFR-ZVHZXABRSA-N	374.444	3.965	50	40	FHGB	
COC(=O)N/N=C/c1c(C)n(CCOc2ccccc2)c2ccccc12	4091855	ILAFOIJIJKLQJT-KGENOOAVSA-N	351.406	3.719	50	40	FHGB	
C[C@]12CCCC[C@@H]1[C@H]2C(=O)N/N=C\c1ccc(-c2cccc(C(=O)O)c2)o1	408718724	BUZLFKLDRLRPRL-QWXHHCODSA-N	366.417	3.921	50	40	FHGB	
CCc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)OCCOC)c1C	408968342	VREGRJRZHVRFLM-CPNJWEJPSA-N	352.434	3.753	50	40	FHGB	
O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc(Cl)cc1	6286643	NCAKKDXLCNIGDA-LSFURLLWSA-N	355.747	3.921	50	40	FHGB	
CCCCSC1=C(C#N)[C@@H](c2ccccc2OCC)[C@@H](C#N)C(=O)N1	9320051	OEFOPYWMSATOTR-PBHICJAKSA-N	355.463	3.707	50	40	FHGB	
CCCc1n[nH]c2c1[C@@H](c1cc(Cl)cc(Cl)c1O)C(C#N)=C(N)O2	1438058	NFPWWZIRTMIQKT-LBPRGKRZSA-N	365.220	3.593	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)c1cccnc1	7931563	GEBPLNRIUWUMRQ-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
CC1(C)CC([PH](c2ccccc2)(c2ccccc2)c2ccccc2)=NN1	104181688	PYQBNNABTOKTIS-UHFFFAOYSA-N	360.441	3.798	50	40	FHGB	
NC(=O)c1sc(=S)n(-c2ccccc2)c1/N=C(\O)CCCCl	53944186	BMQPEVIEHUATAV-UHFFFAOYSA-N	355.872	3.974	50	40	FHGB	
NP(Br)(c1ccccc1)(c1ccccc1)c1ccccc1	104074224	ULPYCPLTHVWYER-UHFFFAOYSA-N	358.219	3.700	50	40	FHGB	
N#C/C(=C/c1cccn1-c1ccccc1)C(=O)Nc1cccc(C(=O)O)c1	408544866	YBEAIICZYHZQCE-SSZFMOIBSA-N	357.369	3.721	50	40	FHGB	
CC(C)COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1	409185713	OXUIIOILVWJDRD-SRZZPIQSSA-N	360.841	3.904	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CCC[C@H]2C)[C@H]1c1ccccc1	35193578	BECKUTVKDLBRRL-WTGRHJARSA-N	361.445	3.710	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(O)O2	107738328	FTFRMJBDNRUHCV-SFHVURJKSA-N	374.356	3.906	50	40	FHGB	
C/C(=N\NC(=O)CCSc1ccc(C)cc1)c1ccc2c(c1)OCCO2	4703688	MFMIQJZPMOAHHG-RCCKNPSSSA-N	370.474	3.789	50	40	FHGB	
COC(=O)COc1cccc(/C=C(\C#N)c2nc3cc(C)c(C)cc3[nH]2)c1	408608451	WIWCOZRDWHCRJP-CXUHLZMHSA-N	361.401	3.796	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2ccc(O)c([N+](=O)[O-])c2)cc1Cl	408735314	QJEWMQLOOLNWRG-WUXMJOGZSA-N	357.753	3.808	50	40	FHGB	
CC(C)(C)c1ccc([C@H]2C[C@H]2C(=O)N/N=C\c2ccc3c(c2)OCO3)cc1	30738480	LGKQQCGYSWJFTD-AWLIUGMOSA-N	364.445	3.967	50	40	FHGB	
C=CCc1ccccc1OCC(=O)N/N=C/c1c(O)ccc2ccccc12	3169153	XGJWIVRFWQGEEZ-OEAKJJBVSA-N	360.413	3.803	50	40	FHGB	
CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC)cc2)cc1	3308750	KKOGPFMRRJHQPX-GHRIWEEISA-N	364.401	3.808	50	40	FHGB	
C/C(CC(=O)Nc1ccccn1)=N/NC(=O)c1ccc(Cl)cc1Cl	101156027	NHAUSVMHMVQIJM-FBHDLOMBSA-N	365.220	3.523	50	40	FHGB	
COc1cc(/C=N/NC(=O)[C@H](C)Sc2ccc(Cl)cc2)ccc1O	59473808	FNCAFSHQPCXJIW-VSMYLPJWSA-N	364.854	3.685	50	40	FHGB	
CC(=O)C1=NN(c2ccc(Cl)cc2)C(N)=C(C#N)[C@@H]1c1ccccc1	35244689	YPLHAPLMYPBRKA-KRWDZBQOSA-N	350.809	3.583	50	40	FHGB	
COc1ccc(NC(=O)c2ccccc2C[C@@H](Br)C#N)cc1	5235376	ADXBMOJJYZEEJO-CYBMUJFWSA-N	359.223	3.777	50	40	FHGB	
Cc1cccc(NNC(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)c1	97212440	HIJLHAQCPGNMGB-UHFFFAOYSA-N	362.311	3.821	50	40	FHGB	
CCN(CC)c1ccc(NC(=O)/C(C#N)=C\c2cccc([N+](=O)[O-])c2)cc1	408780865	MGPPYWMCTDAVDU-VBKFSLOCSA-N	364.405	3.987	50	40	FHGB	
O=C(CCSc1ccccc1)N/N=C/c1cc([N+](=O)[O-])ccc1Cl	408831461	QOYQRZXWHGNGPC-WOJGMQOQSA-N	363.826	3.881	50	40	FHGB	
C#C/C=C\C[C@@H](OC(C)=O)[C@H]1CC=CC[C@@H](Br)[C@@H](CC)O1	33848978	ZFYWONYUPVGTQJ-IIWYLINPSA-N	355.272	3.775	50	40	FHGB	
COc1cc(Br)c(Br)c(/C=C(\C)C=O)c1O	17072648	GXYOOQVNSLMEJM-ZZXKWVIFSA-N	350.006	3.528	50	40	FHGB	
O=P(C(=S)N[C@H]1C[C@@H]2C=C[C@H]1C2)(c1ccccc1)c1ccccc1	1766787	FGUUHJBPQVYOOT-GJYPPUQNSA-N	353.427	3.840	50	40	FHGB	
CC1=CC(=O)[C@@](Cl)(C(C)C)[C@H](Cl)/C1=N/S(=O)(=O)c1ccccc1	5602486	AMXLKTIEMKDGJB-AKOCJZKKSA-N	374.289	3.586	50	40	FHGB	
C=CCOc1c(Cl)cc(/C=N/NC(=O)c2ccccc2C)cc1OC	9201994	VKMKZIKRLXHILH-CIAFOILYSA-N	358.825	3.986	50	40	FHGB	
Nc1ccccc1C(=O)N/N=C/c1cccc(OCc2ccc(F)cc2)c1	82375283	SXUDUTWYLBQVHM-ZMOGYAJESA-N	363.392	3.751	50	40	FHGB	
CC(C)COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1	408891490	RJFFMXNPAYMFPA-GZTJUZNOSA-N	364.401	3.965	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)c2ccccc2C(F)(F)F)cc1OC	408771264	FGOLGINAYKNGBG-JJFYIABZSA-N	366.339	3.877	50	40	FHGB	
Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]	3175082	LDUQZRMWVSGXCL-NGZBARDMSA-N	369.421	3.944	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1	33655534	VOODGLJYDNJFPI-YBFXNURJSA-N	369.402	3.972	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1OC	59473772	HGHNXWLPUGJOIF-RCCKNPSSSA-N	370.474	3.893	50	40	FHGB	
Cc1nc2ccccn2c1C(=O)N/N=C/c1ccc(-c2ccc(F)cc2)o1	6566946	SKSWHQWLPZKLNM-WSDLNYQXSA-N	362.364	3.806	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(-c3cc([N+](=O)[O-])ccc3C)o2)o1	408727213	XPYNMXNKJRVEAJ-VXLYETTFSA-N	353.334	3.829	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2Cl)cc(OC)c1OC	16692629	JHJAJYKPRSGGOG-JYRVWZFOSA-N	372.808	3.911	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)NCCc2ccccc2)cc1OCC	6949272	XYKGIIDPAHSVMX-XMHGGMMESA-N	364.445	3.750	50	40	FHGB	
COc1cc(/C=N/NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)ccc1O	59473809	FNCAFSHQPCXJIW-VURRPDKYSA-N	364.854	3.685	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)CNc2ccccc2)c(OC(C)C)c1	409377459	IHRXKWNICRDRCG-YDZHTSKRSA-N	369.465	3.823	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@H]1CCCc2ccccc21	12852897	SFANKNJOWUCNOK-SXYIGIQMSA-N	366.505	3.860	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1	4672897	BZMMNOVFBZMSKM-KPKJPENVSA-N	358.781	3.730	50	40	FHGB	
O=C(N/N=C\c1ccccc1O)c1ccc2c(c1)CN(c1ccccc1)C2	83329163	VGKPABYSHBWHNL-QRVIBDJDSA-N	357.413	3.676	50	40	FHGB	
COc1ccc(NC(=O)C/C(C)=N/NC(=O)C2CCCCC2)cc1Cl	101424297	FVMVYAIKYCXZDA-CIAFOILYSA-N	365.861	3.750	50	40	FHGB	
C[C@]1(Br)C[P@](=O)(c2ccccc2)C[C@@H]1Br	4777438	WLMNWAODWCNVJT-PGUXBMHVSA-N	352.006	3.606	50	40	FHGB	
COC(=O)[C@@]12CC[C@H](C1)C(C)(C)[C@]2(Br)CBr	100749323	XXGJBUQJCZYXKR-GGZOMVNGSA-N	354.082	3.514	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2cccc(NC(C)=O)c2)cc1C(C)C	107802293	ZGWPHSRUHPJBMW-WSDLNYQXSA-N	367.449	3.849	50	40	FHGB	
COc1cc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)cc(OC)c1OC	408565870	BUXCCVXCJZBFGT-SDQBBNPISA-N	353.353	3.792	50	40	FHGB	
COc1cc(/C=C(\C#N)Cn2cnc3ccccc32)c([N+](=O)[O-])cc1OC	408691836	SXCDQFVGLAEGKN-NTUHNPAUSA-N	364.361	3.569	50	40	FHGB	
O=C(CCSc1ccc(Cl)cc1)N/N=C/c1ccc(C(=O)O)cc1	408785539	HAHQWKROGZGMIA-YBFXNURJSA-N	362.838	3.671	50	40	FHGB	
CCS(=O)(=O)[C@H](Br)[C@H](O)c1ccc(-c2ccccc2)cc1	96519080	APQWIEYFZHXVEA-CVEARBPZSA-N	369.280	3.543	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2Cl)cc([N+](=O)[O-])c1O	36435354	MTEJTYKSFLASJL-IZZDOVSWSA-N	373.752	3.508	50	40	FHGB	
C=CCSC1=C(C#N)[C@@H](c2ccc(Cl)cc2)[C@@H](C(=O)OC)C(O)=N1	9089196	QZNHHLLQAANDLC-ZIAGYGMSSA-N	362.838	3.837	50	40	FHGB	
C[C@H](Cl)C(=O)Nc1ccc(C(=O)Nc2nnc(-c3ccccc3)o2)cc1	39765610	YSDOAGKVNOYKQY-NSHDSACASA-N	370.796	3.555	50	40	FHGB	
COc1ccc(S(=O)(=O)/C(C#N)=C/C2=Cc3ccccc3O[C@@H]2C)cc1	80345332	WSBNPEDIVUGSDG-ONDHQXCVSA-N	367.426	3.741	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C/c1ccc(N2CCCCC2)cc1	6407064	GAOPIUBPNSHYTK-HYARGMPZSA-N	371.868	3.859	50	40	FHGB	
Nc1ccc(N(CCCl)CCN(CCCl)c2ccc(N)cc2)cc1	4880468	QSZGBNISLKRTEJ-UHFFFAOYSA-N	367.324	3.642	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)NNC(=S)Nc1ccccc1	3135768	CPPVLWAKCMWANE-NSHDSACASA-N	365.911	3.838	50	40	FHGB	
CC[C@H]1CCC/C1=N\NC(=O)c1ccccc1I	955305	CXVLOKWSDYUBNO-CDSOTZFASA-N	356.207	3.587	50	40	FHGB	
O=C(N/N=C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1-n1cccc1	3304000	DHSGLANRWYEIOW-WXYKTORPSA-N	360.373	3.815	50	40	FHGB	
N#CCC[C@@H]1CCCC/C1=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1	408719369	COBJWPPSCTUEBW-WATITHJCSA-N	374.466	3.794	50	40	FHGB	
COc1cc(Br)c(/C=C(\C#N)C(=O)c2ccccc2)cc1O	7058187	DRCDNARVMONBKJ-NTUHNPAUSA-N	358.191	3.953	50	40	FHGB	
CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)cc1	5051914	MVWBBFRPVDXVFP-OAHLLOKOSA-N	352.438	3.714	50	40	FHGB	
CC1(C)COc2ccc(/C=C(\C#N)C(=O)NC3CCCCC3)cc2OC1	225369713	HYEYZJJTLXKGTO-MHWRWJLKSA-N	354.450	3.840	50	40	FHGB	
N#C/C(=C\c1cccc(C#N)c1)c1nc2sc3c(c2c(=O)[nH]1)CCCC3	14178120	WLVCVZOAFHUUAN-NTEUORMPSA-N	358.426	3.799	50	40	FHGB	
COc1ccc([C@@H]2CC(=O)N3CN(CCC(C)C)CSC3=C2C#N)cc1	20348004	HHAFSVPXVNFCTE-KRWDZBQOSA-N	371.506	3.756	50	40	FHGB	
COc1cccc(/C=N/NC(C)=O)c1OCCCOc1ccc(C)c(C)c1	27837008	FFJLQBLKDDIZNR-HYARGMPZSA-N	370.449	3.630	50	40	FHGB	
CCn1c(C)cc(/C=N\NC(=O)CSc2nc3ccccc3s2)c1C	409066209	BBZPTOYWWMTEIJ-GRSHGNNSSA-N	372.519	3.977	50	40	FHGB	
CC(C)N(C(=O)OCc1ccccc1)C1CCC(NC(=O)CCl)CC1	79412057	UWXDOTWCMIZPEQ-UHFFFAOYSA-N	366.889	3.700	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)cc1OC	903640	PTEZAVGTCJDEJW-VXLYETTFSA-N	364.854	3.600	50	40	FHGB	
COc1cc(OC)cc(C(=O)NNc2nc3c(Cl)cccc3s2)c1	4121356	RWXBWPRFXBKHRV-UHFFFAOYSA-N	363.826	3.724	50	40	FHGB	
N#C/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Br)c1	108210496	HWCBGQJVCPCCKN-GHXNOFRVSA-N	372.178	3.903	50	40	FHGB	
O=C(CCC(=O)Nc1ccccc1Cl)N/N=C/c1c[nH]c2ccccc12	2100367	DXDBYMGKDVAENI-WSDLNYQXSA-N	368.824	3.690	50	40	FHGB	
CC(C)c1[nH]nc2c1[C@@H](c1ccc(Br)s1)C(C#N)=C(N)O2	8382670	OXUJJXWHMVUTDV-SNVBAGLBSA-N	365.256	3.575	50	40	FHGB	
O=C(COc1ccc(C2CCCCC2)cc1)NNC(=O)c1cccs1	32118995	WTPLNPAVIZOSDG-UHFFFAOYSA-N	358.463	3.636	50	40	FHGB	
O=C(N/N=C\c1ccc(O)cc1)c1cc2cc(Br)ccc2o1	96499123	FMSUDVCCSCIABJ-NVMNQCDNSA-N	359.179	3.665	50	40	FHGB	
Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2Cl)c1	3127154	CBASVFHHISSZBX-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)CCC2CCCC2)c(C)n1-c1ccccc1	8027129	ORFYMXFFFJJFNB-UHFFFAOYSA-N	353.466	3.826	50	40	FHGB	
C/C(CC(=O)NC(C)(C)C)=N\NC(=O)C(c1ccccc1)c1ccccc1	100922327	GMOQZBDQXVHLHK-LFVJCYFKSA-N	365.477	3.615	50	40	FHGB	
CCC[C@H](C(=O)NNC(=O)c1cc(-c2ccccc2)on1)c1ccccc1	14141697	XPFIESZIGPUBAX-KRWDZBQOSA-N	363.417	3.687	50	40	FHGB	
CC(C)c1[nH]nc2c1[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2	5633486	HKZCMLVDYXMLNQ-LBPRGKRZSA-N	359.227	3.514	50	40	FHGB	
CC(=O)OCC(=O)N(/N=C/c1ccccc1)c1cccc(C(F)(F)F)c1	14754003	UCPXDAVPEQTOCW-SSDVNMTOSA-N	364.323	3.636	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)ccc1OC	15222065	HNGWYTBBQXDXFQ-PTNGSMBKSA-N	352.390	3.648	50	40	FHGB	
CCCc1nc2c(o1)NC(N)=C(C#N)[C@H]2c1ccc(OC(C)C)c(OC)c1	1070298	ZETPPKYKZKQWBS-QGZVFWFLSA-N	368.437	3.674	50	40	FHGB	
C=CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)N[C@H](C)CC	408814123	QFHMZTSCRRYXJG-ZMTLZGASSA-N	363.255	3.836	50	40	FHGB	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)c1ccccc1	6251993	CMWSPGHQWGWFBZ-UHFFFAOYSA-N	367.232	3.614	50	40	FHGB	
CC(=O)N/N=C/c1cc(Br)ccc1OCc1cccc(F)c1	409009458	ACBRIMSKYMTVJW-DJKKODMXSA-N	365.202	3.637	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(N3Cc4ccccc4C3)cc2)cc1	408734582	YSWUFBXIJAFKNA-ZVHZXABRSA-N	371.440	3.979	50	40	FHGB	
Cc1cc(-c2ccc(/C=N/NC(=O)c3ccncc3)o2)c([N+](=O)[O-])cc1C	16268052	FUUIGKHJPIIKRS-SRZZPIQSSA-N	364.361	3.631	50	40	FHGB	
O=[N+]([O-])c1ccc([C@@H](O)P(=O)(c2ccccc2)c2ccccc2)s1	2577681	UBYKCMFAADNPNM-KRWDZBQOSA-N	359.343	3.661	50	40	FHGB	
C/C(=N\NC(=O)COc1cc(Cl)c(Cl)cc1Cl)c1ccccn1	4646717	BRFFGBMMHYJHOI-AWQFTUOYSA-N	372.639	3.961	50	40	FHGB	
C/C(=N\NC(=O)c1cc2c(s1)CC[C@@H](C)C2)c1ccc([N+](=O)[O-])cc1	6052009	NMQNOVKMKQEHDR-FLFDVBNFSA-N	357.435	3.935	50	40	FHGB	
N#CCOc1ccc(/C=N/NC(=O)CSCc2ccc(Cl)cc2)cc1	5205579	IXBOMQHVGJVORI-SRZZPIQSSA-N	373.865	3.626	50	40	FHGB	
N#C/C(=C\c1cc(Cl)ccc1O)c1nn(-c2ccccc2)c(N)c1C#N	408721306	OHUQPPYZJFONAL-MDWZMJQESA-N	361.792	3.749	50	40	FHGB	
COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N\NC(=O)OC(C)(C)C)o1	15979546	DVVOUJGOZUTTGK-ZDLGFXPLSA-N	361.354	3.722	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)cc1OC	3140457	ILXCJVBYXDKESE-LPYMAVHISA-N	370.449	3.530	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)c(O)c1	4749218	WAGQXKPODTVAJQ-CIAFOILYSA-N	359.857	3.964	50	40	FHGB	
O=C(NNC(=O)c1[nH]c2ccc(F)cc2c1Cl)c1ccc(Cl)cc1	44847566	LGIJMHDODCQPFH-UHFFFAOYSA-N	366.179	3.689	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc2ccccc2c1Br)C1CC1	4523818	QWBOZCDQIHMFSJ-YBFXNURJSA-N	361.239	3.883	50	40	FHGB	
Cc1nn(Cc2c(Cl)cccc2Cl)c(Cl)c1/C=C(\C#N)C(N)=O	7154665	SIOULFZOTQTWSA-WEVVVXLNSA-N	369.639	3.592	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)CN2CCC[C@@H]2c2cccs2)Nc2ccccc21	101233703	VDGAYADRNWYDFZ-HDAKKWKLSA-N	364.474	3.751	50	40	FHGB	
CCc1ccc(OCC(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1	4591699	BXHJJTDVOGTFCT-UHFFFAOYSA-N	374.440	3.756	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1OC	408549157	QAPWXIRDNZPTQA-HYARGMPZSA-N	363.417	3.567	50	40	FHGB	
CCOc1cc(C(=O)N/N=C\c2cc(Cl)ccc2OC)ccc1OC	6354983	OFDOEXMCNINTNX-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
COc1cc(Cl)cc(Cl)c1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2	659327	LKACDGFFSMODMQ-AWEZNQCLSA-N	365.216	3.817	50	40	FHGB	
O=C(Cc1cccc2ccccc12)NNC(=O)Nc1cccc(Cl)c1	695829	TYOWAGYZQSHKLQ-UHFFFAOYSA-N	353.809	3.889	50	40	FHGB	
N#C/C(=C\c1ccc(O)cc1O)C(=O)Nc1ccc(SC(F)F)cc1	3185266	JGTXCTQMRILPAD-YRNVUSSQSA-N	362.357	3.958	50	40	FHGB	
Cc1ccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccccc3O)cc2)cc1	58900669	VQJKPEWIDKKARH-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
COC(=O)N/N=C/c1cc(Cl)c(OCc2ccccc2F)c(OC)c1	4837337	JQJSVZFSXUOQJU-AWQFTUOYSA-N	366.776	3.757	50	40	FHGB	
O=C(CCCl)N1N=C(c2ccccc2)C[C@@H]1c1cccc([N+](=O)[O-])c1	4897597	PWIPDJIQKNQUSA-QGZVFWFLSA-N	357.797	3.901	50	40	FHGB	
N#C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	4953672	HOSCSTANRQICEK-YRNVUSSQSA-N	372.724	3.702	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2Br)ccc1O	1094413	JICMZDQTRIQDSC-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
Cc1cccc(NCC(=O)N/N=C/C(Br)=C/c2ccccc2)c1	3148287	UBBXAIMIULNESP-OQBHSHHWSA-N	372.266	3.945	50	40	FHGB	
CCCCCC(=O)Nc1ccc(C(=O)N/N=C/c2ccccc2O)cc1	3140152	GSDUOQJASZEROD-KGENOOAVSA-N	353.422	3.675	50	40	FHGB	
N#C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Br)c1	108208028	QUURUGQPKFPQDX-WQLSENKSSA-N	372.178	3.903	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(Br)s2)c(C)c1	20194910	KVEWZEWNILGDFF-RQZCQDPDSA-N	351.269	3.820	50	40	FHGB	
O=C(NN=C1C2CC3CC(C2)CC1C3)C(O)(c1ccccc1)c1ccccc1	4156257	AEJSVVGIYXYMDR-UHFFFAOYSA-N	374.484	3.851	50	40	FHGB	
C/C(=N\NC(=O)CCC(=O)NCc1ccccc1)c1ccc2ccccc2c1	4523915	LZFUPFYOCJFUCF-KOEQRZSOSA-N	373.456	3.777	50	40	FHGB	
CCOc1cc(Cl)c(Cl)c(/C=N\NC(=O)c2ccc(C)nc2)c1O	4723920	MZDPIVBYAUHHQE-ZBKNUEDVSA-N	368.220	3.565	50	40	FHGB	
Cc1cccc(C(O)(C(=O)NN=C2CCCCC2)c2cccc(C)c2)c1	1501576	WAMNFGWDXLREQG-UHFFFAOYSA-N	350.462	3.976	50	40	FHGB	
CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2)cc1	58883450	BFILFJGSTKYPGL-CIAFOILYSA-N	357.841	3.726	50	40	FHGB	
O=C(COc1ccccc1Cl)N/N=C\c1cccc(Br)c1	28616246	GWXYZSGVDMQRJV-NVMNQCDNSA-N	367.630	3.632	50	40	FHGB	
COc1ccc(C/C(C#N)=C\N2CCN(c3ccccc3F)CC2)cc1	6476158	DQZXEBGROPGDJI-FBMGVBCBSA-N	351.425	3.606	50	40	FHGB	
O=C(NN=C1CCC(c2ccccc2)CC1)[C@@H]1COc2ccccc2O1	4863657	OKQWVABUQLHWQJ-FZCLLLDFSA-N	350.418	3.656	50	40	FHGB	
CCOC(=O)c1cc(-c2ccc(/C=C(\C#N)C(N)=S)o2)ccc1Cl	34687563	YATGMHDILOKTRR-YRNVUSSQSA-N	360.822	3.970	50	40	FHGB	
O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(Cl)cc1Cl	33660490	UASGVZJPMSXNLL-NVMNQCDNSA-N	352.177	3.594	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)ccc1OC	44028848	IYUUDDJLOYNDJE-OVCLIPMQSA-N	351.358	3.612	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2Cl)c(C)o1	3194350	LQBOBZQIVVABSG-KEBDBYFISA-N	356.813	3.808	50	40	FHGB	
O=[N+]([O-])c1ccc([P@@](=O)(Cc2ccccc2)c2ccccc2O)cc1	2248777	XOZATYLLJKPRJJ-VWLOTQADSA-N	353.314	3.815	50	40	FHGB	
Cc1cc(Cl)ccc1NC(=O)/C(C#N)=C/c1ccc(O)c([N+](=O)[O-])c1	408862450	JPZZOUJPGIABPZ-KPKJPENVSA-N	357.753	3.808	50	40	FHGB	
Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(N(C)C)c(Br)c2)n1	409380057	GNIPUVQGQRALSL-RIYZIHGNSA-N	373.254	3.576	50	40	FHGB	
CCCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(C(=O)OC)cc1	40948881	DBDBFPZDIBMGSP-GHRIWEEISA-N	364.401	3.808	50	40	FHGB	
N#C/C(=C/c1c(F)cccc1Cl)C(=O)N1CCN(c2ccccc2)CC1	254979764	LEVYIHZSICVHLX-SQFISAMPSA-N	369.827	3.735	50	40	FHGB	
O=C(N/N=C/c1cccc(OCc2ccc([N+](=O)[O-])cc2)c1)c1ccco1	409368628	FMFMQQPMULJBBZ-UDWIEESQSA-N	365.345	3.531	50	40	FHGB	
COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1cccc(OC)c1OC	408800474	MSDOWCPVNFAQJT-RVDMUPIBSA-N	352.390	3.567	50	40	FHGB	
CCC[C@](C)(OCC)C(=O)Nc1ccc(OCCBr)cc1	225692333	SARVTDYTMJSNJG-INIZCTEOSA-N	358.276	3.994	50	40	FHGB	
CCCCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)OC)o2)cc1	252499774	SECAPPKDTQMUEB-VBKFSLOCSA-N	353.374	3.983	50	40	FHGB	
COC(=O)c1ccccc1-c1ccc(/C=C(/C#N)C(=O)NC2CCCC2)o1	208309678	ZFPLBEAOLCYTKO-OWBHPGMISA-N	364.401	3.699	50	40	FHGB	
COc1cccc(/C=N/NC(=O)CCC(=O)Nc2cccc(Cl)c2C)c1	3068014	FJKLDZHHWPDJKB-CIAFOILYSA-N	373.840	3.526	50	40	FHGB	
COC(=O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccccc3C)o2)c1	9200990	ZMILMEIPQQFSNK-LPYMAVHISA-N	362.385	3.806	50	40	FHGB	
CC(=O)Nc1ccc(/C=C(\C#N)C(=O)NCc2ccc(Cl)cc2)cc1	3257888	JWIOPERRVLPTDK-MHWRWJLKSA-N	353.809	3.522	50	40	FHGB	
Cc1cc(N2CCCCC2)ccc1/C=N/NC(=O)c1ccc(C#N)cc1F	4106978	KJWJBSQJRHCVDG-ZVHZXABRSA-N	364.424	3.760	50	40	FHGB	
N#C/C(=C\c1c(OCc2cccc([N+](=O)[O-])c2)ccc2ccccc12)C(N)=O	408865708	DOLKRCFXWHVUPP-LFIBNONCSA-N	373.368	3.719	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C1/Nc2cccc3cccc1c23	4811886	KXHYZLAMLOGCTF-UHFFFAOYSA-N	351.793	3.776	50	40	FHGB	
CC(C)Oc1cccc(NC(=O)/C(C#N)=C\c2ccc(O)c([N+](=O)[O-])c2)c1	408783840	NQSLKRGTKWKLAO-ZSOIEALJSA-N	367.361	3.633	50	40	FHGB	
CC(C)c1[nH]nc2c1[C@H](c1ccc(Br)s1)C(C#N)=C(N)O2	8382671	OXUJJXWHMVUTDV-JTQLQIEISA-N	365.256	3.575	50	40	FHGB	
COc1ccc(NC(=S)NNC(=O)c2ccc(Cl)c(Cl)c2)cc1	59449431	YPDBFMYMIAGKLA-UHFFFAOYSA-N	370.261	3.633	50	40	FHGB	
C=CCc1cc(/C=N/NC(=O)c2ccc(C)cc2OC)cc(OCC)c1O	59248677	QEGXNQOSWMHBNU-LPYMAVHISA-N	368.433	3.600	50	40	FHGB	
O=P(c1ccccc1)(c1ccccc1)[C@@H](c1ccco1)N1CCOCC1	17609738	GRTJLNVTZHJJFL-NRFANRHFSA-N	367.385	3.625	50	40	FHGB	
CCCOc1ccc2ccccc2c1/C=N/NC(=O)[C@@H](O)c1ccccc1	409268465	UASJXCJZRZDIRF-VQYZLWMVSA-N	362.429	3.812	50	40	FHGB	
COc1cccc(-c2n[nH]c3c2[C@H](c2ccc(C)s2)C(C#N)=C(N)O3)c1	5164202	BMSSLNYNESMEPX-HNNXBMFYSA-N	364.430	3.673	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc(Cl)c(Cl)c2)s1)C(=O)NC(N)=O	32831105	MTNQXPOFSJWHMJ-WEVVVXLNSA-N	366.229	3.824	50	40	FHGB	
O=C(NNC(=O)c1ccncc1)Nc1ccc(/N=N\c2ccccc2)cc1	102844342	YYLHEUPZZJYOAG-FCQUAONHSA-N	360.377	3.964	50	40	FHGB	
COc1ccccc1OCC(=O)NNc1c2ccccc2nc2ccccc12	5478692	MPXUJOKKINUZJP-UHFFFAOYSA-N	373.412	3.919	50	40	FHGB	
COc1ccc(/C=C/C(=O)N/N=C/c2ccc(Br)cc2)cc1	409062608	XODKBXRQRQTGQY-VIWQMLNCSA-N	359.223	3.621	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1ccc(C(C)C)cc1	59516280	BSURTZPSCMMUPD-SRZZPIQSSA-N	373.840	3.561	50	40	FHGB	
COc1ccc(NC(=O)N/N=C\c2ccc(N3CCCC3)cc2C)cc1	408960065	IXQHSLZTKJKCEC-STZFKDTASA-N	352.438	3.759	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2cccc(Br)c2)cc1	7068639	NDAVNZRNLDUQBA-DHDCSXOGSA-N	371.234	3.681	50	40	FHGB	
N#CC(/N=C/c1cccs1)=C(\C#N)NCc1sc(Cl)nc1Cl	2151616	ITRLGIDQHGOELM-PJCLXQRGSA-N	368.274	3.979	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(Cl)c2)cc1	7869234	FWRHRZOOYQTTDK-CIAFOILYSA-N	373.840	3.526	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1	1051678	MYMJRXIOIPKQRC-FYJGNVAPSA-N	359.857	3.715	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)c2cc(C)nc3ccccc23)c(OC)c1	4878464	ULMNKVGRCCWDTC-OEAKJJBVSA-N	363.417	3.714	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2OC)cc1	6947285	QNOAQYOEKQZSOW-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
CCNC(=O)/C(C#N)=C/c1cn(Cc2ccccc2C#N)c2ccccc12	408820840	ZKRPPROECKBPIW-WOJGMQOQSA-N	354.413	3.604	50	40	FHGB	
Cc1c(C(=O)O)cccc1-c1ccc(/C=C(/C#N)C(=O)NC2CCCC2)o1	96476345	VQYWFLGVOJSQEN-KAMYIIQDSA-N	364.401	3.919	50	40	FHGB	
O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc(F)cc1F	6286679	BAHYJQTUBFWAFK-LIMNOBDPSA-N	357.282	3.546	50	40	FHGB	
CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC=C(C#N)C#N	7066928	NUCKONXGQZWKRE-UHFFFAOYSA-N	353.403	3.943	50	40	FHGB	
Cc1cc(C)c(NC(=O)CCC(=O)N/N=C/c2ccc(F)cc2)c(C)c1	3082692	IUXASXQZDFWSKR-WSDLNYQXSA-N	355.413	3.620	50	40	FHGB	
Cc1ccccc1[C@H]1CC(=O)N2CN(Cc3ccco3)CSC2=C1C#N	20237965	CRVWJPAAJIIWMS-QGZVFWFLSA-N	365.458	3.803	50	40	FHGB	
N#C/C(=C\c1ccc(N2CCOCC2)cc1)C(=O)c1c[nH]c2ccccc12	28424219	APIKHYMXXDVRGX-GHRIWEEISA-N	357.413	3.794	50	40	FHGB	
COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OC(C)C)cc2)cc1	408801774	VSIGOVGLCZCQAF-SFQUDFHCSA-N	364.401	3.806	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2cccc(C)c2)cc([N+](=O)[O-])c1O	408847454	MJYWOYBWVCYGMA-RIYZIHGNSA-N	367.361	3.553	50	40	FHGB	
O=C(N/N=C/c1ccccn1)c1cc(-c2ccc(Cl)cc2Cl)n[nH]1	867826	SEZPQXKNCYCGDQ-AWQFTUOYSA-N	360.204	3.542	50	40	FHGB	
NC(=O)[C@H](c1ccccc1)c1ccc(N(CCCl)CCCl)cc1	5593614	MVYSCWDJCYSMCC-QGZVFWFLSA-N	351.277	3.588	50	40	FHGB	
CCOc1cc(Br)c(Br)c(/C=C(\C)C=O)c1O	17074849	OYWNVAMPUUUIRE-QPJJXVBHSA-N	364.033	3.918	50	40	FHGB	
Cc1ccc2nc(C)c(C(=O)NNC(=O)c3ccc(Cl)cc3)cc2c1	12791768	XGUXMOYVWHZNHH-UHFFFAOYSA-N	353.809	3.580	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC#N)c(Cl)c2)cc1	408797905	TWSYZPOWALXYAE-GXDHUFHOSA-N	367.792	3.797	50	40	FHGB	
O=C(Cc1cccc(C(F)(F)F)c1)N/N=C\c1ccc(N2CCCC2)o1	408858831	TUAFRCXTXBOADH-UUYOSTAYSA-N	365.355	3.591	50	40	FHGB	
CCOC(=O)c1nc(-c2ccccc2)oc1NNC(=O)c1ccc(C)cc1	71195121	HRYSIATWTZCFTC-UHFFFAOYSA-N	365.389	3.584	50	40	FHGB	
N#C/C(=C\c1cccc(Br)c1)C(=O)c1ccc2c(c1)OCO2	44028892	AYCZANHZRCLAJN-AWNIVKPZSA-N	356.175	3.968	50	40	FHGB	
O=C(COc1ccc(-c2ccccc2)cc1)N/N=C/c1ccccc1C(=O)O	13338165	UPLVVWQQKSJVGT-OEAKJJBVSA-N	374.396	3.581	50	40	FHGB	
C[C@H]1CN(c2ccc(/C=C(\C#N)c3nc4ccccc4n3C)o2)C[C@@H](C)O1	17247392	QPLPZBAEMBDUPW-WMVBVCORSA-N	362.433	3.844	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NC2CCCCC2)c(C)n1C[C@H]1CCCO1	59109269	MPGRLTUQBLQYOF-VOMPUTFMSA-N	355.482	3.640	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccc(F)cc1	30822059	MHKAHTWYVZFBFC-JAIQZWGSSA-N	353.309	3.758	50	40	FHGB	
N#C/C(=C/c1ccc(OCc2cccc3ccccc23)cc1)C(=O)NC(N)=O	409241790	UVOVCCVKSYCINJ-PDGQHHTCSA-N	371.396	3.521	50	40	FHGB	
N#Cc1ccc(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)cc1	4514885	VXAICNIUVDPXJJ-KEBDBYFISA-N	368.190	3.831	50	40	FHGB	
Cc1cccc(C)c1NC(=O)/C(C#N)=C/c1cn(C)nc1-c1cccnc1	66405859	VGRXPKDMEYQOTB-LICLKQGHSA-N	357.417	3.645	50	40	FHGB	
N#C/C(=C\c1ccc(N2CCCC2)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	409214944	YXLZZVOPIUJDCK-FOWTUZBSSA-N	362.389	3.741	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2cc3cc(Cl)ccc3o2)cc1OC	409022924	WMAHMTBHNJYUCZ-JMIUGGIZSA-N	358.781	3.867	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccccc1C)c1ccc([N+](=O)[O-])cc1	408771378	FZAJPYDGWCUKIF-XMHGGMMESA-N	357.435	3.677	50	40	FHGB	
O=C(CN1CCCC1)N/N=C/c1ccc(-c2cccc(Cl)c2Cl)o1	816717	MWLPJHUDPKIVFD-KEBDBYFISA-N	366.248	3.799	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)c1ccncc1	1053552	XPRCMJQIRWVJJA-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
O=C(NN=C(Cc1ccccc1)Cc1ccccc1)c1ccc2c(c1)OCO2	5560448	IPLBVJNGFFLDRR-UHFFFAOYSA-N	372.424	3.987	50	40	FHGB	
O=C(N/N=C\c1cc(Cl)ccc1OC(=O)c1ccco1)c1ccco1	409224655	MZWLNYIZNVNESA-GRSHGNNSSA-N	358.737	3.509	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)CSc2ccc(C)cc2)c1	46589134	VRBFLHIMHQQDFS-KGENOOAVSA-N	355.463	3.586	50	40	FHGB	
COc1ccccc1NC(=S)NNC(=O)c1ccc(Cl)cc1Cl	8686057	XPVZHELBNLUZEF-UHFFFAOYSA-N	370.261	3.633	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)c(C)c1C	107089261	POXKHEOFLYQEFC-WYMPLXKRSA-N	371.440	3.876	50	40	FHGB	
O=C(N/N=C/[C@H]1C[C@H]2C=C[C@H]1C2)c1ccc(NC(=O)c2ccccc2)cc1	105670312	QSXLNIBBGZBRCI-PMNYJKANSA-N	359.429	3.867	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccc(F)cc2)c(OC)c1	6179597	QVDKGCDINMXVMT-GDNBJRDFSA-N	369.348	3.524	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)cc2)cc1Cl	408735052	NAPHRQDUCQKWFT-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
C=CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccccc1F	408875267	IHIQQJAMLMDALX-RVDMUPIBSA-N	352.365	3.945	50	40	FHGB	
C/C(=N/NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(O)cc1O	12362170	IOGOXVDCAVWWJF-HAHDFKILSA-N	360.413	3.770	50	40	FHGB	
O=C(COc1cccc(Cl)c1)N/N=C/c1ccc(Br)s1	3174873	NNVBOJUOJVYYOF-FRKPEAEDSA-N	373.659	3.693	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)CN2CCC[C@H]2c2cccs2)Nc2ccccc21	101233707	VDGAYADRNWYDFZ-TYSUYXETSA-N	364.474	3.751	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1C	408822278	AWCCRVNJSVRYLA-GZTJUZNOSA-N	364.401	3.946	50	40	FHGB	
CCOC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccoc3C)o2)cc1	5797046	LGJBDCXSZAEJOX-CIAFOILYSA-N	366.373	3.789	50	40	FHGB	
Cc1ccoc1/C=N/NC(=O)COc1ccc(Cl)cc1Br	1088183	RPNMTXDSIGDCNZ-REZTVBANSA-N	371.618	3.533	50	40	FHGB	
C/C(CC(=O)Nc1cc(Cl)cc(Cl)c1)=N\NC(=O)c1cccnc1	102266888	RLICEKZLIGPQAF-UFFVCSGVSA-N	365.220	3.523	50	40	FHGB	
C/C(=N\NC(=O)COc1ccccc1C#N)C12CC3CC(CC(C3)C1)C2	8401658	ZFRSBJKNLOBBQZ-OEAKJJBVSA-N	351.450	3.646	50	40	FHGB	
CO/N=C/Nc1nnc(/C(C#N)=C/c2ccc(Cl)cc2Cl)s1	6380301	QOQZNSMYQHJGDK-RUDMXATFSA-N	354.222	3.911	50	40	FHGB	
CCOC(=O)[C@@H](CC)/C(C)=N\NC(=O)COc1cc(C)ccc1C(C)C	408950092	GIYWFAGYLNTSJS-NOEYKIMYSA-N	362.470	3.579	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)NCc2cccs2)c(OC)c1	4083444	QXIFCTSYHUPJAB-LFIBNONCSA-N	369.490	3.826	50	40	FHGB	
CCc1ccc(Oc2nc3c(C)cccn3c(=O)c2C=C(C#N)C#N)cc1	5529013	LUJLIWQJJZMWCV-UHFFFAOYSA-N	356.385	3.788	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=N/NC(=O)Nc2ccc(F)cc2)cc1	4748955	JBMCTJLWGSSXRU-HYARGMPZSA-N	365.412	3.838	50	40	FHGB	
COc1ccc(/C=C\C(=N\NC(=O)c2ccccc2)[C@@H](C)CN(C)C)cc1	17175042	ZWXRBVGZBVIQPO-KBNYPJDNSA-N	365.477	3.692	50	40	FHGB	
COC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1ccc(OC(C)C)cc1	1454279	PTKQNGMNUGVISJ-FOWTUZBSSA-N	364.401	3.806	50	40	FHGB	
CCCCOc1ccc(/C=N\NC(=O)c2cccc(OC)c2)cc1OC	34856632	KTHRJIGBZXCPMY-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3/C[C@@H]4C=CC[C@@H]34)cc2)cc1	138388447	HXGHNTSONLLCSQ-QGODWDNSSA-N	357.413	3.672	50	40	FHGB	
C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1ccc(Cl)cc1Cl	5164229	CJAIZEIBHRLHRM-UWSDUSPXSA-N	365.216	3.674	50	40	FHGB	
COc1ccc(OCC(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc1	636912	PXQSSOMONNXTHM-DJKKODMXSA-N	353.205	3.531	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)NC2CCCCC2)c(OC)c1	57470315	LITZOKSIEGILNG-GHRIWEEISA-N	355.482	3.897	50	40	FHGB	
CCOC(=O)c1c(C)c(C)n(Cc2cccs2)c1NC(=O)CCl	3440556	PEWMHPVWGWDMOT-UHFFFAOYSA-N	354.859	3.569	50	40	FHGB	
COc1ccc(C(=O)N/N=C2/C(=O)c3ccccc3-c3ccccc32)cc1	4550620	BKXCSKUYDNOEHF-BSYVCWPDSA-N	356.381	3.693	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)c1ccc(NC(C)=O)cc1	5481004	GCMBALKJGUQKDJ-LPYMAVHISA-N	361.401	3.571	50	40	FHGB	
CCc1sc(C(=O)NNC(=O)CCc2nc3ccccc3s2)cc1C	8294224	YVYYUHWJBJKSBI-UHFFFAOYSA-N	373.503	3.622	50	40	FHGB	
COc1cc(N2CCCCC2)ccc1/C=N/NC(=O)c1ccc(C)cc1	409220622	CJMARGXXQBIWQJ-PXLXIMEGSA-N	351.450	3.758	50	40	FHGB	
Cc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(C(C)C)cc3)CC2=O)cc1	409156578	OXAZRMTTWMQEAR-VFOSSOBBSA-N	363.461	3.622	50	40	FHGB	
C=C1CC(C(=O)N/N=C/c2ccc(-c3ccc(Cl)c(C(=O)O)c3)o2)C1	408729089	CUKNMLVMWXMYCF-AWQFTUOYSA-N	358.781	3.715	50	40	FHGB	
COc1ccc(/C=C/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1	15227085	UWBYKERGCUDEAH-LWILEHKSSA-N	371.440	3.999	50	40	FHGB	
Cc1cc(C)c2cc([C@@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)c(Cl)nc2c1	898791	XQZREJYHRKOPCL-MRXNPFEDSA-N	365.824	3.755	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)N(C)C)c(C)n1-c1cccc(Br)c1	59334444	WDQMVPVBHSIQHO-DHDCSXOGSA-N	372.266	3.852	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(NC(C)=O)cc2)cc1Cl	1439469	GOIUKTPPDDPBQN-NTEUORMPSA-N	369.808	3.853	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccccn1	1805671	ZAHWDWWPIMKTJK-JMIUGGIZSA-N	370.752	3.667	50	40	FHGB	
C=CCOc1ccc(/C=N\NC(=O)c2ccc(OC)c(OC)c2)cc1Cl	409319462	GRIWSYLFQSKADR-MTJSOVHGSA-N	374.824	3.686	50	40	FHGB	
CCn1cccc1/C=N\NC(=O)c1cc2cc(Br)ccc2o1	408931925	SDDPEOZGLLNILC-ZDLGFXPLSA-N	360.211	3.781	50	40	FHGB	
CO[C@@H]1CC[C@H](/C=C(\C#N)C2CCC([N+](=O)[O-])CC2)C[C@@H]1Br	38310996	OKDIJYAIKUNQCW-TZPRFLRWSA-N	371.275	3.850	50	40	FHGB	
CC(C)OC(=O)N[C@H]1c2ccccc2CC[C@H]1I	17352954	XVBFCQDDPWPAKJ-OLZOCXBDSA-N	359.207	3.612	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	5420537	XGBFFPRWYMJPGV-HYARGMPZSA-N	367.449	3.571	50	40	FHGB	
C=CCc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)cc(OCC)c1O	59679326	KTDSYUVNMOHVDX-ATVHPVEESA-N	354.450	3.875	50	40	FHGB	
Cc1ccc(-c2csc(NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	1415095	HRXMNBBYHIPYKI-UHFFFAOYSA-N	354.391	3.784	50	40	FHGB	
Cc1cccn2c(=O)c(C=C(C#N)C#N)c(Oc3ccccc3Cl)nc12	5574231	NKNLPLQLSXKGOU-UHFFFAOYSA-N	362.776	3.879	50	40	FHGB	
CCSC1=C(C#N)[C@@H](c2ccc(Cl)cc2)[C@@H](C(=O)OC)C(O)=N1	16995921	WKEUIGQOEPOIBX-CHWSQXEVSA-N	350.827	3.671	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)cc1OC	408831628	ONHAIYFBQRWLFO-CIAFOILYSA-N	356.422	3.503	50	40	FHGB	
CC(C)(C)c1ccc([C@@H]2C[C@@H]2C(=O)N/N=C\c2ccc(O)c(O)c2)cc1	30738456	YSMQCTMMMJDQNV-JUFXSQMOSA-N	352.434	3.649	50	40	FHGB	
Cn1nnc(-c2cccc(NC(=O)CCCC[C@H]3CCSS3)c2)n1	79488309	QQBADZJVJWQBMS-AWEZNQCLSA-N	363.512	3.530	50	40	FHGB	
CCOC(=O)c1cc(-c2ccc(Cl)c(Cl)c2)[nH]c1NNC(=O)OC	3128629	KSOGQODKNBFODS-UHFFFAOYSA-N	372.208	3.848	50	40	FHGB	
COc1cc(OC)c(/C=N/NC(=O)c2ccccc2Cl)cc1Cl	408590533	PLAAHICDJFEJHF-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
O=C(CSc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(Cl)s1	408966508	MZBHNHCRUHPFGD-VIZOYTHASA-N	355.828	3.552	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)[C@@H](C)Oc2cc(C)cc(C)c2)cc1OC	31776138	RBMSJJQFZBQKRO-NXUSMQHESA-N	370.449	3.628	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2cccc(Cl)c2)cc(Cl)c1OC	8043048	YLHDMHZXPDDULG-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
COC(=O)[C@]12CC[C@H](C1)C(C)(C)[C@]2(Br)CBr	12661430	XXGJBUQJCZYXKR-JFUSQASVSA-N	354.082	3.514	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)CSc2ccc3ccccc3c2)c(C)o1	6509176	AKNJJTVZNSYKLE-UHFFFAOYSA-N	354.431	3.603	50	40	FHGB	
COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3ccc4ccccc4c32)cc1	1037164	DKRFJDHFZMNYLF-IBGZPJMESA-N	356.381	3.845	50	40	FHGB	
C[C@H](Oc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc([N+](=O)[O-])s1	1445112	RPMTYOOWXQHVSN-MKFNJMOCSA-N	369.402	3.727	50	40	FHGB	
C=CCOc1cccc(/C=N\NC(=O)c2ccc(OCCC)c(OC)c2)c1	409337557	YZLBFDVHZIVBFG-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
Cc1ccc(NC(=O)C(=O)N/N=C/c2c(Cl)cccc2Cl)c(C)c1	3131983	LNHKHARPIRMUJA-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
COCCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C	7165276	PGPOTUJKEFSUQJ-SFQUDFHCSA-N	371.868	3.807	50	40	FHGB	
CSc1ccc(/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1	1095512	SWKUBROTQXLBCR-OBGWFSINSA-N	363.486	3.664	50	40	FHGB	
Cn1cc(/C=C(\C#N)c2ccccn2)c(-c2ccc3c(c2)OCCCO3)n1	12543208	MBUPJHFFASFNJB-LFIBNONCSA-N	358.401	3.708	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2ccccc2-n2cccc2)cc1Cl	28632502	ARZDSAGUFBFPTF-BKUYFWCQSA-N	353.809	3.903	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)Nc1ccccc1	4106502	DIAAGYPAEGDQPU-CPNJWEJPSA-N	355.398	3.597	50	40	FHGB	
CCc1ccc(OCC(=O)N/N=C(\C)c2ccccc2OC(F)F)cc1	5417670	HCCVSDKBRBAPHI-LPYMAVHISA-N	362.376	3.770	50	40	FHGB	
O=C(O)c1ccc(-n2cccc2/C=N/NC(=O)c2cccc(Cl)c2)cc1	4747621	RINMVVNFDBSYEY-CIAFOILYSA-N	367.792	3.593	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)CC1(C)SCCS1	409262118	FHHGFNZZXGQRMM-XDHOZWIPSA-N	360.504	3.885	50	40	FHGB	
O=C(NNC(=S)Nc1cccc(C(F)(F)F)c1)c1cccc(Cl)c1	8691942	MLQFVHZYYRCHHQ-UHFFFAOYSA-N	373.787	3.990	50	40	FHGB	
CCOc1cc2c(cc1/C=C(/C#N)C(=O)N[C@H](C)c1ccccc1)OCO2	409236328	DZAIRVYIHAWDHF-KDVQLTRESA-N	364.401	3.598	50	40	FHGB	
COc1cc(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)ccc1O	36490003	RFNHUDFDSPEWKU-HAHDFKILSA-N	360.413	3.683	50	40	FHGB	
C#CCOc1ccc(OC)cc1/C=N/NC(=O)Cc1cccc2ccccc12	8114313	GMGWTKJNABHCPV-LFVJCYFKSA-N	372.424	3.553	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)s1	21554808	RUUXPFBZLNXPFB-HAVNEIBRSA-N	363.657	3.758	50	40	FHGB	
CCC(=O)Nc1ccc(C(=O)N/N=C/c2c(O)ccc3ccccc23)cc1	672099	NFXISZYMYXGPAR-LPYMAVHISA-N	361.401	3.658	50	40	FHGB	
C/C(CC(=O)Nc1cccc2c1CCCC2)=N\NC(=O)c1ccoc1C	4679878	UPMXNJYRACQGKD-LPYMAVHISA-N	353.422	3.601	50	40	FHGB	
Cc1cccc2cc(/C=N/NC(=O)COc3ccccc3)c(Cl)nc12	408726863	CPNYINCIBVJNMP-SRZZPIQSSA-N	353.809	3.726	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)CC2(C)SCCS2)cc1	409270735	HUSICODOCXOKIF-QGOAFFKASA-N	351.541	3.569	50	40	FHGB	
CCO[Si](C)(CCCNCCC[Si](C)(OCC)OCC)OCC	197954518	SUKDLHIPTSZFPO-UHFFFAOYSA-N	365.663	3.646	50	40	FHGB	
COc1cccc(/C=N\NC(=O)c2cc3cc(Br)ccc3o2)c1	83295486	ANHLOXZVPVJLEL-GRSHGNNSSA-N	373.206	3.968	50	40	FHGB	
CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1	17076425	IANMOFKCFVGROL-GOSISDBHSA-N	373.412	3.535	50	40	FHGB	
O=C(Cc1ccc2c(c1)OCCO2)NN(c1ccccc1)c1ccccc1	14862474	UZRDDZPUEFHQQI-UHFFFAOYSA-N	360.413	3.870	50	40	FHGB	
O=C(CSCc1c(Cl)cccc1Cl)N/N=C/c1ccccn1	409138863	JAQNPBVANHXYFP-UFWORHAWSA-N	354.262	3.772	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)C)c(C)c2)c(C)o1	40140336	HAVWEFYGYKYJOH-OAHLLOKOSA-N	358.438	3.557	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)cc1	5513568	QMXJEBQZZLKDDD-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
CCOc1cc(/C=C(\C#N)c2ccc(Cl)cc2)ccc1OCC(N)=O	2849143	AHAFGANNYMCREB-OQLLNIDSSA-N	356.809	3.667	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N/NC(=O)CNc1ccc(C)c(C)c1	409102577	DKLNCZUPAQBLGA-SSDVNMTOSA-N	359.857	3.918	50	40	FHGB	
CSc1ccc(/C=N/NC(=O)C(=O)Nc2cccc3ccccc23)cc1	4525706	XYBPAGVVIKRAOZ-FYJGNVAPSA-N	363.442	3.651	50	40	FHGB	
C[C@H]1CCCN(c2ccc(C(=O)NN(C)c3ccccc3)cc2[N+](=O)[O-])C1	58415781	NTCUWPLDQBDAOR-HNNXBMFYSA-N	368.437	3.612	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1	4179467	LEWDAZCWXDDCSR-ZVHZXABRSA-N	369.424	3.613	50	40	FHGB	
COc1cc(-c2noc(/C(C#N)=C\c3cccnc3)n2)ccc1OC(F)F	96845495	YLNVGLSFFVMUAT-QPEQYQDCSA-N	370.315	3.806	50	40	FHGB	
Cc1oc(/C=N/NC(=O)CSc2ccccc2)cc1Br	408863519	SLWFAJCISHVJEA-LZYBPNLTSA-N	353.241	3.593	50	40	FHGB	
N#C/C(=C\c1c(OCc2ccc([N+](=O)[O-])cc2)ccc2ccccc12)C(N)=O	408869764	TXUMBQSICHGRDQ-LFIBNONCSA-N	373.368	3.719	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)cc(OC)c1O	408806935	CJHKEDDXUCXPMN-XNTDXEJSSA-N	352.365	3.814	50	40	FHGB	
CC(=O)Oc1ccc(/C=N/NC(=O)CCSc2ccc(C)cc2)cc1	409115285	IJZQFYPZQGSLMW-DEDYPNTBSA-N	356.447	3.553	50	40	FHGB	
C[C@H](NC(=O)OC(C)(C)C)C(=O)NN(c1ccccc1)c1ccccc1	33553045	CQBRQAHLPWCFON-HNNXBMFYSA-N	355.438	3.769	50	40	FHGB	
COc1ccc(C(=O)N/N=C\c2cccc(Cl)c2Cl)cc1OC	38204606	NQSRKBIXLHWKJX-OCKHKDLRSA-N	353.205	3.775	50	40	FHGB	
CC(C)(C)c1csc(NNC(=O)c2ccc(Br)cc2)n1	4176405	GMTQJWXXCAZJCS-UHFFFAOYSA-N	354.273	3.960	50	40	FHGB	
O=C(NN=C1CCCCCCC1)C(=O)Nc1ccccc1Br	59435841	VFQYTBZSZVOFJB-UHFFFAOYSA-N	366.259	3.604	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)cc1	3140225	JPXXYYSWDIBXPX-HYARGMPZSA-N	354.450	3.912	50	40	FHGB	
CC1(C)[C@H](C=C(Cl)Cl)[C@H]1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	2349077	HROKMTWSVSFHHI-VWGMZFAQSA-N	356.209	3.636	50	40	FHGB	
CC(=O)Oc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)cc1	409118105	NCYSOYPDVGPNGA-MQMKENTISA-N	356.447	3.551	50	40	FHGB	
CC(=O)Nc1cccc([C@H](C)NC(=O)NNc2cccc(Cl)c2C)c1	45719403	AESLTTHLBIELGN-LBPRGKRZSA-N	360.845	3.994	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1OCC	13845110	YTAALVRBMCSHQA-LPYMAVHISA-N	370.449	3.630	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1OCc1ccccc1	408866060	GEOQKXOQECYINA-OVCLIPMQSA-N	356.809	3.710	50	40	FHGB	
O=C(O)c1ccc(/C=N/NC(=O)c2ccc(OCc3ccccc3)cc2)cc1	13013633	PCKBQJQJARQXRQ-OEAKJJBVSA-N	374.396	3.728	50	40	FHGB	
CCCCCc1ccc(OCC(=O)N/N=C/c2ccc(OC)cc2)cc1	3169146	KECAWJGHFAPXIS-PXLXIMEGSA-N	354.450	3.957	50	40	FHGB	
CCOC(=O)N/N=C/c1c(C)c(C(=O)c2ccc(F)cc2)n2ccccc12	3271388	FUKLPDMOFVUWTL-WSDLNYQXSA-N	367.380	3.698	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2O)cc1Cl	4966246	SAKAXNMMCWMAEB-IZZDOVSWSA-N	373.752	3.508	50	40	FHGB	
CC(C)Oc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1Br	409368040	LVTGZFQUUJJSIR-NTEUORMPSA-N	363.255	3.766	50	40	FHGB	
CC[C@@H](C)Oc1c(Cl)cc(/C=N/NC(=O)c2ccncc2)cc1OC	6168205	QMFLWTUIOVIDAF-KIHMUJGBSA-N	361.829	3.685	50	40	FHGB	
Cc1ccc2cc(C(=O)NNC(=O)c3oc4ccccc4c3C)c(C)nc2c1	31482185	ORCWBCATQGIJJI-UHFFFAOYSA-N	373.412	3.981	50	40	FHGB	
CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccco2)sc2c1CCCC2	5171942	UKLKUOOMRZWLPR-BENRWUELSA-N	370.430	3.942	50	40	FHGB	
COc1cc(/C=N/NC(=O)CC#N)ccc1OCc1cccc2ccccc12	4513418	BQAJZFURIVKVEJ-ZVHZXABRSA-N	373.412	3.791	50	40	FHGB	
CCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2ccccc2)c1C	5870635	BRPNCEFXMVZOIK-XDHOZWIPSA-N	350.418	3.848	50	40	FHGB	
Cc1ccc(S(=O)(=O)/C(C#N)=C/c2cnn(Cc3ccccc3)c2)cc1	9762266	HFUVPIQHDYYSCH-RGVLZGJSSA-N	363.442	3.578	50	40	FHGB	
COc1ccc(CCCC(=O)N/N=C/c2ccc(OC)c(C)c2)c(C)c1	408909749	IARCUNSNYAKLMZ-HYARGMPZSA-N	354.450	3.794	50	40	FHGB	
CC(C)N(CC1CCN(C(=O)CCl)CC1)C(=O)OCc1ccccc1	79412054	FHMQGVPNBFMGMF-UHFFFAOYSA-N	366.889	3.511	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)C)c(C)c2)c(C)o1	40140335	HAVWEFYGYKYJOH-HNNXBMFYSA-N	358.438	3.557	50	40	FHGB	
O=C(O)/C=C\C(=O)Nc1ccc2c(c1)[C@H](Br)c1ccccc1-2	17311950	JTIYJRIPYLNEHT-ZPUOCTKUSA-N	358.191	3.731	50	40	FHGB	
CC(C)(C)c1cc(/C=N\NC(=O)c2cnccn2)cc(C(C)(C)C)c1O	30828511	GSNSJAMMEWEGBG-KSEXSDGBSA-N	354.454	3.541	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)c(OC)c1OC	2777318	WZCOEBJBMNUHFY-RVDMUPIBSA-N	352.390	3.567	50	40	FHGB	
CCn1nc(C)c(/C=C(\C#N)C(=O)Nc2cc(Cl)ccc2OC)c1C	17074041	MQMRDFMWOIFXCS-MDWZMJQESA-N	358.829	3.728	50	40	FHGB	
N#C/C(=C/c1c[nH]c2ccc(Br)cc12)C(=O)NC1CCCC1	409191895	PTTKZPCYXUDURL-XFFZJAGNSA-N	358.239	3.896	50	40	FHGB	
CN(CC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1)c1ccccc1	3202175	CFNNXOZATUYNGQ-LFVJCYFKSA-N	373.456	3.852	50	40	FHGB	
Cc1c(/C=N/NC(=O)CNc2ccc(Cl)cc2)c2ccccc2n1C	409366852	ZMODZBCACPHIQO-SSDVNMTOSA-N	354.841	3.702	50	40	FHGB	
CCc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2)cc1	39486070	YANPVTXHFNQTGI-CYVLTUHYSA-N	361.445	3.631	50	40	FHGB	
COC(=O)/C(C#N)=C\c1ccc(-c2ccc(Br)cc2F)o1	252495177	OMJMDTCOWOLSHP-TWGQIWQCSA-N	350.143	3.928	50	40	FHGB	
O=C(N/N=C/c1ccccc1)C1CCN(Cc2ccc(Cl)cc2)CC1	5637241	HFMIHMQYEVPFJO-HYARGMPZSA-N	355.869	3.702	50	40	FHGB	
O=C(O)c1ccccc1/C=N\NC(=O)C(c1ccccc1)c1ccccc1	58885237	QEWALEYMJZQZOI-HAHDFKILSA-N	358.397	3.667	50	40	FHGB	
O=C(N/N=C/c1ccc(O)cc1)c1cc2cc(Br)ccc2o1	4514858	FMSUDVCCSCIABJ-GIJQJNRQSA-N	359.179	3.665	50	40	FHGB	
Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N\NC(=O)c2ccc(O)cc2)o1	408719019	FXKQXJARJCHWFF-JAIQZWGSSA-N	365.345	3.633	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)cc(Cl)c1O	7168233	GJPQBCKZQUGXCC-MDWZMJQESA-N	372.808	3.999	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C\c2cc(Cl)ccc2O)cc1OC	6324439	GPWTYYVHIMDZKW-JAIQZWGSSA-N	362.813	3.607	50	40	FHGB	
COc1c(Cl)cc(Cl)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2	856158	GYQGFYWVCGNFOK-AWEZNQCLSA-N	365.216	3.817	50	40	FHGB	
COc1cccc(/C=N/NC(=O)c2cc3cc(C)ccc3nc2C)c1OC	685556	TVLULXZUQQDUNJ-WSDLNYQXSA-N	363.417	3.633	50	40	FHGB	
CN(C)C(=O)/C(C#N)=C\c1cn(Cc2ccccc2C#N)c2ccccc12	59333802	LGUOWAHTRLUHAK-WQRHYEAKSA-N	354.413	3.556	50	40	FHGB	
CCN(C(=O)c1sc(NC(=O)CCl)c(C#N)c1C)C1CCCCC1	844186	ZGJZOMMWEFRPGL-UHFFFAOYSA-N	367.902	3.900	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)C/N=C/c2ccc(Cl)cc2)Nc2ccccc21	104808293	GHADHHAVJDTTND-UKUOEOJPSA-N	350.809	3.625	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)N2CCCC2)ccc1OCc1ccccc1	1421064	WMSBSEBLOVTHHL-CPNJWEJPSA-N	362.429	3.804	50	40	FHGB	
Cc1ccc(C(=O)OCC(=O)Nc2c(C)cc(SC#N)cc2C)c(O)c1	5226549	JKOYGZVIEVMVQL-UHFFFAOYSA-N	370.430	3.686	50	40	FHGB	
C/C(=N/NC(=O)COc1ccccc1C(C)(C)C)c1cccc([N+](=O)[O-])c1	4724416	WELZRRKMFDFKHH-STZFKDTASA-N	369.421	3.812	50	40	FHGB	
CC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2cc([N+](=O)[O-])ccc2C)o1	408797081	FSIXAARBXKVOND-FYQHACEVSA-N	353.378	3.985	50	40	FHGB	
COC(=O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccc(C)cc3)o2)c1	6211419	AMQOEAWXIWZCOB-LPYMAVHISA-N	362.385	3.806	50	40	FHGB	
COc1ccc([C@H]2C(C#N)=C(N)S[C@H](c3ccccc3)[C@H]2[N+](=O)[O-])cc1	971474	ZYUXEXKQXZNGKC-OKZBNKHCSA-N	367.430	3.606	50	40	FHGB	
N#C/C(=C\c1cccc(Br)c1)C(=O)Nc1ccccc1C(=O)O	2774007	YWXJWMKMISXVKQ-XYOKQWHBSA-N	371.190	3.693	50	40	FHGB	
CC1(C)CC2=NC(SCC(N)=O)=C(C#N)C3(CCCCC3)C2=C(O)C1	4730731	OWPKWOOBDRCZIN-UHFFFAOYSA-N	359.495	3.977	50	40	FHGB	
COc1ccc(NC(=O)C(=O)NN=C2CCCCCCC2)cc1Cl	58885815	JGPJNLRLESFZFP-UHFFFAOYSA-N	351.834	3.504	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2cc(C3CC3)nc3ccccc23)ccc1O	1826774	GECCKSSHVQHGGG-WSDLNYQXSA-N	361.401	3.590	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1	4544142	BEBNSCRZDYGYHW-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
N#C/C(=C/c1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(C(=O)O)cc1	8513497	SJMNCFKFPOSNRG-LCYFTJDESA-N	360.291	3.949	50	40	FHGB	
C/C(CC(=O)N(C(C)C)C(C)C)=N\NC(=O)c1cccc2ccccc12	4409022	PEYYAOGWCVCUTQ-CJLVFECKSA-N	353.466	3.981	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)Cc2ccccc2)c(OC(C)C)c1	14134914	HTXOPBGTPYMING-HYARGMPZSA-N	354.450	3.954	50	40	FHGB	
CC(C)[C@@H](Br)C(=O)Nc1nc2ccc(N(C)C)cc2s1	20133500	BFTHXVGTYFSOHB-GFCCVEGCSA-N	356.289	3.720	50	40	FHGB	
Cc1ccc(COc2ccc(Br)cc2/C=C(\C#N)C(N)=O)cc1	59305858	AUONNUHJELVSIG-OVCLIPMQSA-N	371.234	3.729	50	40	FHGB	
C/C(=N\NC(=O)c1sc(-c2ccccc2)nc1C)c1ccc(N)cc1	7064928	MDPUUJAOFKNQLP-WSDLNYQXSA-N	350.447	3.855	50	40	FHGB	
COC(=O)c1c(NC(=O)CCl)sc2c1CC[C@@H](c1ccccc1)C2	74941632	KUISIESUYVPDAB-GFCCVEGCSA-N	363.866	3.985	50	40	FHGB	
Cc1ccc(/C=C(\C#N)c2nn(-c3ccccc3)c(N)c2C#N)cc1[N+](=O)[O-]	408980135	VIHWVXSTAOUTTP-OQLLNIDSSA-N	370.372	3.607	50	40	FHGB	
Cn1cc(C(=O)N/N=C\c2ccccc2Br)c2ccccc21	33334668	HEBYFEPVDRTAIG-GRSHGNNSSA-N	356.223	3.705	50	40	FHGB	
C[C@@H](NC(=O)CCCC[C@H]1CCSS1)c1nnc2ccccn12	52972001	HVAWQCMGQSSHOC-OLZOCXBDSA-N	350.513	3.621	50	40	FHGB	biogenic
O=C(CBr)c1cc(Cl)cc(I)c1	97437876	WIDNNIUAZKVEQD-UHFFFAOYSA-N	359.388	3.522	50	40	FHGB	
C=CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2F)cc1OC	7156532	HKPAXUNCQJPCBU-RVDMUPIBSA-N	352.365	3.945	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2ccccc2C(F)(F)F)cccc1[N+](=O)[O-]	5921563	WCNJZAFRBSMVKD-AWQFTUOYSA-N	351.284	3.686	50	40	FHGB	
CCC[C@@H](Br)C(=O)NCCC(=O)Nc1ccc(C(C)C)cc1	15423132	DQQSKDGMOOKZAA-OAHLLOKOSA-N	369.303	3.818	50	40	FHGB	
O=C(NC(=S)P(=O)(c1ccccc1)c1ccccc1)c1ccccc1	2577835	BKMAUHDTGFXIBY-UHFFFAOYSA-N	365.394	3.715	50	40	FHGB	
N#C/C(=C/c1cc(Cl)ccc1O)C(=O)NCCc1c[nH]c2ccccc12	408951946	NABNCKFRQAOEMM-DHDCSXOGSA-N	365.820	3.793	50	40	FHGB	
O=C(COc1cccc2ccccc12)N/N=C\c1ccc(Br)o1	33339491	VYHSUNWAXQPJRN-GRSHGNNSSA-N	373.206	3.724	50	40	FHGB	
CCCc1cc(C(=O)N/N=C\c2ccc([N+](=O)[O-])cc2)c2ccccc2n1	31629144	PTVQJYUCQMMILH-BKUYFWCQSA-N	362.389	3.859	50	40	FHGB	
N#CC1=C2SCN(Cc3ccco3)CN2C(=O)C[C@H]1c1ccccc1F	20348338	MYMONVUDPHNFKN-HNNXBMFYSA-N	369.421	3.634	50	40	FHGB	
O=C(NCP(=O)(c1ccccc1)c1ccccc1)OCc1ccccc1	1643288	OSEFGVZNAGCXPR-UHFFFAOYSA-N	365.369	3.884	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)cc1)c1ccc(N2CCCC2)cc1	408676176	GOMHRXWDNQOJMG-DEDYPNTBSA-N	372.266	3.813	50	40	FHGB	
COc1ccc(C(=O)/C(C#N)=C\c2cc(OC)c(OC)c(OC)c2)cc1	72235938	IZSCJDYTBOFIFB-DHDCSXOGSA-N	353.374	3.511	50	40	FHGB	
COc1cccc(/C=N\NC(=O)c2cc(-c3ccccc3Cl)n[nH]2)c1	31830144	STSRYIVOVUJADP-JAIQZWGSSA-N	354.797	3.503	50	40	FHGB	
C/C(=N/NC(=O)[C@@H](C)Nc1cccc(Br)c1)c1ccccc1	4619321	IHFAPEZNXXGKAT-UAAGNOOKSA-N	360.255	3.790	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)c(C)n1C[C@@H]1CCCO1	7608863	LRSHQDLJKRBHEI-HNLWVNFGSA-N	363.461	3.507	50	40	FHGB	
Cc1ccc(-c2nc3cc(N4C[C@H](C(=O)Cl)CC4=O)ccc3o2)cc1	57327049	ZNGIMDWSSPZQIP-CYBMUJFWSA-N	354.793	3.922	50	40	FHGB	
O=C(N/N=C/c1ccccc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	59459728	CDUPIGLVIUXVAB-PXLXIMEGSA-N	359.385	3.568	50	40	FHGB	
O=C(N/N=C/c1ccc(OC(=O)c2ccccc2)cc1)c1ccc(F)cc1	1458071	ZCFDBBFKZKLQDJ-OEAKJJBVSA-N	362.360	3.809	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2ccc(F)cc2)o1)c1ccc([N+](=O)[O-])cc1	408566380	GAJNUOCWMAWOJZ-JAIQZWGSSA-N	353.309	3.758	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2ccc3ccccc3c2)c([N+](=O)[O-])c1	5362834	PGJSFEPADRNZEL-CIAFOILYSA-N	363.373	3.586	50	40	FHGB	
O=C(N/N=C\c1cc(Br)cc(Cl)c1O)c1ccc(F)cc1	4784598	HJSUCCIQFQRQON-WSVATBPTSA-N	371.593	3.711	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc1OC	408965682	XDMCWERGEXWCDI-SSDVNMTOSA-N	366.339	3.877	50	40	FHGB	
CCCCCCC(/C=C\c1ccc(Cl)c(Cl)c1)=N/NC(=O)C(N)=O	17109934	KNMKBQAECHDPAT-PTWJGVHSSA-N	370.280	3.935	50	40	FHGB	
CCCc1cc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)c2ccccc2n1	1681716	PTVQJYUCQMMILH-FYJGNVAPSA-N	362.389	3.859	50	40	FHGB	
CC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccc(OCc2ccccc2)cc1	1444666	MWZVLZVIEVZQBI-NRFANRHFSA-N	360.413	3.936	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2ccc3c4c(cccc24)CC3)cccc1[N+](=O)[O-]	59436873	YALNJZPUMANXGF-WSDLNYQXSA-N	359.385	3.919	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)[C@H](C)Sc2ccccc2)cc1OC	831091	GKVFGKKAXQNUNX-ZXOFLVKFSA-N	358.463	3.725	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(Br)cc2)c(O)c1	408892608	BLSAOUWJXODOJX-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
CCC[C@@H](Br)C(=O)NCCC(=O)Nc1ccccc1C(C)C	15423170	SMGSFUOYWRRHNX-CQSZACIVSA-N	369.303	3.818	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(N)=O)ccc1OCc1ccccc1Cl	33410040	GNUXVEQEFFLALO-DHDCSXOGSA-N	356.809	3.710	50	40	FHGB	
C[C@@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3F)[C@@H]2C1	13739053	QBQKOQFOCNSULL-PZDGAKPMSA-N	350.372	3.804	50	40	FHGB	
CCCc1[nH]nc2c1[C@H](c1cc3ccccc3nc1Cl)C(C#N)=C(N)O2	6720058	FHALIXORRKSYTL-OAHLLOKOSA-N	365.824	3.782	50	40	FHGB	
CC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2ccc(OC)c(OC)c2)cc1	1319371	FNAPUPYNWONIFB-IKMPRTQCSA-N	370.449	3.746	50	40	FHGB	
CC(C)C1=C/C(=N\S(=O)(=O)c2ccccc2)[C@](C)(Cl)[C@@H](Cl)C1=O	12562490	AMKNSIWVDQASDH-HXNCVPNASA-N	374.289	3.586	50	40	FHGB	
O=C(NNC(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccco1	12998308	LMYSVSVFWSUHJC-QGZVFWFLSA-N	352.415	3.574	50	40	FHGB	
O=C(Cc1cccc(C(F)(F)F)c1)NNc1c(F)c(F)cc(F)c1F	7058523	SMVVQJFJARAEQM-UHFFFAOYSA-N	366.236	3.948	50	40	FHGB	
Cn1/c(=N\NC(=O)c2cccc(Cl)c2Cl)sc2ccccc21	3236457	FZNVHKVMBPNMCI-XDJHFCHBSA-N	352.246	3.792	50	40	FHGB	
O=C(N/N=C\c1cccnc1)c1cc(-c2cc(Cl)cc(Cl)c2)n[nH]1	30743105	SFOJKZWRRAGWTO-UKWGHVSLSA-N	360.204	3.542	50	40	FHGB	
C[C@H]1CCc2sc(C(=O)N/N=c3/c(=O)c4cccc5cccc3c54)cc2C1	3391005	XJPJMEWATKJXQO-SEDFNUQVSA-N	374.465	3.661	50	40	FHGB	
O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1ccccc1-n1cccc1	408885017	ZRAIXBPJOSNMLR-SRZZPIQSSA-N	367.792	3.623	50	40	FHGB	
COc1cc(/C=N\NC(=O)c2cc3ccccc3o2)ccc1OC(C)C	33850032	IIEJLTFABYZYMG-MTJSOVHGSA-N	352.390	3.993	50	40	FHGB	
CC1(C)COc2ccc(C(=O)N/N=C\c3ccc(Cl)cc3)cc2OC1	225368725	HRXUVQHYCDSGQQ-FBHDLOMBSA-N	358.825	3.901	50	40	FHGB	
O=C(NNc1ccc(Br)cc1)c1cnc(-c2ccccc2)nc1	194633093	KECRYBPVYVTPFA-UHFFFAOYSA-N	369.222	3.663	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(N3CCCCC3)o2)cc1	16216776	CDCARXPTPMDMKH-LGMDPLHJSA-N	365.433	3.502	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2cccc(OC)c2)ccc1OC	6945291	SOCAQDMPSMDABC-XNTDXEJSSA-N	352.390	3.648	50	40	FHGB	
CCCCCCCCNC(=O)/C(C#N)=C\c1cc(OC)c(O)c(OC)c1	105407926	QAXWGENDMJHZBV-WJDWOHSUSA-N	360.454	3.793	50	40	FHGB	
CCCCCCOc1ccccc1C(=O)N/N=C1/C(=O)Nc2ccccc21	2186508	FLVBDYIAOFSEBK-UHFFFAOYSA-N	365.433	3.732	50	40	FHGB	
O=C(CCC(=O)N(c1ccccc1)c1ccccc1)N/N=C/c1cccnc1	4698775	RIYLAGUFSSKGNS-JJIBRWJFSA-N	372.428	3.677	50	40	FHGB	
Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)cc1C	4703098	KTAQKAVJAXFZFJ-LPYMAVHISA-N	351.450	3.690	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)COc2ccccc2)c(OC(C)C)c1	408530940	NAYUNMRKZBKMKS-LPYMAVHISA-N	370.449	3.790	50	40	FHGB	
CC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1	408813404	QIHMPRIFYDSTLM-LFGHMXSPSA-N	353.378	3.985	50	40	FHGB	
N#Cc1ccc(C(=O)N/N=C/c2ccc(OC(=O)c3ccccc3)cc2)cc1	408737486	SDBINDVEFDLENX-BUVRLJJBSA-N	369.380	3.541	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(C)c2C)cc1C(=O)O	409168904	OGOYPRIMQLRPGE-MHWRWJLKSA-N	364.401	3.946	50	40	FHGB	
CCOC(=O)c1sc2nc(-c3ccccc3)nn2c1CBr	5835526	WJECFPAULLARKL-UHFFFAOYSA-N	366.240	3.529	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1	3073168	BJCPIJAIOOGNFA-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)COc1ccc(C)cc1C	6843911	HCUJXCLTMRBDSQ-YDZHTSKRSA-N	362.429	3.994	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C(F)(F)F)c2)ccc1O	16901479	LFKRAYWNSVZBFK-GHXNOFRVSA-N	362.307	3.965	50	40	FHGB	
COC(=O)c1c(NC(=O)CCl)sc2c1CC[C@H](c1ccccc1)C2	74941635	KUISIESUYVPDAB-LBPRGKRZSA-N	363.866	3.985	50	40	FHGB	
COC(=O)/C(C#N)=C\c1ccc(-c2ccc(F)cc2Br)o1	252483581	FFNSUVJNNXQKOR-TWGQIWQCSA-N	350.143	3.928	50	40	FHGB	
C[C@@H](NC(=S)NNC(=O)c1cccc(Cl)c1)c1ccc(Cl)cc1	670419705	GKUZKJWRIPOMGC-SNVBAGLBSA-N	368.289	3.864	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)c2cccc(OC)c2)cc1OCC	169878413	QCTDVPWSHFTVJD-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
CCCOc1ccccc1/C=N/NC(=O)c1cc2cccc(OC)c2o1	6943268	VVJXBVWNGYRVGM-FYJGNVAPSA-N	352.390	3.994	50	40	FHGB	
Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)[C@@H](C)Cc1ccccc1	655597	CNLKSJNWIMFFAA-PFRBSUFTSA-N	360.461	3.818	50	40	FHGB	
COc1cc(Br)cc(/C=C(\C#N)C(=O)Nc2ccccc2)c1O	408725289	GTYPQFZDWRCAPA-KPKJPENVSA-N	373.206	3.709	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)c(O)c1	4710516	DEARGDAGBUNNSE-FOWTUZBSSA-N	365.433	3.793	50	40	FHGB	
C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1cccc2ccccc12	409176900	AHJHZSHVAYOOPK-HYARGMPZSA-N	373.368	3.524	50	40	FHGB	
COc1ccc(-n2c(C)cc(/C=N/NC(=O)c3cccs3)c2C)cc1	408589248	LDCRMOOENHGRFX-UDWIEESQSA-N	353.447	3.928	50	40	FHGB	
CC(=O)N/N=C/c1cc(Br)c(Sc2ccc(C)cc2)o1	1097462	KJVDCSXTCKPALP-LZYBPNLTSA-N	353.241	3.972	50	40	FHGB	
C/C(=N/NC(=O)CSc1nc2ccccc2n1C)c1ccccc1Cl	5024861	WPRLFGFFZKYDQS-MTJSOVHGSA-N	372.881	3.859	50	40	FHGB	
CCCCCC[C@@H]1/C(=N\NC(=O)Cc2ccccc2)CC[C@H]1C(=O)OC	5184942	KQXIKFNFOVCXOR-JBBAMGPQSA-N	358.482	3.871	50	40	FHGB	
COc1cccc(OC)c1C(=O)NNc1nc2c(C)cc(C)cc2s1	4121456	FYKBHZJEOGWLAX-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
CC(C)OC(=O)N[C@@H]1c2ccccc2CC[C@H]1I	4887547	XVBFCQDDPWPAKJ-CHWSQXEVSA-N	359.207	3.612	50	40	FHGB	
CCn1c(C)c(/C=N/NC(=O)c2cc(OC)cc(OC)c2)c2ccccc21	8811023	YKGHXDZNYLKIET-LPYMAVHISA-N	365.433	3.751	50	40	FHGB	
COC(=O)N/N=C/c1cn(CCOc2ccccc2C)c2ccccc12	1308175	NYICYGWNWRCYOK-FYJGNVAPSA-N	351.406	3.719	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)N(C)C)cc(Cl)c1OCc1ccccc1	59334262	WNQNIMXHHYEZPZ-SXGWCWSVSA-N	370.836	3.923	50	40	FHGB	
COc1ccc(/C(=N/NC(=O)c2ccccc2)c2ccc(C)cc2)c(O)c1	55152972	PHQJFEOFWLYMTR-XTQSDGFTSA-N	360.413	3.892	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)c1cc2cc(Cl)ccc2o1	409022537	PWQNDABUZHBNRI-OCKHKDLRSA-N	373.752	3.767	50	40	FHGB	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1ccc(F)cc1	8223352	PJIFUDHYQYSKTH-CYBMUJFWSA-N	367.380	3.599	50	40	FHGB	
C/C(=N/NC(=O)[C@@H]1C[C@@H]1c1ccccc1)c1cccc(NC(=O)C2CC2)c1	17074415	KDHORHKPXUVVTA-WSJMOLPHSA-N	361.445	3.679	50	40	FHGB	
CC(/C=C/c1ccc2c(c1)OCO2)=N\NC(=O)c1cc(Cl)ccc1O	4266810	FYRLVXFYTWKZGY-ULUXBISQSA-N	358.781	3.593	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)OC(C)(C)C)c(C)n1CCC(C)C	14013419	NKZWPMWQGRZOPX-WOJGMQOQSA-N	374.481	3.943	50	40	FHGB	
O=C(N/N=C/c1ccc(N2CCCCC2)o1)c1cc2ccccc2cc1O	33957652	VJLUIVAKLKSPGO-HYARGMPZSA-N	363.417	3.893	50	40	FHGB	
Cc1cc(C)c(OCC(=O)N/N=C\c2ccccc2)c(Br)c1	30900872	BFLCGLAALKVECA-GRSHGNNSSA-N	361.239	3.595	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C(\C)c1ccc(C)cc1	5578635	URMVSUYZJUQPKG-XDHOZWIPSA-N	361.239	3.920	50	40	FHGB	
CCCCCCCC(=O)N/N=C1/C(=O)Nc2ccc(Br)cc21	2676310	OEECHSIDYJSNJC-UHFFFAOYSA-N	366.259	3.582	50	40	FHGB	
CN1/C(=C(/C#N)C(=O)c2cc[n+](Cc3ccccc3)cc2)Nc2ccccc21	27232690	WZECEOSUSIYIQG-UHFFFAOYSA-O	367.432	3.502	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1cc2c(cc1Cl)OCO2	2270439	FJJHQQFVGWFXRE-INIZCTEOSA-N	372.808	3.520	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(C(=O)O)cc1	408725976	JPKCUHGAKOYNSA-VURRPDKYSA-N	362.838	3.669	50	40	FHGB	
O=[P@]1(N(CCCl)CCCl)NCC23C[C@@H]4CC(C[C@H](C4)C2)[C@@H]3O1	301054429	KQPFNDFZAYNYAJ-MGJQVNOHSA-N	367.257	3.689	50	40	FHGB	
Cc1c(/C=N/NC(=O)Cc2ccccc2)c(Cl)nn1-c1ccccc1	408895817	VWEUNAAMKITYJT-FYJGNVAPSA-N	352.825	3.527	50	40	FHGB	
N#C/C(=C\c1cccc(Oc2nc(Cl)ncc2F)c1)C(=O)N1CCCC1	409371066	FSGMJAQAPPSCGX-MDWZMJQESA-N	372.787	3.591	50	40	FHGB	
O=C(N/N=C\c1cc([N+](=O)[O-])ccc1N1CCCCC1)Nc1ccccc1	13286314	OPEPXXIFXYBKSU-ZHZULCJRSA-N	367.409	3.741	50	40	FHGB	
O=C(N/N=C/C=C/c1cccc([N+](=O)[O-])c1)c1cccc(Br)c1	9668337	AMCXTLTYGHKOKN-OBQYLLBLSA-N	374.194	3.786	50	40	FHGB	
O=C1CCC/C(=N/NC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1	103458432	JSUBBVFUSXJMPN-IWIPYMOSSA-N	358.401	3.526	50	40	FHGB	
COC(=O)c1ccc(NC(=O)[C@@]23CC[C@H]([C@H]2Br)C3(C)C)cc1	100919981	ZGDDAYBCQWSPDY-PBFPGSCMSA-N	366.255	3.611	50	40	FHGB	
COc1ccc([C@H]2C(C#N)=C(N)Oc3c2ccc(=O)c2c(C)oc(C)c32)cc1	807680	MEWLYERVPBCGNT-HXUWFJFHSA-N	374.396	3.637	50	40	FHGB	
N#C/C(=C\c1ccc(Cl)s1)C(=O)N1CCN(c2ccccc2)CC1	1098445	SVEUVWYUJDLSIZ-WYMLVPIESA-N	357.866	3.657	50	40	FHGB	
O=C(O)CC/C(=N\NC(=O)c1ccc(Cl)cc1Cl)c1ccccc1	17075016	JSHDDXKWRGZBTJ-HMMYKYKNSA-N	365.216	3.992	50	40	FHGB	
N#CCC(=O)N/N=C/c1cc(Br)c(Sc2ccccc2)o1	408998898	SMRXGDMBGYYWQM-RQZCQDPDSA-N	364.224	3.557	50	40	FHGB	
COc1cc(/C(C#N)=C/c2cc(OC)c3c(c2)OCO3)cc(OC)c1OC	66091381	DBEOZXYRHRZKBJ-LHHJGKSTSA-N	369.373	3.514	50	40	FHGB	
COc1ccc(C(=O)NNc2nc3c(Cl)cccc3s2)cc1OC	4121360	JFHJVPVSCGIBOC-UHFFFAOYSA-N	363.826	3.724	50	40	FHGB	
CC(C)C[C@@H](NC(=O)c1ccccc1)C(=O)N/N=C/C=C\c1ccccc1	12401324	PDDDDYPEJDNCMW-KCGYICQXSA-N	363.461	3.647	50	40	FHGB	
CCCOc1ccccc1/C=C(\C#N)C(=O)Nc1cccc([N+](=O)[O-])c1	6936592	HHOONCGJSWCKED-RVDMUPIBSA-N	351.362	3.929	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(Br)o2)cc1	993946	IJXZAQYYRYKEHA-WOJGMQOQSA-N	364.243	3.652	50	40	FHGB	
Cc1cccc(C)c1OCC(=O)N/N=C/c1cc(Br)cs1	3153832	LOISLPRFNUWKHP-REZTVBANSA-N	367.268	3.657	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2c[nH]nc2-c2ccc(Cl)cc2)cc1	8566838	ILQUOFJWBNHMBJ-SRZZPIQSSA-N	354.797	3.503	50	40	FHGB	
N#C/C(=C\c1ccc(OCc2ccc(F)cc2)cc1)C(=O)N1CCCC1	193407864	HGJZQAVIKGBGAG-QGOAFFKASA-N	350.393	3.934	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2cccc(C(F)(F)F)c2)cc1	255389315	AWEKKRLMBFQJGO-DHDCSXOGSA-N	360.335	3.937	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2nc3ccc(OC)cc3s2)cc1	834286	DRONLTQNOHJIEJ-UKTHLTGXSA-N	365.414	3.859	50	40	FHGB	
C/C(=N/NC(=O)CCC(=O)Nc1ccc(C)cc1C)c1ccc(C)cc1	12447452	ZMQQLWSIHBIIRB-QJOMJCCJSA-N	351.450	3.871	50	40	FHGB	
COc1cc(OC)c([N+](=O)[O-])cc1/C=C(\C#N)c1nc2ccccc2[nH]1	17072660	RFBFSUNULODRQU-KPKJPENVSA-N	350.334	3.552	50	40	FHGB	
CCOc1cc2c(cc1C[C@H](Br)CBr)OCO2	1652138	IVXMVUCZBLZXJQ-VIFPVBQESA-N	366.049	3.515	50	40	FHGB	
CNC(=O)/C(C#N)=C\c1cc(C)n(-c2sc3c(c2C#N)CCCC3)c1C	408820064	UWKWMCKVDBJWGG-DHDCSXOGSA-N	364.474	3.559	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1cn(CC(=O)Nc2ccccc2)c2ccccc12	5100595	OEVFTAOZQDRGMH-FOWTUZBSSA-N	373.412	3.750	50	40	FHGB	
O=C(CSc1cccc2ccccc12)N/N=C/c1ccc(C(=O)O)cc1	4545143	OMWBKZZRXHUZJY-CIAFOILYSA-N	364.426	3.780	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1ccc(O)cc1)c1ccc(N2CCCC2)cc1	408677578	SBONBOLHGSFNML-XQNSMLJCSA-N	374.444	3.547	50	40	FHGB	
N#CC(C#N)=Cc1ccc(SCC(=O)Nc2ccccc2)c([N+](=O)[O-])c1	408988286	DEDRHLPWNMMAAZ-UHFFFAOYSA-N	364.386	3.756	50	40	FHGB	
Cc1ccccc1NC(=O)/C(C#N)=C\c1cc(Cl)cc([N+](=O)[O-])c1O	408746110	XJFMEHMZAVRFQU-SDQBBNPISA-N	357.753	3.808	50	40	FHGB	
N#C/C(=C/c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCCCc1ccccc1	409229749	UOUMQZKCGFKHNI-WJDWOHSUSA-N	369.808	3.904	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CCSc2ccc(C)cc2)c(OC)c1	409128901	JHQVXFXCRHBUIQ-DEDYPNTBSA-N	358.463	3.645	50	40	FHGB	
CCCCCc1ccc(OCC(=O)N/N=C/c2ccccc2OC)cc1	3174527	AEPHFJLQSINHNI-PXLXIMEGSA-N	354.450	3.957	50	40	FHGB	
Cc1ccc(C)n1-c1ccc(C(=O)NNC2=CC(=O)CC(C)(C)C2)cc1	101771333	YUTWIKFTUGOWKG-UHFFFAOYSA-N	351.450	3.602	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@@H]2C[C@H]3C[C@H](CBr)[C@@H]2C3)cc1	4280489	SSOHWXRVPHYKLJ-MYZSUADSSA-N	359.285	3.510	50	40	FHGB	
CN1CCC(=NNC(=O)c2cc(-c3cccs3)nc3ccccc23)CC1	57884342	MHAGEDIEOXXHCG-UHFFFAOYSA-N	364.474	3.775	50	40	FHGB	
CCCCCOc1ccc(N/C=C(\C#N)C(=O)NCc2ccco2)cc1	3953668	HQZPWHHCTASQCR-JQIJEIRASA-N	353.422	3.984	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cccc(Cl)c2)c(C)n1-c1ccccn1	409233463	KQDITYJAPJXGPK-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
Cc1c(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)oc2ccccc12	6512099	AABRSHPGOBPTSS-UHFFFAOYSA-N	373.368	3.740	50	40	FHGB	
C[C@@](CCl)(CC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21	72481817	IOAUVNOTPSLZIT-FQEVSTJZSA-N	373.836	3.997	50	40	FHGB	
CC[C@H](C)n1nc(C)c(Cl)c1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2	253401010	MGXQOFHRCFNDRF-LKFCYVNXSA-N	360.845	3.631	50	40	FHGB	
O=C(CNc1ccc(Cl)cc1)N/N=C/c1ccc(Br)cc1	1052653	WJNFOUOQNKYUEE-DJKKODMXSA-N	366.646	3.665	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1ccccc1)c1ccc(F)cc1	1429124	PLFXXFHCUAQIOK-OEAKJJBVSA-N	361.376	3.842	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1ccc(-c2cccc(Cl)c2Cl)o1	5006495	KJPLQCNBRWGFME-PKNBQFBNSA-N	365.216	3.923	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)c(C)c1	8718316	FJYQXIAKGFMULE-UHFFFAOYSA-N	361.445	3.738	50	40	FHGB	
COc1ccc(Cl)cc1C(=O)N/N=C/c1cccc(Br)c1	2795980	IZRJWBYYWHKIJQ-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)c2cc(C3CC3)nc3ccccc23)cc1	1085730	DVWFAEVMMCLNOY-OEAKJJBVSA-N	358.445	3.942	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@]1(C(=O)Nc1ccccc1F)[C@H](Br)C2=O	100924377	SFCDVEAYTLQJKX-CSMYWGQOSA-N	368.246	3.923	50	40	FHGB	
CCOC(=O)C1=C(N)SC(c2ccccc2)=C(C#N)[C@H]1c1ccco1	20459299	LXSHUXBNXUPTPG-HNNXBMFYSA-N	352.415	3.778	50	40	FHGB	
Cc1ccc(C)n1-c1nc(CC(=O)NNc2cccc(Cl)c2)cs1	45080677	JKNBPCCBUIGVBW-UHFFFAOYSA-N	360.870	3.890	50	40	FHGB	
O=C(Cc1cccc(C(F)(F)F)c1)NNC(=O)c1cccc2ccccc12	9434855	DGSIWAKBOBGWDL-UHFFFAOYSA-N	372.346	3.862	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccc(F)c1	409393281	PPMJMANEDXAVIO-YBEGLDIGSA-N	353.353	3.635	50	40	FHGB	
N#CCn1cc(/C=N\NC(=O)c2cccc(-n3cccc3)c2)c2ccccc21	34807197	IKNCIXYUFHZISA-IWIPYMOSSA-N	367.412	3.719	50	40	FHGB	
Cc1ccccc1NC(=S)NNC(=O)c1ccc(Cl)cc1Cl	1438689	XOIDVPTXBCUNEI-UHFFFAOYSA-N	354.262	3.933	50	40	FHGB	
COc1ccc([C@H]2C(C#N)=C(N)Oc3n[nH]c(C(C)C)c32)c2ccccc12	8382692	QNKVSTPZQSCMQG-KRWDZBQOSA-N	360.417	3.913	50	40	FHGB	
C[C@@H]1[C@H](c2ccccc2)O[P@@](=O)(N(CCCl)CCCl)N1C	301054502	WSTLBKXVNMSQSJ-MTNMJMNLSA-N	351.214	3.966	50	40	FHGB	
COc1cccc(/C=N/NC(=O)c2cc3cccc(C)c3nc2C)c1OC	36612285	ZEZZZYYDHXLDKR-WSDLNYQXSA-N	363.417	3.633	50	40	FHGB	
CSc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1	96563344	SUOIJIDQTSNXLW-INIZCTEOSA-N	374.421	3.549	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2ccc(Br)s2)cc1C	1425054	UOVCEIXMKRYSHE-CAOOACKPSA-N	367.268	3.657	50	40	FHGB	
Cc1cc(C)c2cc([C@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)c(Cl)nc2c1	898795	XQZREJYHRKOPCL-INIZCTEOSA-N	365.824	3.755	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1	7893490	AEDUBVFJSZHLLX-HYARGMPZSA-N	373.368	3.524	50	40	FHGB	
Cc1cc(Cl)ccc1OCCCC(=O)NN=C1CCN(C(C)C)CC1	55072175	AGEOUTQRUVYRFN-UHFFFAOYSA-N	365.905	3.784	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OC(C)C	6209462	XVALWFOTDIAPMH-WOJGMQOQSA-N	350.418	3.706	50	40	FHGB	
O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1cccnc1)c1cccs1	7007115	OLJRGEKLOMNESM-LPYMAVHISA-N	373.441	3.760	50	40	FHGB	
N#CCC[C@H]1CCCC/C1=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1	408719373	COBJWPPSCTUEBW-XZOUCZQKSA-N	374.466	3.794	50	40	FHGB	
CCN(CC)c1ccc(NC(=O)/C(C#N)=C\c2ccc(O)c(OC)c2)cc1	408772057	JYDLRZJFHAQGGE-VBKFSLOCSA-N	365.433	3.793	50	40	FHGB	
Cc1cc(C(=O)O)ccc1-c1ccc(/C=C(/C#N)C(=O)NC2CCCC2)o1	409191478	IIMKZKPQLKJEFH-PTNGSMBKSA-N	364.401	3.919	50	40	FHGB	
O=C(CBr)c1ccc(Br)cc1Br	39255647	KNNILNUMRMDWJY-UHFFFAOYSA-N	356.839	3.789	50	40	FHGB	
CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C\c1ccccc1Cl)CO2	32109227	KKJNTPBEJZGNBM-JGVLGKFESA-N	372.852	3.928	50	40	FHGB	
CCO[Si](CCO[C@@H](CC)O[C@H]1CCCS1)(OCC)OCC	299888444	JUOVIGBDJWCFHQ-HUUCEWRRSA-N	352.569	3.657	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)CSCc2ccccc2Cl)cc1	5328474	SKCWVWBIVMLUHA-RGVLZGJSSA-N	361.898	3.790	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)o1)c1ccccc1-n1cccc1	2744509	KLTUAJQMBCHZTD-WOJGMQOQSA-N	358.195	3.597	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl)c1ccccn1	694908	KYGKCUYZMPIVIZ-JZOCJUILSA-N	352.221	3.696	50	40	FHGB	
CC(/C=N/NC(=O)COc1c(C)cc([N+](=O)[O-])cc1C)=C\c1ccccc1	3066683	JDOPTDVWLZUDPI-UEOFKOENSA-N	367.405	3.796	50	40	FHGB	
COc1ccc(Cl)cc1-n1c(C)cc(/C=C(/C#N)C(=O)N(C)C)c1C	59334460	IAZHPYBXDPWVFE-DHDCSXOGSA-N	357.841	3.751	50	40	FHGB	
COc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)c([N+](=O)[O-])cc1OC	5248613	WVBDQPFWXWDLIU-KPKJPENVSA-N	350.334	3.552	50	40	FHGB	
CCn1c(C)cc(/C=N\NC(=O)COc2ccc(Cl)cc2Cl)c1C	409074775	VNIWNLIHUABOMZ-UKWGHVSLSA-N	368.264	3.961	50	40	FHGB	
CCOC(=O)/C(C#N)=C\C=C(\c1ccc(Cl)cc1)N1CCSCC1	33384164	USJZNVLEWLWYQU-IGZCTHCLSA-N	362.882	3.743	50	40	FHGB	
O=C(Cc1ccccc1)Nc1ccc(C(=O)N/N=C/c2cccs2)cc1	6338498	NPHLKDYLENUYQZ-KGENOOAVSA-N	363.442	3.693	50	40	FHGB	
CCN(NC(=O)c1cc(-c2ccccc2OC)on1)c1ccc(C)cc1	30034419	OWZKJQMWQROBMX-UHFFFAOYSA-N	351.406	3.830	50	40	FHGB	
Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2cccc(Cl)c2Cl)c1	6796608	UDNPRIXSOKNBBW-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc(N2CCCC2)cc1	706054	MXZLEDYBRJAKBI-LJQANCHMSA-N	363.461	3.738	50	40	FHGB	
CCCCOC(=O)c1cc(-c2ccc(/C=C(\C#N)C(N)=O)o2)ccc1Cl	59416957	KPIDGSPVBSTHPX-UKTHLTGXSA-N	372.808	3.949	50	40	FHGB	
N#CC(Nc1ccc(OC(F)(F)F)cc1)=C1C(=O)c2ccccc2C1=O	2549803	WVTWVFOSZICHJA-UHFFFAOYSA-N	358.275	3.854	50	40	FHGB	
COc1cc(OC)c(/C=N/NC(=O)c2ccc(Cl)cc2)cc1Cl	408588829	JXBAOLJHQCGUKI-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
CCCc1[nH]nc2c1[C@H](c1ccc(OC3CCCC3)cc1)C(C#N)=C(N)O2	8382681	STCUPEZVMRQGQV-GOSISDBHSA-N	364.449	3.902	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1	408966547	PBKIOFYDMMJWBL-YBFXNURJSA-N	353.334	3.504	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccccc2C(F)(F)F)cc1[N+](=O)[O-]	695630	WBYCSGKIGSIEAQ-AWQFTUOYSA-N	351.284	3.686	50	40	FHGB	
N#CC(/N=C/c1ccccc1)=C(/C#N)NCc1sc(Cl)nc1Cl	33374260	QUGFRBCDMXDPOF-DXVIJHHWSA-N	362.245	3.917	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C\c2ccc(O[C@@H](C)C(=O)O)cc2)c1C	59679796	JNVNZVLPVOFUNW-ZCQLHAAUSA-N	364.401	3.701	50	40	FHGB	
CCOc1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)ccc1OC	818658	IROVYXILADISDQ-SFHVURJKSA-N	368.433	3.545	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccccc2F)c(OC)c1	4543775	JDQYYEJSRMLKJQ-UVTDQMKNSA-N	369.348	3.524	50	40	FHGB	
COc1ccc(-c2nc(C(=O)NN(C)c3ccccc3)cs2)cc1OC	7243184	NDQPLCCIEVIDFZ-UHFFFAOYSA-N	369.446	3.609	50	40	FHGB	
C=CCn1c(C)c(/C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21	408568839	XAOJWQMCOJCSJV-BKUYFWCQSA-N	362.389	3.808	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)c2cccc(NC(C)=O)c2)c2ccccc21	33859631	FJNGUQXXHXGWDO-OEAKJJBVSA-N	374.444	3.858	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1cn(CCOc2ccccc2C)c2ccccc12	872771	VTSKTJRZOOYKTE-GHRIWEEISA-N	359.429	3.682	50	40	FHGB	
N#C/C(C(=O)CSc1nccn1C1CC1)=C1\Nc2ccccc2S1	103076713	KSKGMAZHOMCFDW-VBKFSLOCSA-N	354.460	3.832	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)n1	84114502	LNMSYRGDECBPSZ-ZZXKWVIFSA-N	370.762	3.922	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2C)c(OCC)c1	216046585	DRXYSHASLOZEBV-HMAPJEAMSA-N	354.450	3.794	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-]	5618276	GDUOONONYFYYPI-QGMBQPNBSA-N	352.177	3.974	50	40	FHGB	
CC(C)c1ccc([C@@H]2[C@H]3CSCC=C3C(C#N)=C(N)C2(C#N)C#N)cc1	1438270	DOQZLYHJAPRIQA-RBUKOAKNSA-N	360.486	3.967	50	40	FHGB	
CCCc1nn(C)c2c1[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2	706888	GJNGPPWWXJJHNO-CYBMUJFWSA-N	363.248	3.898	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)Cc1ccc(OC)cc1	6581846	HMESMKWZYWAPMP-LFVJCYFKSA-N	372.424	3.553	50	40	FHGB	
N#C/C(=C/c1cccn1-c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(O)cc1	6815696	CVVJRCFPKLYYIW-KAMYIIQDSA-N	374.356	3.637	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)c1ccccn1	7893348	KWUIVAOOKHLFQX-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
O=C(N/N=C/c1c[nH]c2ccccc12)C(O)(c1ccccc1)c1ccccc1	824823	XSJDNXSXFZDZMT-PCLIKHOPSA-N	369.424	3.554	50	40	FHGB	
O=C(NNc1c(F)c(F)nc(F)c1F)Nc1cccc(C(F)(F)F)c1	3771015	OHXGGNGESONKBS-UHFFFAOYSA-N	368.212	3.805	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2C(C)=O)cc1OC	408757007	VNJNEJPRQGVCLI-WJDWOHSUSA-N	364.401	3.842	50	40	FHGB	
IC[C@H]1CCCC[C@@H]1CI	82133028	UYOGTWIDMSRPJU-HTQZYQBOSA-N	364.008	3.663	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2cc(Br)ccc2O)cc1	5720519	HTKOKEMOSWALPH-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)CCl	2641110	NCFQQSCEJZFFBI-UHFFFAOYSA-N	371.186	3.773	50	40	FHGB	
C[C@H](Oc1ccccc1Br)C(=O)N/N=C/c1ccccc1F	1085462	LCUOKKXRJXYLOJ-VSMYLPJWSA-N	365.202	3.506	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)Cc1ccc(OC)cc1	59426526	APSOHUVMWQTVFC-HZHRSRAPSA-N	362.429	3.940	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CSCc2cc(C)cc(C)c2)ccc1O	59473810	GNLUZSJRSIHVON-SRZZPIQSSA-N	372.490	3.791	50	40	FHGB	
O=C(COc1ccc(C2SCCS2)cc1)N/N=C/c1ccccc1	408570224	SVUOABSLRHIUJO-XDHOZWIPSA-N	358.488	3.694	50	40	FHGB	
N#C/C(=C/c1ccccc1OCc1ccc2ccccc2c1)C(=O)NC(N)=O	409254507	XNBZWOPQVFUYOM-UNOMPAQXSA-N	371.396	3.521	50	40	FHGB	
COc1ccc(Cl)cc1/C=N/NC(=O)c1ccccc1Br	20760609	MTAPXVFTYGSHDS-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
CCn1c(C)c(/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	408566480	GTDMJTZWJBIGNZ-NDENLUEZSA-N	350.378	3.642	50	40	FHGB	
CCN(CC)C(=O)/C(C#N)=C\c1ccc(-c2ccc(C)c(C(=O)O)c2)o1	408857026	MJHWPNNNBYHURP-GDNBJRDFSA-N	352.390	3.729	50	40	FHGB	
O=C(ON1C(=O)c2ccccc2O[C@@H]1CCCl)c1ccc(Cl)cc1	2577812	YQNBZPKMXWLIFZ-OAHLLOKOSA-N	366.200	3.902	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@@H]2C[C@@H]3C[C@H]2[C@H](CBr)C3)cc1	2145565	SSOHWXRVPHYKLJ-NZBPQXDJSA-N	359.285	3.510	50	40	FHGB	
Cn1nnc(-c2cccc(NC(=O)CCCC[C@@H]3CCSS3)c2)n1	79488306	QQBADZJVJWQBMS-CQSZACIVSA-N	363.512	3.530	50	40	FHGB	
CCOc1ccc(C=NNC(=O)[C@@H](C)Oc2cc(C)cc(C)c2)cc1OC	941957	RBMSJJQFZBQKRO-MRXNPFEDSA-N	370.449	3.628	50	40	FHGB	
Cc1ccc(N2C(S)=C(C#N)C(=O)N[C@H]2c2ccccc2Cl)cc1	4513584	VELRHYQCECLCPR-MRXNPFEDSA-N	355.850	3.948	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc(C)cc2C)cc1[N+](=O)[O-]	216047663	QFHPWEMRPCSHRR-RCCKNPSSSA-N	369.421	3.693	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)c2cccs2)c(OCC)c1	957969	WOTRZEXLWLKGNH-GXDHUFHOSA-N	371.414	3.836	50	40	FHGB	
O=C(CC(=O)NN=C1CCCCCCCCCCC1)NCc1cccnc1	5338162	VFUIOONBFJUXNE-UHFFFAOYSA-N	372.513	3.865	50	40	FHGB	
CC(C)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1	17073771	MPCMWQWYJFXIGI-GOSISDBHSA-N	357.413	3.870	50	40	FHGB	
CCCOc1ccccc1/C=N\NC(=O)c1ccc(OCC)c(OC)c1	6324717	ZKNFWGHSASYBME-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
O=[P@](O)(CCP(c1ccccc1)c1ccccc1)[C@H](O)c1ccco1	1241503	FQKIQDWJTOQAIR-IBGZPJMESA-N	374.313	3.674	50	40	FHGB	
CC[C@@H](Nc1ccc(C)cc1C)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1	654993	CTKHDSSFNLWURH-XNHPLOEXSA-N	354.410	3.552	50	40	FHGB	
C/C(=N\NC(=O)CNc1cccc(Cl)c1C)c1ccc([N+](=O)[O-])cc1	870319	QUGBJYNVMARQHY-UDWIEESQSA-N	360.801	3.509	50	40	FHGB	
C[C@@H](Cl)C(=O)Nc1cccc(C(=O)Nc2nnc(-c3ccccc3)o2)c1	9062117	PVXQJNICYYQYJV-LLVKDONJSA-N	370.796	3.555	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1cccc(Br)c1	20249030	DVNKOGVKZORUBO-VCHYOVAHSA-N	363.280	3.833	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=N\NC(=O)c2cccc(C)c2)cc1OCC	408949443	FLHDBIMRYPKJPP-XKZIYDEJSA-N	370.836	3.823	50	40	FHGB	
CCN(CC)c1ccc(/C=N\NC(=O)c2ccc(Br)cc2)o1	408948294	COYYVKOFCYGHPI-WQRHYEAKSA-N	364.243	3.652	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)cc1OC	408720333	ZDDKODUSYRKJFO-HFITWMCCSA-N	370.474	3.891	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)Cc2ccc(C)cc2C)cc(Cl)c1O	216043526	RUYDJFBGOZNONW-NHDPSOOVSA-N	360.841	3.754	50	40	FHGB	
C/C(CCc1ccccc1)=N/NC(=O)C(=O)Nc1ccc(C(C)C)cc1	59515722	JFVJIZBLUGPUIU-KQWNVCNZSA-N	351.450	3.873	50	40	FHGB	
COc1ccc([C@H]2CC(c3cccs3)=NN2C(=O)CCl)cc1OC	3886989	AQTIYCHYBRWPPP-CYBMUJFWSA-N	364.854	3.682	50	40	FHGB	
Cc1c2ccccc2c(/C=N/NC(=O)CC2(C)OCCO2)c2ccccc12	6188520	MINPZYKFJAOELL-OEAKJJBVSA-N	362.429	3.905	50	40	FHGB	
C[C@@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3F)[C@H]2C1	5595716	QBQKOQFOCNSULL-DJCROIMJSA-N	350.372	3.804	50	40	FHGB	
O=C(Cc1ccc(Br)cc1)N/N=C/c1c[nH]c2ccccc12	4735266	QHBNMEDHSQFCRH-RGVLZGJSSA-N	356.223	3.623	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)sc(N)c1C#N	408723766	KURXFAYHSVHNIO-KPSZGOFPSA-N	353.234	3.581	50	40	FHGB	
CCO[P@@](=O)(CI)Oc1ccc([N+](=O)[O-])cc1	5576182	MMEKEECKFQQOMD-KRWDZBQOSA-N	371.067	3.596	50	40	FHGB	
O=C(N/N=C/c1cn(Cc2ccccc2)c2ccccc12)c1ccccn1	847890	VPJXWSKNLDZQSE-ZVHZXABRSA-N	354.413	3.849	50	40	FHGB	
CCOC(=O)Cn1cc(/C=C(\C#N)C(=O)Nc2ccccc2)c2ccccc21	871906	HNIGVCSCQKVLKV-FOWTUZBSSA-N	373.412	3.750	50	40	FHGB	
CCN1CC=C2[C@@H](C1)[C@H](c1ccc(C(C)C)cc1)C(C#N)=C(N)C2(C#N)C#N	34914867	YAPQBNGFTOKIEC-TZIWHRDSSA-N	371.488	3.555	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccc(F)cc1	4814018	NCLMWSJXWRIDTC-JAIQZWGSSA-N	353.309	3.758	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccc(C)c(C)c1	408875542	JXWNLAIALAHMTI-VCHYOVAHSA-N	350.418	3.673	50	40	FHGB	
N#C/C(=C\c1cccc(Br)c1)C(=O)Nc1ccc(C(=O)O)cc1	2632413	NCCJWNHYPXFNPV-MDWZMJQESA-N	371.190	3.693	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2	3898781	MPRCLQBKACCGQY-UHFFFAOYSA-N	356.510	3.567	50	40	FHGB	
O=C(N/N=C/c1cccnc1)c1cc(-c2cc(Cl)cc(Cl)c2)n[nH]1	18091148	SFOJKZWRRAGWTO-AWQFTUOYSA-N	360.204	3.542	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)ccc1OC(C)=O	4132427	FUBSZVUQAJZNDZ-LPYMAVHISA-N	368.433	3.682	50	40	FHGB	
O=C(COc1ccc(C2SCCS2)cc1)N/N=C/C=C/c1ccco1	408570237	SXNIHYLRMOPILV-XUACOFDLSA-N	374.487	3.952	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(C)c(C)c1)OCO2	409074107	KEQFDCRPABWQKJ-VIZOYTHASA-N	350.374	3.586	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)cc1[N+](=O)[O-]	409113219	HCNRJCHBRWLIMO-OTGIAGGSSA-N	373.434	3.543	50	40	FHGB	
CCc1ccc(NC(=O)/C(C#N)=C\c2cc(OC)c(OC)c(OC)c2)cc1	214073815	JGGMJUVRZAVIFX-YBEGLDIGSA-N	366.417	3.820	50	40	FHGB	
CCc1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1	4724087	IYGCMMMDUMYXFO-JJIBRWJFSA-N	358.441	3.635	50	40	FHGB	
O=C(NNc1ccccc1[N+](=O)[O-])c1csc(-c2ccc(F)cc2)n1	15631786	CNNFTYYXXOZABL-UHFFFAOYSA-N	358.354	3.614	50	40	FHGB	
Cc1ccc(SCC(=O)N/N=C/c2ccc(OC3CSC3)cc2)cc1	408863333	NDPDPDKKVFITMC-KEBDBYFISA-N	372.515	3.732	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C\c1cc(Cl)cc([N+](=O)[O-])c1O)c1ccccc1	97994052	KUQLXLLTNAYQOM-DKTFCQPKSA-N	371.780	3.738	50	40	FHGB	
CCN(CC)C(=O)[C@H](Br)[C@H](Br)c1ccccc1	1690344	ZNLSNPVEZHLCGQ-VXGBXAGGSA-N	363.093	3.755	50	40	FHGB	
O=S(=O)(Cc1ccccc1)[C@@H](I)c1ccccc1	6575147	ZZBNUHVTCUZKLL-CQSZACIVSA-N	372.227	3.735	50	40	FHGB	
COc1cc(/C=N\NC(=O)c2cccc3ccccc23)cc(Cl)c1O	108334692	QCJVSJUWFWTTEM-NHDPSOOVSA-N	354.793	3.971	50	40	FHGB	
O=C(N/N=C/c1ccc(O)cc1)c1cccc(N2Cc3ccccc3C2)c1	59503618	AHFNXCMQGBNCHO-YDZHTSKRSA-N	357.413	3.676	50	40	FHGB	
Cc1cc(/C=N/NC(=O)COc2ccccc2)c(C)n1-c1ccc(F)cc1	58928194	XZJFANBSRUASIB-YDZHTSKRSA-N	365.408	3.762	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc(Cl)c2)o1)C(=O)NC[C@@H]1CCCO1	26967835	QQMZHIQDXGNFQZ-SHRNQRGKSA-N	356.809	3.802	50	40	FHGB	
CCCOC(=O)c1cc(-c2ccc(/C=C(\C#N)C(N)=O)o2)ccc1Cl	59416946	HDXYSRFKTSDXQB-XYOKQWHBSA-N	358.781	3.559	50	40	FHGB	
COc1ccc(N/C=C(\C#N)S(=O)(=O)c2ccc(C(C)(C)C)cc2)cn1	5250002	AAABVZKENIXXPJ-GHRIWEEISA-N	371.462	3.638	50	40	FHGB	
O=C(N/N=C\c1ccc(N2CCCC2)cc1)c1cccc(-n2cccc2)c1	408961625	UDFQPGNBESCYOK-QJOMJCCJSA-N	358.445	3.841	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2ccc3c4c(cccc24)CC3)cc1OC	408858821	PXQNTGWCUZDRBV-ZVHZXABRSA-N	374.440	3.648	50	40	FHGB	
CC[C@H](C)c1ccc(OCC(=O)N/N=C\c2cc(OC)ccc2OC)cc1	30822048	VKNVUSPYOBADSR-PXNCGERRSA-N	370.449	3.746	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2cc(Cl)cc(OC)c2O)cc1	408746806	VXKGTQMYAGLVGA-GHXNOFRVSA-N	358.781	3.608	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1	96840680	SDSSCPKLCMKECB-XFFZJAGNSA-N	359.769	3.940	50	40	FHGB	
CCOc1ccc([C@@H](O)CCC(=O)N/N=C/c2ccccc2Cl)cc1	4535245	XJKMPANUSUHRAD-LANLRWRYSA-N	360.841	3.703	50	40	FHGB	
O=C(N/N=C/c1ccc2ccccc2c1O)c1ccc(Br)o1	2794930	SRNRIIRLFJBOPI-GIJQJNRQSA-N	359.179	3.665	50	40	FHGB	
CN1/C(=C\C=N\NC(=O)COc2ccccc2F)C(C)(C)c2ccccc21	7738110	ALOYWYOWQKPDLG-CZACTKFKSA-N	367.424	3.618	50	40	FHGB	
CC[C@H](C)Oc1c(Cl)cc(/C=C(\C#N)C(=O)OCCOC)cc1OC	9973302	IIBGKHWTGHRLJX-ACLQVGRQSA-N	367.829	3.622	50	40	FHGB	
N#C/C(=C/NC(=S)NCc1ccccc1)c1nc2ccccc2s1	104304819	UANFNSTZUFFIIV-OWBHPGMISA-N	350.472	3.825	50	40	FHGB	
CCN(Cc1ccccc1)c1ccc(/C=N/NC(=O)c2cccnc2)cc1	3335162	VABAYOZVLXBJQI-BUVRLJJBSA-N	358.445	3.872	50	40	FHGB	
O=C(NNC(=O)C1CC1)c1cc(-c2ccc(Cl)cc2)nc2ccccc12	12863421	PGMWFBQUVKPHIL-UHFFFAOYSA-N	365.820	3.726	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)c2cc(-c3ccc(Cl)s3)n[nH]2)cc1	13618775	PQLHSEFITSDIMB-VXLYETTFSA-N	374.853	3.954	50	40	FHGB	
CCN(C(=O)COC(=O)/C(C#N)=C\c1ccc(Cl)cc1)C1CCCCC1	6173156	UFGUWFIEELALQS-VBKFSLOCSA-N	374.868	3.971	50	40	FHGB	
Cc1cc(C)c2[nH]c(C)c(CC(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)c2c1	4673377	PZJBGOLNAJEWBD-SRZZPIQSSA-N	364.405	3.694	50	40	FHGB	
COc1cccc2c(SCC(=O)N/N=C/c3ccccc3)cc(C)nc12	871146	QMESKNDVBGABMD-CIAFOILYSA-N	365.458	3.794	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)c2ccn(Cc3ccc(Cl)cc3)n2)c(C)c1	2738811	DRLFBTLJXHUKIZ-WSDLNYQXSA-N	366.852	3.966	50	40	FHGB	
O=C(CCCCBr)c1ccc(OCCN2CCCC2)cc1	575359009	MNYGNMZYYDPXBE-UHFFFAOYSA-N	354.288	3.909	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-]	58885265	IQCJHGOYDHHUAX-LSCVHKIXSA-N	368.176	3.674	50	40	FHGB	
Cn1cc(C(=O)N/N=C/c2cc(Br)cs2)c2ccccc21	2453487	BDQNAKXWAJQBRR-REZTVBANSA-N	362.252	3.766	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])c(C)n1-c1ccccc1	6286399	WNJSOBRJCXVLSC-FYJGNVAPSA-N	362.389	3.766	50	40	FHGB	
CC(C)Oc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(C(=O)O)cc1	6538761	YMSVTOVIRWNNFA-LFIBNONCSA-N	350.374	3.718	50	40	FHGB	
IC[C@@H]1CCCC[C@H]1CI	82133027	UYOGTWIDMSRPJU-YUMQZZPRSA-N	364.008	3.663	50	40	FHGB	
COC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(SC)cc2)cc1	223174090	PWCGHGFWESXVQD-PTNGSMBKSA-N	352.415	3.741	50	40	FHGB	
N#C/C(=C\c1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(Cl)c1	4090736	URAVBKVVQKCFAQ-FOWTUZBSSA-N	367.836	3.722	50	40	FHGB	
COc1ccc(C)c2sc(NNC(=O)c3nc4ccccc4s3)nc12	4121472	QWEGGMSSAHPOKT-UHFFFAOYSA-N	370.459	3.980	50	40	FHGB	
Cc1ccc2nc(SCC(=O)NNC(=O)C3CCCCC3)c(C)cc2c1	881311	KORWEFZAYOSBGL-UHFFFAOYSA-N	371.506	3.671	50	40	FHGB	
O=C(NN/C=C1\S/C(=N\c2ccccc2)N=C1Cl)c1ccccc1	105461634	NTVPKHFKXMAMFG-SKPTZGHVSA-N	356.838	3.834	50	40	FHGB	
O=C(O)CC/C(=N\NC(=O)Cc1cccc2ccccc12)c1ccccc1	4156443	LPIGZRLHBUNPAZ-BSYVCWPDSA-N	360.413	3.768	50	40	FHGB	
N#C/C(=C\c1cccnc1)C(=O)Nc1c(Cl)cc([N+](=O)[O-])cc1Cl	408896205	QGLQIUMSAQAFRK-ONNFQVAWSA-N	363.160	3.842	50	40	FHGB	
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CCl	605693538	MBKAANDQMJJTRM-DGEXFFLYSA-N	374.908	3.999	50	40	FHGB	
Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3cccc(Cl)c3)c2)n1	6189273	PJGBPRUBSIYCFI-WSDLNYQXSA-N	366.852	3.966	50	40	FHGB	
COc1ccc(NCC(=O)/C(C#N)=C(\C)Nc2ccc(OC)cc2)cc1	102749584	IKTVQOBDEKHJSF-XMHGGMMESA-N	351.406	3.594	50	40	FHGB	
COc1cc(Br)c(/C=C(\C#N)C(=O)C(C)(C)C)cc1OC	6823148	RXHYYVUNANIDHV-IZZDOVSWSA-N	352.228	3.988	50	40	FHGB	
C[C@@H](Oc1ccc(/C=C(/C#N)C(=O)Nc2cccc(Cl)c2)cc1)C(=O)O	59249950	MTBXVTOUPFQXCP-OJLMPMFISA-N	370.792	3.738	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)c2cccc(Br)c2)c1	59471533	PMXWMPPUGCWEQY-XDHOZWIPSA-N	359.223	3.778	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C\c2ccc(N(CC)CC)cc2)cc1	408711843	NHKQTOKPWHWAAP-JWGURIENSA-N	353.466	3.624	50	40	FHGB	
Cc1cccc(-n2c(C)cc(/C=N/NC(=O)[C@@H](O)c3ccccc3)c2C)c1	408589934	NMRHXNGGHXSJSA-VSIOZEBNSA-N	361.445	3.586	50	40	FHGB	
Cc1ccc(/C(C#N)=C/c2ccc(OCC(N)=O)c(Br)c2)cc1	408579331	FUZDPZFQVINJDO-OVCLIPMQSA-N	371.234	3.686	50	40	FHGB	
O=C(O)c1cc(Br)c(CBr)c(Br)c1	98210790	YGUIGKFBULNEOB-UHFFFAOYSA-N	372.838	3.805	50	40	FHGB	
N#CC1=C2SCN(Cc3ccccc3)CN2C(=O)C[C@H]1c1ccccc1	20517475	VVFMQWOKWDJISL-SFHVURJKSA-N	361.470	3.902	50	40	FHGB	
CCC[C@@H](C)CC(CCBr)(C(=O)OCC)C(=O)OCC	1760287	ISNOAFJMQNMZLU-GFCCVEGCSA-N	351.281	3.710	50	40	FHGB	
O=C(N/N=C/C=C/c1ccc2c(c1)OCO2)c1cc2ccccc2cc1O	4893904	XARVVTDTAGNSDX-UKFDIXNYSA-N	360.369	3.703	50	40	FHGB	
CCCCSc1nc(C)cc(SCC(=O)N/N=C/c2ccccc2)n1	2258994	NSQNQMXDOLYZOF-XDHOZWIPSA-N	374.535	3.920	50	40	FHGB	
CCCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2C)[C@@H](C#N)C(O)=N1	2310115	YONWMCQRGAWENO-PBHICJAKSA-N	369.446	3.610	50	40	FHGB	
COc1ccccc1/C=N\NC(=O)COc1ccc(-c2ccccc2)cc1	13943744	NVOBKVFSMBEIKA-HAHDFKILSA-N	360.413	3.891	50	40	FHGB	
CCC1=C(C(=O)OC)[C@H](c2c(Cl)cccc2Cl)C(C#N)=C(N)O1	4652916	SFRVUXHENOVFPH-LBPRGKRZSA-N	353.205	3.638	50	40	FHGB	
COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccccc2OC(C)C)cc1	408804023	CBNKDNCIBVJKAD-SFQUDFHCSA-N	364.401	3.806	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)cc1C(C)C	33658097	DVDMMDQURSEUTC-WSDLNYQXSA-N	367.449	3.849	50	40	FHGB	
N#C/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Br)cc1	5757096	RSOHQHHXBXCQCM-WQLSENKSSA-N	372.178	3.903	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccc(F)cc2)o1)C(=O)NCCN1CCCCC1	1463451	VJHIPABVJOOXQL-VKAVYKQESA-N	367.424	3.595	50	40	FHGB	
CCOC(=O)c1c(NC(=O)CCCCl)sc2c1CC(C)(C)OC2	2346380	PGMSLNBPMROQIC-UHFFFAOYSA-N	359.875	3.734	50	40	FHGB	
O=C(NNC(=O)c1ccccc1OCc1ccc(Cl)cc1)c1ccco1	13006346	SEUQHGKWJOGBCE-UHFFFAOYSA-N	370.792	3.587	50	40	FHGB	
COc1cc(/C=C(/C#N)c2nc3ccc(C)cc3[nH]2)c([N+](=O)[O-])cc1OC	33467177	MJQDYNUMIKBFJM-QPEQYQDCSA-N	364.361	3.861	50	40	FHGB	
C=CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)N[C@@H](C)CC	408814122	QFHMZTSCRRYXJG-IGVUGNCQSA-N	363.255	3.836	50	40	FHGB	
N#C/C(=C/c1cc(Cl)cc(Br)c1O)C(=O)NC1CCCC1	409188897	BUVRJTWYHAOLMX-YHYXMXQVSA-N	369.646	3.774	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C\c1cccn1-c1ccc(O)cc1)c1ccccc1	409241888	ZEYVWDNZBMMDOA-IYWFSZBXSA-N	357.413	3.967	50	40	FHGB	
CC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2cccc(OC)c2OC)cc1	1320100	QVQPUOAQDZPUIR-IKMPRTQCSA-N	370.449	3.746	50	40	FHGB	
Cc1ccc([C@@H]2CC(=O)NC(SCC(=O)c3ccccc3)=C2C#N)cc1	8973434	FCACBQDWZZWVGY-KRWDZBQOSA-N	362.454	3.950	50	40	FHGB	
CCCc1[nH]nc2c1[C@@H](c1cc3ccccc3nc1Cl)C(C#N)=C(N)O2	6720057	FHALIXORRKSYTL-HNNXBMFYSA-N	365.824	3.782	50	40	FHGB	
O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(-c2ccccc2)cc1	33705060	CYXYLZDIELYAJL-JCMHNJIXSA-N	359.385	3.955	50	40	FHGB	
CC1(C)CC(=O)C/C(=N/NC(=O)COc2ccc(Cl)cc2Cl)C1	100233088	YVTZQTYIRSOZPH-ODLFYWEKSA-N	357.237	3.624	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)c2ccc(NC(=O)C(C)(C)C)cc2)cc1	59515249	ISKPJGKPZFRQKD-HYARGMPZSA-N	366.465	3.501	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(OC)ccc2OC)cc1	67190149	BHNTYMXEYRLARN-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
N#C/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)NC1CCCC1	254987036	AUBSCDNCWFRZLJ-KAMYIIQDSA-N	351.362	3.821	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)cc(OC)c1OC	6209511	KZYKIYSAQBAMBB-OQLLNIDSSA-N	352.390	3.567	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)N(C)C)c(C)n1-c1ccccc1Br	59334443	IUSXGBCFKOMNTF-GDNBJRDFSA-N	372.266	3.852	50	40	FHGB	
O=C(Cl)[C@@H]1CC(=O)N(c2ccc3oc(-c4cccc(F)c4)nc3c2)C1	57327088	YDQBEHQFRWSVCL-LLVKDONJSA-N	358.756	3.752	50	40	FHGB	
CCOc1ccccc1OCC(=O)N/N=C/c1ccc(C(C)(C)C)cc1	3277290	RSYUSROXMNTKGT-HYARGMPZSA-N	354.450	3.912	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccccc1F	59333744	WYVYVCHJZFDNSK-BOPFTXTBSA-N	368.408	3.799	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(C)c2)cc1C(=O)O	409162425	DUERSOUCBZKAQR-XNTDXEJSSA-N	350.374	3.638	50	40	FHGB	
COc1ccc(-n2cccc2/C=N\NC(=O)Nc2ccccc2OC)cc1	408954326	SNBXZLLHNAXEAM-STZFKDTASA-N	364.405	3.650	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C(\C)c2c(OC)cccc2OC)cc1	216069813	CCXILLZIISTLTF-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
O=C(NNC(=O)c1ccccc1)N[C@H](c1ccc(F)cc1)c1cccs1	45127881	BXOSYLLQMCRDIC-QGZVFWFLSA-N	369.421	3.621	50	40	FHGB	
COc1cc(C(=O)N/N=C/c2cccc(Oc3ccccc3)c2)ccc1O	15934531	PLMGULBGEORUQB-HYARGMPZSA-N	362.385	3.957	50	40	FHGB	
O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1cccc2ccccc12	6476706	MSGWKFYNGPDJDR-UFFVCSGVSA-N	352.777	3.986	50	40	FHGB	
O=C(CSCc1ccc(Br)cc1)N/N=C/c1ccccc1	1434902	KQPLBEHQNYDNEK-VCHYOVAHSA-N	363.280	3.833	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)cc1	3067342	AGNGZEJLJOZLOF-CIAFOILYSA-N	373.840	3.526	50	40	FHGB	
C/C(=N/NC(=O)[C@H]1COc2cc3ccccc3cc2O1)c1ccc(C)cc1	4893923	CBSDTIKTICOLJP-FYYJVHHASA-N	360.413	3.828	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)c(C)c1	6843915	JKGHUAYEFLHVBR-DNTJNYDQSA-N	367.232	3.845	50	40	FHGB	
O=C(NNc1ccc(Br)cc1)c1ccc(Br)cc1	6926295	BGWJMCDTQPYJTN-UHFFFAOYSA-N	370.044	3.969	50	40	FHGB	
CC/C(=N\NC(=O)Cc1ccc(Br)cc1)c1cccs1	15933877	AMJUMPKFBJXMEJ-GHRIWEEISA-N	351.269	3.984	50	40	FHGB	
CC(C)OC(=O)N[C@H]1c2ccccc2CC[C@@H]1I	17352950	XVBFCQDDPWPAKJ-STQMWFEESA-N	359.207	3.612	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2OC(C)C)c(C)c1	20195416	FCPDVJRAVDRBCC-CIAFOILYSA-N	369.421	3.692	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/c2cc(Cl)ccc2O)cc(C)c1Cl	30937413	RRAQHIVYWHNYJR-DNTJNYDQSA-N	367.232	3.845	50	40	FHGB	
CC1(C)[C@@]2(C)CC[C@@]1(C(=O)NC1CCCCC1)[C@H](Br)C2=O	100834614	VKMWSCRLAWWBDN-DQYPLSBCSA-N	356.304	3.594	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc(OC)c1O	408816440	YUCGOIOCQMJLLR-KFRPNGRJSA-N	354.450	3.731	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)c2cc3ccccc3cc2OC)c1	33761292	CZQSWAXCBVYOSE-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
C[C@H]1CCCC[C@H]1NC(=O)/C(C#N)=C/c1cc(Br)ccc1O	408804160	CQDOFLNLXSXAFE-PCKNOYNLSA-N	363.255	3.757	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccccc1OCC#N	408810157	LPVJETGDXMDBKP-GXDHUFHOSA-N	367.792	3.797	50	40	FHGB	
O=C(O)CCCC[PH](c1ccccc1)(c1ccccc1)c1ccccc1	100991606	PCQABCAZWQTQDN-UHFFFAOYSA-N	364.425	3.968	50	40	FHGB	
O=C(CBr)Nc1cccc(NC(=O)CCc2ccccc2)c1	35605315	BLEQXANAMHPWJI-UHFFFAOYSA-N	361.239	3.591	50	40	FHGB	
CCOc1ccc([C@H]2C(C#N)=C(N)N3C(=C2C#N)Nc2ccccc23)cc1	2267836	NRHOLPCJXJFZGK-IBGZPJMESA-N	355.401	3.544	50	40	FHGB	
N#Cc1ccc(/C=N\NC(=O)c2cc3cc(Br)ccc3o2)cc1	34388517	VXAICNIUVDPXJJ-JMIUGGIZSA-N	368.190	3.831	50	40	FHGB	
COC(=O)c1sc(NC(=O)CCCC[C@H]2CCSS2)nc1C	79189102	KZNSQZFKQXWMTP-JTQLQIEISA-N	360.526	3.891	50	40	FHGB	biogenic
COc1ccc(C[C@@H](C)Oc2ccc(/C=C/C=O)cc2OC)cc1OC	49181096	PUDXYWKCEYLTMQ-LLYBFZRZSA-N	356.418	3.935	50	40	FHGB	biogenic,in-vitro
Cc1ccc(S(=O)(=O)O[C@@H](C#N)CO[Si](C)(C)C(C)(C)C)cc1	206562587	PIXYABSVURGQOD-AWEZNQCLSA-N	355.532	3.614	50	40	FHGB	in-vitro
CN(C)c1ccc2c(c1)N1Cc3ccccc3C1=N[P@]2(=O)c1ccccc1	3198952	YMNAAPWDEUIUCN-MHZLTWQESA-N	373.396	3.762	50	40	FHGB	
COc1ccc(Br)cc1/C=N\NC(=O)c1ccc(Cl)cc1	13838256	AKAFHWSJNUWAIJ-NVMNQCDNSA-N	367.630	3.875	50	40	FHGB	
Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)COc2ccccc2)c1C	58926861	BPKGVXQJXGYYQO-OEAKJJBVSA-N	361.445	3.932	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(C)c(C)c1	408801063	RMLJSHDTFBKIBI-LDADJPATSA-N	360.413	3.870	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1	408838481	WWVNBHNQVMSKLA-YBFXNURJSA-N	359.769	3.577	50	40	FHGB	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)c1	851418	KUBMGLIWYHSEAE-UHFFFAOYSA-N	374.440	3.810	50	40	FHGB	
COC(=O)[C@@]12CC[C@@H](C1)C(C)(C)[C@@]2(Br)CBr	5645070	XXGJBUQJCZYXKR-AXTRIDKLSA-N	354.082	3.514	50	40	FHGB	biogenic
Cc1cc(C(=O)OCC(=O)/C(C#N)=C2/Sc3ccccc3N2C)c(C)o1	33462924	UTGRGPFLAOIZRU-NBVRZTHBSA-N	368.414	3.600	50	40	FHGB	
COc1ccc(S(=O)(=O)/C(C#N)=C/c2c(C)[nH]c3ccccc23)cc1	80345388	WIUVMPBRBXDLMU-LFIBNONCSA-N	352.415	3.823	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)ccc1OCC#N	408805894	IBOWLRBYHBANQS-YFCLQTKISA-N	367.449	3.590	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C\c1cccn1-c1ccc(O)cc1)c1ccccc1	409241891	ZEYVWDNZBMMDOA-VVZNPABPSA-N	357.413	3.967	50	40	FHGB	
COc1cccc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)c1OC	409136884	YUIWQPGVXHLORQ-PVGUKEHMSA-N	358.463	3.643	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)cc1Cl	408890117	OCEZDGAIOMEFDF-XYOKQWHBSA-N	356.765	3.592	50	40	FHGB	
CCO/C=N/C1=C(C#N)[C@@H](c2ccccc2)C(C(=O)OCC)=C(CCl)O1	226762242	VAEGZCAOSHVGRO-LTNVFZTJSA-N	374.824	3.656	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1ccc(Br)cc1	12346203	MIWRFBMPWTVXBT-VCHYOVAHSA-N	363.280	3.833	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)o1)c1cc2ccccc2cc1O	33599730	AMFQJXXTEUFUEI-GIJQJNRQSA-N	359.179	3.665	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc2c(c1)OCO2	5531590	LTWRHFDREYKFSA-YXZFXQPTSA-N	362.838	3.700	50	40	FHGB	
CCc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(Cl)c(Cl)c1	3085666	WKSLQPMZRCNUHI-KEBDBYFISA-N	364.232	3.645	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)NC2CCCC2)cc1OCC	4616808	JNKUOCWACCRYJY-XNTDXEJSSA-N	372.852	3.716	50	40	FHGB	
CSCc1c(C(=O)NNc2ccccc2[N+](=O)[O-])oc2ccccc12	15502640	OABSOGRRWNIHRM-UHFFFAOYSA-N	357.391	3.961	50	40	FHGB	
Cc1ccc(-c2nc(C#N)c(NNC(=O)C(F)(F)c3ccccc3)o2)cc1	35681929	XTAZBDVWEIUBNN-UHFFFAOYSA-N	368.343	3.757	50	40	FHGB	
O=C(NNc1cccc(C(F)(F)F)c1)c1cncn1-c1ccc(F)cc1	69525393	KCHZQOKNGSAYQP-UHFFFAOYSA-N	364.302	3.787	50	40	FHGB	
Cc1cc(OCC(=O)NNC(=O)c2cccs2)c(C(C)C)cc1Cl	999231	JACGJTPZKPUTJY-UHFFFAOYSA-N	366.870	3.673	50	40	FHGB	
CCOC(=O)c1c(NC(=O)C(Cl)Cl)sc2c1CC[C@H](C)C2	943476	QFHVUIQHLMPAJA-ZETCQYMHSA-N	350.267	3.792	50	40	FHGB	
O=C(NNC(=O)c1cc2cc3ccccc3nc2s1)c1ccc(F)cc1	1399203	RJCOQNMWGCBTBK-UHFFFAOYSA-N	365.389	3.663	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccccc1C(=O)O	20246291	PPHHXIYIJLDLEA-VSMYLPJWSA-N	362.838	3.669	50	40	FHGB	
CC(=O)N/N=C/c1ccccc1OCCCOc1ccc(Cl)c(C)c1	4599287	VKCSJOFQGVYIGH-FYJGNVAPSA-N	360.841	3.966	50	40	FHGB	
CC(C)(C)C1=CC2=S(S1)N(c1ccc([N+](=O)[O-])cc1)N=C2[N+](=O)[O-]	17118445	FGRRWCIANRWOCI-UHFFFAOYSA-N	366.424	3.953	50	40	FHGB	
Cc1ccc(CSCC(=O)N/N=C/c2ccc(N3CCCCC3)o2)cc1	408993944	DURQBASRZSNUJU-FYJGNVAPSA-N	371.506	3.962	50	40	FHGB	
CC[C@@H](C)NC(=O)/C(C#N)=C/c1c[nH]nc1-c1ccc(Br)cc1	96311088	MVURYBPRLJHGPW-KAQJVSAMSA-N	373.254	3.661	50	40	FHGB	
O=C(O)c1cccc(-c2ccc(/C=N\NC(=O)c3ccc(F)cc3)o2)c1	15938636	LZZCJXBDKZMILZ-NHDPSOOVSA-N	352.321	3.548	50	40	FHGB	
O=C(O)c1ccnc([C@H]2CCCC/C2=N\NC(=O)c2ccccc2Cl)c1	16778491	ODDQEWDZHIGXPT-USIKMKBCSA-N	371.824	3.877	50	40	FHGB	
O=C(OCCCCCl)[C@H]1CC=CC[C@H]1C(=O)OCCCCCl	5373378	LBTPPVFWGKEQJP-OKILXGFUSA-N	351.270	3.693	50	40	FHGB	
Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1ccc(Cl)c(Cl)c1	226366769	CIFHGNBFYJOJLE-UHFFFAOYSA-N	362.216	3.549	50	40	FHGB	
O=C(N/N=C\c1cccc(O)c1)c1cccc(N2Cc3ccccc3C2)c1	32123401	JGZKWYMCEHCINO-QRVIBDJDSA-N	357.413	3.676	50	40	FHGB	
O=C(ON1C(=O)c2ccccc2O[C@H]1CCCl)c1ccccc1Cl	3079439	RZZTUGOSOZTEBO-HNNXBMFYSA-N	366.200	3.902	50	40	FHGB	
N#C/C(=C/c1ccc(C#N)cc1)S(=O)(=O)c1ccc(Br)cc1	96891616	KUSNGLGTYRZJGM-SXGWCWSVSA-N	373.231	3.659	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)COc1cccc(C)c1C	989947	FIVQCDOOLYCXFQ-YDZHTSKRSA-N	362.429	3.994	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)NC2CCCC2)cc1Br	4546477	DTDPCZQXCKSSOE-UKTHLTGXSA-N	363.255	3.814	50	40	FHGB	
CCOC(=O)/C(C#N)=C/Nc1nc2ccc(SC(F)F)cc2s1	6847853	VFFJUVLYQZNKCG-BQYQJAHWSA-N	355.391	3.993	50	40	FHGB	
C=CCOc1ccc(Cl)cc1/C=N/NC(=O)Cc1ccc(OCC)cc1	10475924	DLXXMPTYLGYRCO-HYARGMPZSA-N	372.852	3.996	50	40	FHGB	
CN1C(=C(C#N)C(=O)CSc2ncccc2Cl)N(C)c2ccccc21	32789333	IFUPOSQVCDXEHN-UHFFFAOYSA-N	370.865	3.718	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1	33939553	UGSIUJIZQWDRTQ-WJDWOHSUSA-N	352.346	3.644	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2ccc(OC(=O)c3ccccc3)cc2)c1	59445241	IYXBEYPUILNNOK-HZHRSRAPSA-N	374.396	3.678	50	40	FHGB	
CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)Cn1cnc3cc(F)c(F)cc31)C2	102186333	YCCXWKLXZUGWDS-QCDWDNDWSA-N	360.408	3.633	50	40	FHGB	
COc1cccc(/C=N\NC(=O)Nc2ccc(Br)c(C)c2)c1	408904307	HSBKABCWZFLCFQ-ZDLGFXPLSA-N	362.227	3.922	50	40	FHGB	
CO[C@H](C(=O)N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccccc1	3071491	MWMLLFWMZNUJON-OMPOGXFXSA-N	353.205	3.537	50	40	FHGB	
C#CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2F)cc1OCC	67189557	ASYHXAFTJNMVHU-VBKFSLOCSA-N	364.376	3.782	50	40	FHGB	
Cc1nn(Cc2ccccc2)c(Cl)c1/C=N/NC(=O)c1ccccc1	6673307	VNSBXIXOGGVUJO-CIAFOILYSA-N	352.825	3.657	50	40	FHGB	
O=C(N/N=C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1Br	4815509	CGDPLEUDJHAJJJ-FJIBGIISSA-N	374.194	3.786	50	40	FHGB	
COc1cc(Cl)c(/C=N/NC(=O)c2ccccc2Cl)cc1OC	66202160	LMUYUKOJTGYXQN-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
COc1ccc(-n2cccc2/C=N/NC(=O)c2ccccc2Cl)cc1	408954809	VIODXJRZWALNBJ-FYJGNVAPSA-N	353.809	3.903	50	40	FHGB	
O=C(NNC(=O)[C@@H]1Cc2ccc(Cl)cc21)c1ccc2ccccc2c1	1626182676	FIBPSAYZKMRYEC-GOSISDBHSA-N	350.805	3.594	50	40	FHGB	
O=C(CCl)Nc1ccc2oc(-c3cncc(Br)c3)nc2c1	16431279	PRFQDBFEPLKFCU-UHFFFAOYSA-N	366.602	3.830	50	40	FHGB	
CC/C=N/NC(=O)C(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1	5633774	WXFIMYZMSDFYFT-RGVLZGJSSA-N	351.233	3.741	50	40	FHGB	
C=CCOc1ccc(Br)cc1/C=N/NC(=O)OC(C)(C)C	2175983	HZPRELOXHLEBKN-LICLKQGHSA-N	355.232	3.873	50	40	FHGB	
C/C(CC(=O)NC1CCCCCC1)=N\NC(=O)c1ccc(C)c(Cl)c1	4680560	QHVIFIJKOCCCCK-HYARGMPZSA-N	363.889	3.983	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C/c1ccc(Cl)cc1	8812652	KZRATFCOPKLJDY-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
CC/C(Cc1ccccc1)=N/NC(=O)C(=O)Nc1ccc(Cl)cc1C	13882079	BLILTGYMDXQKBI-JWGURIENSA-N	357.841	3.712	50	40	FHGB	
O=C(Cn1ccc(C(F)(F)F)n1)NN(Cc1ccccc1)c1ccccc1	32255407	PKMRSKCQKKPRNL-UHFFFAOYSA-N	374.366	3.640	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)c2ccc3c(c2)OCO3)cc1OC	48332441	SYEQRUGWSRBURW-NVNXTCNLSA-N	351.358	3.612	50	40	FHGB	
O=C(Cl)[C@H]1CC(=O)N(c2ccc3oc(-c4ccccc4F)nc3c2)C1	57327074	AEESZHICODUWFU-JTQLQIEISA-N	358.756	3.752	50	40	FHGB	
CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2)cc1	59519741	OEWLILJBCVDZHU-CIAFOILYSA-N	357.841	3.726	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)cc1OC	409113999	PEXWXSAUHFLSBQ-MQMKENTISA-N	358.463	3.643	50	40	FHGB	
COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]1CC[C@@]13OO[C@@H](C[C@H]21)[C@]1(C(C)C)O[C@H]13	104133761	JXEACGHXWMSLSW-PJVNQZCDSA-N	364.482	3.649	50	40	FHGB	
COc1ccc(Br)c(/C=N/NC(=O)c2cc3ccccc3o2)c1	2741655	AAPQZRJQPGDJEV-VXLYETTFSA-N	373.206	3.968	50	40	FHGB	
O=C(CSCc1ccc(Cl)cc1)N/N=C/c1ccc([N+](=O)[O-])cc1	903674	SYKVCGGTNOZJRC-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
C=C(C)[C@H]1CC=C(C)/C(=N/NC(=O)COc2ccc(C(=O)OCC)cc2)C1	12137590	NMGDDAGGWJRPFF-XENKUQMPSA-N	370.449	3.647	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C\c2cc([N+](=O)[O-])ccc2Cl)c1	59133374	GVCRJZJPOPIXTJ-GHXNOFRVSA-N	357.753	3.802	50	40	FHGB	
N#C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1Br	3254426	VRARRDGAOXFZFT-FMIVXFBMSA-N	372.178	3.903	50	40	FHGB	
O=C(N/N=C/c1c(F)c(F)c(F)c(F)c1F)c1ccc2ccccc2n1	3229393	YAAJQPMNLJXKEK-HCGXMYGOSA-N	365.261	3.694	50	40	FHGB	
O=C(N/N=C/c1ccc(OCc2ccc(F)cc2)cc1)c1ccc(O)cc1	59445169	AKHXXWUGPBWCRO-YDZHTSKRSA-N	364.376	3.874	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2cccc(OCC)c2)cc1OCC	409316810	RANKNGVHJCWKDO-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
Cc1ccc(C(C)C)c(OCCOc2cccc(/C=C(\C#N)C(N)=O)c2)c1	4508530	YTLLYFVNNFYIKM-LDADJPATSA-N	364.445	3.969	50	40	FHGB	
CCO[P@](=O)(CI)Oc1ccc([N+](=O)[O-])cc1	1719954	MMEKEECKFQQOMD-QGZVFWFLSA-N	371.067	3.596	50	40	FHGB	
O=C(CSCc1cccc(Cl)c1)N/N=C/c1cccc([N+](=O)[O-])c1	59473013	POWKPSQHGXHEBU-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)c2cccs2)o1	58871344	XQFAZWIJKZOSNJ-VCHYOVAHSA-N	355.375	3.989	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)CSCc2ccc(C)cc2)c1	59473690	AKNZQOFVYDAKKN-PXLXIMEGSA-N	369.490	3.727	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)c2ccc(Br)cc2)c1	111679086	VLPJQBRAOZMUIJ-RGVLZGJSSA-N	374.238	3.562	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@@H]2C[C@@H]3C=C[C@@H]2C3)cc(OCC)c1OCC	226272261	ZNEHIIAWOIPSAR-YGAZNUDYSA-N	372.465	3.811	50	40	FHGB	
O=C(CCl)N[C@H](CC(=O)OC1CCCCC1)c1ccc(F)cc1F	1615055494	AAYJBOFSDWJKJE-OAHLLOKOSA-N	359.800	3.627	50	40	FHGB	
CC[C@H](C)Oc1c(Cl)cc(/C=N/NC(=O)c2ccccn2)cc1OC	33685073	YMAGHBHMVLZHRL-OVMKCGGTSA-N	361.829	3.685	50	40	FHGB	
Cc1ccc(/C=N\NC(=O)COc2ccc(-c3ccccc3)cc2)c(O)c1	13943619	DQTCVOQPTZHEHP-UCQKPKSFSA-N	360.413	3.897	50	40	FHGB	
Cc1cccc(C)c1NC(=O)/C(C#N)=C/c1ccc(N(C)C)c([N+](=O)[O-])c1	5692941	ZAYFFTMXMQZUOZ-MHWRWJLKSA-N	364.405	3.823	50	40	FHGB	
N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccccc2OC(F)F)[C@H]2CCCC=C12	19852435	XVVNFKBYLCTFTJ-GUYCJALGSA-N	366.371	3.882	50	40	FHGB	
COC(=O)N/N=C/c1ccc(OCCCOc2ccccc2C)c(OC)c1	9514144	BVYVQIXXUGMZLT-KGENOOAVSA-N	372.421	3.541	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)NCc2ccccc2)cc1Br	28699924	CXFHRLRGVYKVAU-OQLLNIDSSA-N	371.234	3.681	50	40	FHGB	
C/C(=N\NC(=O)c1cc2c(s1)CCCC2)c1ccc(C)c([N+](=O)[O-])c1	7167031	GTERMCJFZRGTTI-XDHOZWIPSA-N	357.435	3.998	50	40	FHGB	
COC(=O)c1ccc([C@H]2C(C#N)=C(C)NC3=C2C(=O)CC(C)(C)C3)cc1	100526497	UUCHSGMWXCSOKD-SFHVURJKSA-N	350.418	3.601	50	40	FHGB	
COC(=O)Cn1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)c2ccccc21	2726794	KVHVDOQDKAZNDX-LFIBNONCSA-N	373.412	3.668	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccccc1)[C@@H](Br)C2=O	2172574	JLKGVIGPYYRFHH-VUCTXSBTSA-N	350.256	3.784	50	40	FHGB	
CCOc1cc2c(cc1/C=C(/C#N)c1nc3ccc(F)cc3[nH]1)OCO2	408567761	GKIPQJQJDNKAEX-XGICHPGQSA-N	351.337	3.894	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccc(Cl)cc1	40007424	OXRPQFCXTSDUGQ-OQLLNIDSSA-N	356.809	3.710	50	40	FHGB	
C/C(CC(=O)Nc1c(C)cc(C)cc1C)=N\NC(=O)c1cccc(F)c1	4402065	LASHWLHROAEPNX-HZHRSRAPSA-N	355.413	3.885	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)Cc2cccc3ccccc23)c(OC)c1	12492767	PIKHYIZHRDYHPN-HZHRSRAPSA-N	362.429	3.940	50	40	FHGB	
Cc1ccc(-c2n[nH]c3c2[C@@H](c2ccc(N(C)C)cc2)C(C#N)=C(N)O3)cc1	985585	AKVGQFWVWIASKQ-SFHVURJKSA-N	371.444	3.669	50	40	FHGB	
CC(C)c1ccc(/C=N/NC(=O)CC(=O)Nc2cccc(Cl)c2)cc1	1437730	APXOALPYHOFFNL-CIAFOILYSA-N	357.841	3.942	50	40	FHGB	
COC(=O)c1cccc([C@H](C)Br)c1I	1632802	BBGFMZCSGKAJID-LURJTMIESA-N	368.996	3.534	50	40	FHGB	
N#CC1=C2SC[C@@](O)(c3ccco3)N2C(=O)C[C@@H]1c1ccc(Cl)cc1	12274953	HTPUSOGNMGTVSA-FZKQIMNGSA-N	372.833	3.576	50	40	FHGB	
COc1cc(/C=C/C(=O)NN)cc(Cl)c1OCc1ccccc1Cl	226336182	IDMWSXBDSMHXCD-VOTSOKGWSA-N	367.232	3.584	50	40	FHGB	
N#C/C(=C\c1cc(Cl)ccc1OCC(=O)O)c1nc2ccccc2[nH]1	409045857	JBIOKPVNRBTPSI-KPKJPENVSA-N	353.765	3.744	50	40	FHGB	
CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(C(C)C)cc3)[C@@H]2C1	809449	GAMUXOLTMHKTAC-RTWAWAEBSA-N	371.488	3.555	50	40	FHGB	
Cc1ccc(NC(=O)COc2ccc(/C=C(/C#N)C(N)=S)cc2)cc1C	107866532	UWJYEVNIOSUYJH-YBEGLDIGSA-N	365.458	3.514	50	40	FHGB	
CN1CC2=C(OC(N)=C(C#N)[C@@H]2c2cccs2)/C(=C\c2cccs2)C1	20813247	HICPRZRMTPGVDW-UEOUDEGLSA-N	367.499	3.900	50	40	FHGB	
Cc1ccccc1C(=O)N/N=C/c1c(Cl)nn(-c2ccccc2)c1C	408896467	YQOFYEOWEVBOAF-CIAFOILYSA-N	352.825	3.906	50	40	FHGB	
O=C(NNC(=O)c1cc2sc3ccccc3c2s1)c1ccccn1	17329308	RDXJODFTIBJCGO-UHFFFAOYSA-N	353.428	3.586	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(F)cc2)o1)c1ccccc1[N+](=O)[O-]	408599739	ZELJLZVTKRHAOV-RGVLZGJSSA-N	353.309	3.758	50	40	FHGB	
CCCO[C@@](C)(C(=O)Nc1ccc(OCCBr)cc1)C1CC1	225671555	SANONGBVPJAMOO-QGZVFWFLSA-N	370.287	3.994	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)c2ccccc2)o1	5514476	RRJIYZBFJYXZQW-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)cc1	705817	NRPOMOAXGQADLS-HXUWFJFHSA-N	356.429	3.961	50	40	FHGB	
CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(C)(C)C)cc1	1750081	YAMRCFIRUHXPQA-UHFFFAOYSA-N	362.514	3.973	50	40	FHGB	
Cc1nc(-c2cc(C)n(CC(=O)NN(C)c3ccccc3)c2C)cs1	42632109	LZPBZTZHSKLMQA-UHFFFAOYSA-N	354.479	3.704	50	40	FHGB	
CCOC(=O)[C@@H](C)[PH](c1ccccc1)(c1ccccc1)c1ccccc1	104141037	ANSSRUHZDLNVIJ-LJQANCHMSA-N	364.425	3.664	50	40	FHGB	
Cc1c(Br)cc(Br)c(OCC(=O)Cl)c1C	217709692	NVUSGNVVYGHGFK-UHFFFAOYSA-N	356.441	3.973	50	40	FHGB	
Cc1cc(C(=O)NN)c(C)n1-c1ccc(Br)cc1C(C)C	223709535	GEDVTEVWEPJDFJ-UHFFFAOYSA-N	350.260	3.584	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2cn(CC#N)c3ccccc23)cc1	408746469	SVNXJLIUGNVAJB-QINSGFPZSA-N	356.385	3.719	50	40	FHGB	
COc1ccc2c(c1O)-c1cccc3c1[C@@H](C2)N(CCOCCCl)CC3	6484949	KNOIVLXSJQLGRZ-QGZVFWFLSA-N	373.880	3.779	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C/c1c[nH]c2ccccc12	8812674	BAUFTHMSFRICPX-KEBDBYFISA-N	372.222	3.703	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)NC2CCCC2)cc1Br	33721653	DTDPCZQXCKSSOE-LCYFTJDESA-N	363.255	3.814	50	40	FHGB	
COC(=O)c1sccc1NC(=O)/C(C#N)=C/c1c[nH]c2ccccc12	44893083	WSUJSVHMFXTDEW-DHZHZOJOSA-N	351.387	3.562	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2cccn2-c2ccc(Cl)cc2)c1	59301944	GMESOIXHEUXEJD-FYJGNVAPSA-N	353.809	3.903	50	40	FHGB	
CC(C)OC(=O)CSC1=C(C#N)[C@H](c2ccc(C(C)C)cc2)CC(=O)N1	841889	QVYWXVWAQKYFMQ-INIZCTEOSA-N	372.490	3.833	50	40	FHGB	
Cc1ccc(C(O)(C(=O)NN=C2CCCCC2)c2ccc(C)cc2)cc1	1437131	HUCVZCCIEVMCHQ-UHFFFAOYSA-N	350.462	3.976	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccc(F)cc1	15144872	NCLMWSJXWRIDTC-RGVLZGJSSA-N	353.309	3.758	50	40	FHGB	
CC(=O)Oc1ccc([C@H]2C(C#N)=C(C)NC3=C2C(=O)CC(C)(C)C3)cc1	19805760	ARGWLNOMPXYPQN-IBGZPJMESA-N	350.418	3.739	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)COc2cccc(C)c2C)cc1OCC	30843247	MKRLPERWXWECRO-XKZIYDEJSA-N	370.449	3.630	50	40	FHGB	
Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)c1	59472223	YXCPFTWKRVCHBC-LPYMAVHISA-N	351.450	3.690	50	40	FHGB	
Cn1cc(/C=N/NC(=O)CNc2cccc3ccccc23)c2ccccc21	1819247	GAZZEWBEEBTUAM-ZMOGYAJESA-N	356.429	3.894	50	40	FHGB	
O=C(N/N=C/c1ccc(OC(F)F)cc1)c1ccc(Br)cc1	3285596	FWVMGSKQRKXDIW-DJKKODMXSA-N	369.165	3.814	50	40	FHGB	
C=CCSC1=C(C#N)[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)OC)C(O)=N1	9089198	QZNHHLLQAANDLC-UONOGXRCSA-N	362.838	3.837	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)cc1[N+](=O)[O-]	59197919	UPVKEAOUHYEOPH-VCHYOVAHSA-N	355.375	3.989	50	40	FHGB	
CCn1c(C)nc2cc(C(=O)N/N=C(\C)c3cc(C)ccc3O)ccc21	102948689	STDAYBSBRFADHQ-LPYMAVHISA-N	350.422	3.533	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1	408676283	HCJWHVQUAMZMIX-PXLXIMEGSA-N	351.450	3.838	50	40	FHGB	
CCOC(=O)c1c(NC(=O)C(Cl)Cl)sc2c1CC[C@@H](C)C2	943477	QFHVUIQHLMPAJA-SSDOTTSWSA-N	350.267	3.792	50	40	FHGB	
COc1ccc(N2Cc3ccc(C(=O)N/N=C/c4ccco4)cc3C2)cc1	1063420	XZNCDLVMNHXRPM-WSDLNYQXSA-N	361.401	3.572	50	40	FHGB	
O=C(COc1ccccc1Cl)N/N=C/c1ccc(Br)cc1	3153919	PWNOOXPXEYLUJZ-GIJQJNRQSA-N	367.630	3.632	50	40	FHGB	
Cc1ccccc1SCC(=O)N/N=C/c1ccc(Br)cc1	1094713	BFAMOYQFGMKHCR-VCHYOVAHSA-N	363.280	4.000	50	40	FHGB	
COc1ccc(Br)cc1/C=N/NC(=O)CCc1ccccc1	3034082	CDCOGKASTSUKMB-XDHOZWIPSA-N	361.239	3.541	50	40	FHGB	
C/C(=N\NC(=O)C(=O)Nc1ccc(Cl)cc1)c1ccc(Cl)s1	5177223	BGSHUFMEBQMNHX-QGMBQPNBSA-N	356.234	3.534	50	40	FHGB	
O=C(NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(Cl)cc1Cl	5427656	PWZRGGSVUNSVAZ-UHFFFAOYSA-N	371.136	3.567	50	40	FHGB	
C/C(=N/NC(=O)c1ccc(N(C)C)cc1)c1cccc(Br)c1	6021548	WLIHGLOAGBOLAW-UNOMPAQXSA-N	360.255	3.669	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1)c1cccnc1	809050	BIDAYWOWUWXOAX-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	59447328	PKJPUJGANFPLSW-DEDYPNTBSA-N	355.394	3.846	50	40	FHGB	
Cc1[nH]c2ccc(C(=O)NNC(=O)c3ccc(OC(C)C)cc3)cc2c1C	12931750	LQIOHAJIWADYAH-UHFFFAOYSA-N	365.433	3.647	50	40	FHGB	
COc1ccc(C(=O)/C(C#N)=C\c2cc(OC)c(OC)cc2OC)cc1	72235942	JXNCCAFSRSMLRT-DHDCSXOGSA-N	353.374	3.511	50	40	FHGB	
O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)N/N=C/c1ccccc1	408977450	DLVHSXRXKGASKF-MQMHFVAESA-N	371.440	3.698	50	40	FHGB	
O=C(N/N=C/c1ccc(O)c(Br)c1)c1ccccc1Cl	6222302	AQOIRSWFIAYLQE-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c(C)n1C1CCCCC1	8205762	DINUZBITGZYTCG-VOMPUTFMSA-N	355.482	3.812	50	40	FHGB	
Cc1cccc(C)c1NCC(=O)N/N=C\c1cc(Br)cs1	13285930	PULXYLFJMNKXSE-WSVATBPTSA-N	366.284	3.690	50	40	FHGB	
Cc1cc(C)c(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c(C)c1	408748724	BXYUNTWDXUSXDZ-PCLIKHOPSA-N	372.468	3.998	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)Nc2cccc(C)c2)cc(OCC)c1O	408851324	XVAYOLPQJCUREB-BKUYFWCQSA-N	353.422	3.983	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccccc1Cl	408885538	BPMFUYGHCVRYOD-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N/NC(=O)COc1ccccc1Cl	408916441	XOMQCIMTGTYNCI-KEBDBYFISA-N	367.232	3.921	50	40	FHGB	
Cc1cc2c(cc1/C=N/NC(=O)c1cccc(C(F)(F)F)c1)OCO2	408965845	JASOSJJYCCSPCA-ODCIPOBUSA-N	350.296	3.506	50	40	FHGB	
COc1ccc(C(=O)N/N=C\c2c(OC)ccc3ccc(OC)cc23)cc1	409006079	HMLJOPYSJJDXOK-XKZIYDEJSA-N	364.401	3.630	50	40	FHGB	
CCCCC(O)(CCCC)C(=O)NN(C(=O)OCC)c1ccccc1	4188843	JDQLQYJFUZKVIU-UHFFFAOYSA-N	350.459	3.792	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2ccc(OCC)c(OC)c2)cc1	20197321	FYDIOQHCFDJONY-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc1Br	408793395	DWKFPFOAVXLQEA-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	409191585	ILXPDLRDYHFUCL-UDWIEESQSA-N	368.780	3.803	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N\NC(=O)c1cccc([N+](=O)[O-])c1	38366341	FNFMVBHBTUKEKC-BKUYFWCQSA-N	363.373	3.911	50	40	FHGB	
CCOc1ccc([C@@H](O)CCC(=O)N/N=C/c2cccc(Cl)c2)cc1	6351417	ZQNWUEWCRQMKPN-LANLRWRYSA-N	360.841	3.703	50	40	FHGB	
O=C(NNc1ccccc1[N+](=O)[O-])c1ccccc1SC[C@@H]1CCCO1	32820067	PSMCPVXRVFSWJA-ZDUSSCGKSA-N	373.434	3.623	50	40	FHGB	
O=C(NNc1nc2c(Cl)cccc2s1)c1cc2ccccc2oc1=O	4121363	BWNOYWIPWJXZAN-UHFFFAOYSA-N	371.805	3.813	50	40	FHGB	
Cc1cc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)c(C)n1-c1ccc(F)cc1	6961675	VSCXTCFSFAJAHF-PFRKPPGBSA-N	374.419	3.991	50	40	FHGB	
CC[C@@H](C)Oc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1	7071407	MABOVYBTJHSVSK-PZUDMAOCSA-N	372.494	3.513	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)c(C)c2)cc(OC)c1OC	7156687	GGYNMPCXXZGSMI-CXUHLZMHSA-N	366.417	3.875	50	40	FHGB	
CC(C)(C)c1ccc(C(=O)N/N=C2\C(O)=Nc3ccc([N+](=O)[O-])cc32)cc1	8344586	URJSBFWKHZRUMW-UHFFFAOYSA-N	366.377	3.628	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)ccc1OC	28495800	PGIJADQEWFZUJX-BRFSQIRFSA-N	350.418	3.878	50	40	FHGB	
CC(=O)Nc1ccc(C(=O)N/N=C/c2cn(C(C)C)c3ccccc23)cc1	33795391	DSGPHHRCCXKOIE-WSDLNYQXSA-N	362.433	3.945	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(F)cc3F)o2)cc1	408602899	OVIXRHPJCFNWNI-SSDVNMTOSA-N	356.328	3.997	50	40	FHGB	
CSC(SC)=C(C#N)S(=O)(=O)c1ccc(OC(F)(F)F)cc1	2550153	PCYSIGSKUWQWSP-UHFFFAOYSA-N	369.411	3.778	50	40	FHGB	
O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1c(Cl)cccc1Cl	3094640	DHCLUDGKTZYAOL-GIJQJNRQSA-N	352.177	3.594	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)NC1CCCC1	4893944	NZRBQLQESIYPSL-KAMYIIQDSA-N	351.362	3.821	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc(C)n(NC(=O)c3ccccc3)c2C)cc1	8372066	KCVILDMEZVEVOS-OEAKJJBVSA-N	374.444	3.561	50	40	FHGB	
O=C(N[C@@H](CSc1ccccc1)[C@H](O)CCl)OCc1ccccc1	16697412	YMCLVAZUQJPLTE-DLBZAZTESA-N	365.882	3.673	50	40	FHGB	in-vitro
N#CC1=C(NC(=O)c2cc3ccccc3oc2=O)S[C@@H]2CCCC[C@H]12	100026350	WDMRXEGZHCJKGY-MLGOLLRUSA-N	352.415	3.564	50	40	FHGB	
C[C@@]12CCCC[C@H]1[C@@H]2C(=O)N/N=C/c1ccc(-c2ccc(C(=O)O)cc2)o1	100175486	GMECDSONWHNXFI-JECGJWKJSA-N	366.417	3.921	50	40	FHGB	
C[C@H]1C[C@@H]([P+](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)O1	1775964770	BRGBURGZSZDDIA-PGRDOPGGSA-N	361.401	3.685	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccccc1Br	711316	HLQVRBNRPRSKBT-OAHLLOKOSA-N	373.250	3.900	50	40	FHGB	
N#CC1=C(N)OC2=C(CNC/C2=C/c2cccs2)[C@H]1c1cccs1	8783243	JTRAECBFPAEOIY-UBAGTECSSA-N	353.472	3.558	50	40	FHGB	
COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]1CC[C@@]13OO[C@H](C[C@H]21)[C@]1(C(C)C)O[C@@H]31	104133767	JXEACGHXWMSLSW-BRICAONVSA-N	364.482	3.649	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc3c4c(cccc24)CC3)cc1OC	4502765	ZJZVOKNJGIVMEK-YDZHTSKRSA-N	360.413	3.720	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C\c1cc2c(cc1Cl)OCO2)c1ccccc1	32561697	PMJBWHGRKYYKAJ-FKZYXTMDSA-N	354.793	3.853	50	40	FHGB	
COc1cccc(-c2nc3cc(NC(=O)CSC#N)cc(C)c3o2)c1	216856115	ZCVLAAAXBGGSQF-UHFFFAOYSA-N	353.403	3.965	50	40	FHGB	
Cc1ccc(N2Cc3ccc(C(=O)N/N=C\c4cccc(O)c4)cc3C2)cc1	83318407	AUWBBOQBUGPNMH-CFRMEGHHSA-N	371.440	3.985	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)N(C)[C@H](C)c2cc3ccccc3o2)cc1	32779666	IYOQGWXVWVAWOU-CQSZACIVSA-N	351.406	3.789	50	40	FHGB	
CCN(CC)c1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc([N+](=O)[O-])cc1	5322028	ZGCSLKRRWDNVMM-LJQANCHMSA-N	364.405	3.659	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1	5661318	ATCJZMQESYTVLW-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
Cn1cc(/C=N\NC(=O)c2ccc(Br)cc2)c2ccccc21	12428168	CYVSVWKTXRSHCJ-GRSHGNNSSA-N	356.223	3.705	50	40	FHGB	
O=C/C(=C/Nc1ccc(O)c(C(=O)O)c1)c1nc2cc(Cl)ccc2o1	5338026	YLGDOHXHNLNZLH-CLFYSBASSA-N	358.737	3.537	50	40	FHGB	
CC(C)CCN1CSC2=C(C#N)[C@@H](c3ccc(F)cc3)CC(=O)N2C1	20347972	GTWADJMHSZYFIT-MRXNPFEDSA-N	359.470	3.887	50	40	FHGB	
CC(C)(C)c1ccc(OCCOc2ccccc2/C=C(/C#N)C(N)=O)cc1	4616392	FEHDYVYLWGBLGQ-VKAVYKQESA-N	364.445	3.834	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1)N/N=C/c1cc(Br)ccc1O	5173022	NGJQVTKVHBLQBY-GIJQJNRQSA-N	367.630	3.501	50	40	FHGB	
O=C(NN=C1CCN(Cc2ccccc2)CC1)c1cc2ccccc2cc1O	55009007	ABNVUJNIHXHJML-UHFFFAOYSA-N	373.456	3.927	50	40	FHGB	
O=C(Cl)[C@H]1CC(=O)N(c2ccc(Br)c(C(F)(F)F)c2)C1	57327543	JSNXSFPSJVDLGI-LURJTMIESA-N	370.552	3.586	50	40	FHGB	
CC(C)(C)OC(=O)N1C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@H]1C(=O)O	169986983	AJNYVLYSVHQBTA-OLZOCXBDSA-N	359.539	3.861	50	40	FHGB	
COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1	1506615	CDPQDHJMQWHQJB-QGMBQPNBSA-N	368.176	3.674	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C\c2cc(Cl)ccc2OC)cc1OC	6355497	ZELBNRORAFVVQK-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)c1cccc(OC)c1	409143586	HOEZTCHKBQGBLI-HZHRSRAPSA-N	358.397	3.624	50	40	FHGB	
CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccc(C)cc1	994328	FQHJSXVOIGQOEF-YBFXNURJSA-N	361.239	3.920	50	40	FHGB	
COc1ccc(OCC(=O)N/N=C/c2ccc(OCCC(C)C)cc2)cc1	3266476	XGCBGGBRJYCYSN-HYARGMPZSA-N	370.449	3.649	50	40	FHGB	
C=CCNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc(F)cc1	2287396	REJMWVGDPJAQMM-GHRIWEEISA-N	372.403	3.888	50	40	FHGB	
CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc1OC	8846207	UXSSICMJUIFNNW-HXUWFJFHSA-N	365.433	3.674	50	40	FHGB	
COc1cccc(C(=O)NN(C(=O)c2cccc(C)c2)C(C)(C)C)c1C	137979126	CDUYORZAQRQNFH-UHFFFAOYSA-N	354.450	3.898	50	40	FHGB	in-vitro
NNC(=O)c1ccc2oc(-c3cc(Br)ccc3Cl)nc2c1	226317701	FOOXZUYCHKECGD-UHFFFAOYSA-N	366.602	3.514	50	40	FHGB	
O=C(CCCCl)NC(=S)Nc1c(Cl)cc(Cl)cc1C(=O)O	6234802	RZFXZNXXPKTSJL-UHFFFAOYSA-N	369.657	3.524	50	40	FHGB	
COc1ccc(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)c(OC)c1	408568442	ULGXJZUTKJPSNW-HYARGMPZSA-N	354.450	3.694	50	40	FHGB	
Cc1cc(C)nc(S/C(=C\C=C(\C#N)C(N)=O)c2ccc(Cl)cc2)n1	5379534	TZKVWSYZYXZWJQ-BOLZARLISA-N	370.865	3.815	50	40	FHGB	
COc1cc(C(=O)NN=C(CC(C)C)CC(C)C)cc(OC)c1OC	5753635	USXVUTVZVYXALN-UHFFFAOYSA-N	350.459	3.890	50	40	FHGB	
CCN(CC)c1ccc(/C=N\NC(=O)[C@H](C)Oc2ccc(C)cc2)cc1	32675367	SEVMINYPAMYNSN-WPGBELRESA-N	353.466	3.759	50	40	FHGB	
CO[C@@]1(C(=O)Nc2ccc(OCCBr)cc2)CCC[C@@H](C)C1	225634642	YEXIDDHSTKHEFH-DYVFJYSZSA-N	370.287	3.994	50	40	FHGB	
Cc1ccc(NC(=O)C(=O)N/N=C/c2cccc(Cl)c2Cl)cc1C	13923583	JESCPCYYAQDDQN-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
CCOc1ccccc1-c1cc(C(=O)N/N=C(/C)c2ccc(F)cc2)[nH]n1	5444763	LSGVWKMQBZSTCE-XKZIYDEJSA-N	366.396	3.769	50	40	FHGB	
COc1ccc(-c2cc(C(=O)N/N=C\c3ccccc3Cl)[nH]n2)cc1	5126049	LRMWZDHIVCUXLN-JAIQZWGSSA-N	354.797	3.503	50	40	FHGB	
CC1(C)CC(=O)C/C(=N\NC(=O)COc2ccccc2-c2ccccc2)C1	100018233	UIKCKNIZGRBRSD-HAVVHWLPSA-N	364.445	3.984	50	40	FHGB	
Cc1nocc1[C@H]1C(C#N)=C(N)N(c2ccccc2)C2=C1C(=O)CC(C)(C)C2	1073699	BGOCFPZHMGUIKZ-LJQANCHMSA-N	374.444	3.924	50	40	FHGB	
COc1ccc2c(Cl)c(C(=O)NNC(=O)c3ccoc3C)sc2c1	674914	XYBFUSNMWGSIOL-UHFFFAOYSA-N	364.810	3.540	50	40	FHGB	
O=C(N/N=C\C=C\c1ccc(Br)cc1)c1ccc2c(c1)OCO2	4838668	HLAUOCIWPZYJNQ-LCUBDLGASA-N	373.206	3.607	50	40	FHGB	
CC1CCN(c2ccc(N3C[C@@H](C(=O)Cl)CC3=O)cc2Cl)CC1	57332370	IVTDSMRCGMXCHP-LBPRGKRZSA-N	355.265	3.695	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)c2nc(N)nc(Nc3ccccc3)n2)cc1	14093293	ORZUXOWELOTARK-NTCAYCPXSA-N	358.405	3.660	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)CCCc2ccc(OC)cc2C)c1	408905402	AAULEPIRQWNGRA-PXLXIMEGSA-N	354.450	3.875	50	40	FHGB	
Cc1nn(-c2ccccc2)c(N2CCCC2)c1/C=N/NC(=O)OC(C)(C)C	3234459	BEBSPQODNIRQEQ-KGENOOAVSA-N	369.469	3.640	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1Br)c1cccc([N+](=O)[O-])c1	5289356	FTUMFEDMYKGNEW-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
CO[C@@H](C(=O)N/N=C(\C)c1cccc(Br)c1)c1ccccc1	20248790	MGCUMFZEIJYQJB-PUMYGXPMSA-N	361.239	3.677	50	40	FHGB	
COc1cccc(CO[C@H](C)C(=O)NNc2ccccc2C(F)(F)F)c1	40093883	QHHAIVYCCYIVPT-GFCCVEGCSA-N	368.355	3.762	50	40	FHGB	
O=C(NNc1ccccc1)Nc1cccc(S(=O)(=O)C2CCCC2)c1	69517833	UMWBORXHVYYHEV-UHFFFAOYSA-N	359.451	3.552	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)ccc1OCC#N	408798673	WPELQRXQRGGCLY-SFQUDFHCSA-N	361.401	3.842	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cccc(Br)c2)o1)c1cccnc1	830877	PRNZDLULQBPVCN-RGVLZGJSSA-N	370.206	3.868	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)C(=O)NN=C1CCCCCCC1	59516317	HEXJTEXSXCNUHA-UHFFFAOYSA-N	351.834	3.504	50	40	FHGB	
O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)c1cc(C2CC2)n[nH]1	4135883	KFEBZGCKMKEQRJ-LPYMAVHISA-N	360.417	3.630	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1)c1ccccn1	408723311	TUYFSBCGMOQSNN-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(F)cc2[N+](=O)[O-])o1)c1ccc(F)cc1	8812147	FEBUDUKRUFSKPN-UFFVCSGVSA-N	371.299	3.897	50	40	FHGB	
CCN(C(=O)c1ccccc1NC(=O)CBr)c1ccccc1	35605210	AGAUZYYGXHEDTB-UHFFFAOYSA-N	361.239	3.687	50	40	FHGB	
C/C(CC(=O)Nc1ccccc1F)=N\NC(=O)Cc1ccc(Cl)cc1	100059396	GEQDJJCLFAMFCA-WSDLNYQXSA-N	361.804	3.543	50	40	FHGB	
C/C(CC(=O)NC1CCCCC1)=N\NC(=O)c1cccc2ccccc12	101158911	YSUVYVCQXVDRCJ-HZHRSRAPSA-N	351.450	3.785	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC	206244459	MMUGRSMJAMGOOC-ZROIWOOFSA-N	367.361	3.548	50	40	FHGB	
O=C(CSc1ccccc1)NN=C1CCN(Cc2ccccc2)CC1	409330304	KXVKOMUNEXMZPO-UHFFFAOYSA-N	353.491	3.547	50	40	FHGB	
Cc1ccc(C(C)C)c(OCCCOc2ccc(/C=N/NC(N)=O)cc2)c1	4549159	HGBNKJHROZRVHN-OEAKJJBVSA-N	369.465	3.969	50	40	FHGB	
COc1cc2ccccc2cc1C(=O)N/N=C/c1ccc(C)c([N+](=O)[O-])c1	6449958	DKSZVFPEFZHVBP-CIAFOILYSA-N	363.373	3.829	50	40	FHGB	
Cn1c(C/C(=N/NC(=O)c2ccccc2)c2ccccc2)nc2ccccc21	33490145	HHMXSGSJPNLSLQ-QQTULTPQSA-N	368.440	3.950	50	40	FHGB	
CCOC(=O)/C(C#N)=C/NC[C@@H](c1cccs1)c1c[nH]c2ccccc12	103550338	NLBYGOBXFMTMIT-GWKQRERASA-N	365.458	3.921	50	40	FHGB	
N#C/C(=C\c1ccccc1)C(=O)Nc1cccc(I)c1	408754455	VANZJEQTANKJHH-UKTHLTGXSA-N	374.181	3.837	50	40	FHGB	
CCN(CC)c1ccc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)cc1	408812476	OVPBITUTIPCJEI-RGEXLXHISA-N	363.461	3.765	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2ccc(F)cc2[N+](=O)[O-])o1)c1ccccc1	408957606	VGDPGHKRMKWICI-JAIQZWGSSA-N	353.309	3.758	50	40	FHGB	
COc1ccc(C(=O)N/N=C(\Cc2cccs2)C(F)(F)F)cc1OC	409063650	ARCHQWYKLMSRQV-XSFVSMFZSA-N	372.368	3.656	50	40	FHGB	
O=C(O)c1cccc(-n2cccc2/C=N/NC(=O)c2ccc(Cl)cc2)c1	409089959	PKZJDSIXUQNXMH-CIAFOILYSA-N	367.792	3.593	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)CCCC(=O)N/N=C/c1ccccc1O	409252750	SSXDYDSDAZBZRW-CIAFOILYSA-N	373.840	3.613	50	40	FHGB	
COc1ccccc1NC(=O)N/N=C/c1ccc(N2CCCC2)c(C)c1	1104641	NQZZKDQXGNBGIH-KGENOOAVSA-N	352.438	3.759	50	40	FHGB	
CC(C)(OC(=O)c1ccccc1)[C@@H](Br)CBr	1608562	JMWHQWCBBDSMKV-JTQLQIEISA-N	350.050	3.780	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)[nH]c2ccc(Cl)cc12	2207600	PQTBDUBKBHNWLY-DJKKODMXSA-N	356.769	3.802	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1	13956874	IRJNHKYZLFWSKO-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
N#CC1=CN(c2ccc(OC(F)(F)F)cc2)c2ccccc2S1(=O)=O	38488001	FIMONWVGOWTTFP-UHFFFAOYSA-N	366.320	3.876	50	40	FHGB	
Cc1nc2sccn2c1C(=O)N/N=C/c1cccc(Cl)c1Cl	58883882	YXUIQEGIGZABNN-REZTVBANSA-N	353.234	3.775	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(Sc2ccccn2)c([N+](=O)[O-])c1	408987460	BCIHRSYXBWRHAA-UKTHLTGXSA-N	355.375	3.611	50	40	FHGB	
CCOc1ccc(O)c(/C=N\NC(=O)c2cc3cc(Cl)ccc3o2)c1	409022032	CMNQMWJIYAQZAX-JMIUGGIZSA-N	358.781	3.954	50	40	FHGB	
CC(=O)Nc1ccc([C@@H](O)P(=O)(c2ccccc2)c2ccccc2)cc1	2163362	KQZJVWFLFGVGJU-NRFANRHFSA-N	365.369	3.650	50	40	FHGB	
O=C(NNc1nc2c(Cl)cccc2s1)c1cc(=O)c2ccccc2o1	4121362	HUPDQYXWWNFDMI-UHFFFAOYSA-N	371.805	3.813	50	40	FHGB	
N#C/C(=C\c1c[nH]c2ccccc12)C(=O)Nc1nnc(C(F)(F)F)s1	4544248	FJMRTPDPCRQIPC-VMPITWQZSA-N	363.324	3.584	50	40	FHGB	
CC1(CC(=O)N/N=C/c2ccc(-c3ccccc3C#N)o2)SCCS1	6348161	KGEXJZKXBPGVOM-UDWIEESQSA-N	371.487	3.855	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N\NC(=O)c1cccc(C)c1	15018814	FNHKGHNPOZGJGH-MOSHPQCFSA-N	354.410	3.513	50	40	FHGB	
CN1C(=C(C#N)C(=O)COc2ccccc2Cl)N(C)c2ccccc21	28139810	FGHKCIQVVVFYLQ-UHFFFAOYSA-N	353.809	3.609	50	40	FHGB	
COc1cc(Cl)c(/C=N/NC(=O)c2cccc(Cl)c2)cc1OC	408892633	BMTPMYWJOOGIFK-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2cc([N+](=O)[O-])ccc2N(C)C)cc1C	409000609	ZIRTZTORBQGKKE-MHWRWJLKSA-N	364.405	3.823	50	40	FHGB	
CCc1ccccc1NC(=O)/C(C#N)=C\c1ccc(N2CCOCC2)cc1	409104478	ZXUJIBAGNYOIPM-CYVLTUHYSA-N	361.445	3.631	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Sc1ccc(C)cc1)c1ccc2c(c1)OCCO2	409120837	VAWOYYGCFFBKDK-HFITWMCCSA-N	370.474	3.787	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)CSCc2ccc(C)cc2)cc1OC	59473202	CACKDUQSTQIESW-RCCKNPSSSA-N	372.490	3.786	50	40	FHGB	
CCCCCOc1ccc(/C=N/NC(=O)COc2ccc(F)cc2)cc1	3174747	BPCHCGOTZVLHPI-HYARGMPZSA-N	358.413	3.924	50	40	FHGB	
COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)c2ccccc2)o1	58822814	DGGUYAHMCKTVRO-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
COc1cccc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)c1OC	1942926	IWQXEYNOHZNMFR-XNTDXEJSSA-N	363.822	3.696	50	40	FHGB	
Cc1ccc(C(=O)Nc2ccccc2C(=O)N/N=C/c2ccc(O)cc2)cc1	58871483	PUBKESXBJOFIMK-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
COc1cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)cc(SC#N)c1O	409047254	NUXIAQBSAITQBW-MLPAPPSSSA-N	353.359	3.946	50	40	FHGB	
O=[N+]([O-])c1ccc(SC[C@H](Cl)CS(=O)(=O)c2ccccc2)cc1	4704598	NRQIGAAJQATSJC-LBPRGKRZSA-N	371.867	3.768	50	40	FHGB	
C/C(=N\NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc(C)cc1	5362853	BYHXQIDAVRZQRV-HKOYGPOVSA-N	358.441	3.771	50	40	FHGB	
O=C(N/N=C/c1ccccc1Br)c1ccc(N2CCCC2)cc1	7384903	JSGCRRCTOGAHCZ-DEDYPNTBSA-N	372.266	3.813	50	40	FHGB	
N#CC1=C(SCc2ccc([N+](=O)[O-])cc2)NC(=O)C[C@H]1c1ccccc1	6496101	NESCUDAAVRAKPT-INIZCTEOSA-N	365.414	3.867	50	40	FHGB	
COc1cc(Br)cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)c1	408869169	PLXHMWZTGWSDCA-WUXMJOGZSA-N	373.206	3.709	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)CNc1ccc(F)cc1	409352089	YPNRGTZYKDIDHN-FSJBWODESA-N	351.381	3.550	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Sc1ccc(C)cc1)c1cccc([N+](=O)[O-])c1	409121544	YJSFYMVTGYBUCZ-NFECSFHCSA-N	357.435	3.924	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)CSCc2ccccc2C)cc1OC	408774091	AJIUIOCKESVNQM-RCCKNPSSSA-N	372.490	3.786	50	40	FHGB	
CCC[C@@](C)(OCC)C(=O)Nc1ccc(OCCBr)cc1	225692310	SARVTDYTMJSNJG-MRXNPFEDSA-N	358.276	3.994	50	40	FHGB	
O=C(N/N=C\c1cccc(OCc2ccccc2)c1)c1n[nH]c2c1CCCC2	31841368	XCMNNJAOCAVQHO-UCQKPKSFSA-N	374.444	3.631	50	40	FHGB	
O=C(N/N=C/c1ccco1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1	2020918	UTZOXAYTUUZNDT-CIAFOILYSA-N	367.792	3.949	50	40	FHGB	
NC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1ccc2ccccc2c1	3308084	HHBGZSLPNBBUMU-YDZHTSKRSA-N	355.401	3.695	50	40	FHGB	
C/C(CC(=O)Nc1cc(C)cc(C)c1)=N\NC(=O)COc1ccc(C)cc1	5415382	BOUIAHDQYTWQIO-HAVVHWLPSA-N	367.449	3.512	50	40	FHGB	
Cc1[nH]c2ccccc2c1/C=N/NC(=O)c1cc(Br)ccc1O	6588660	KAQNJUDNQHTJIC-DJKKODMXSA-N	372.222	3.708	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N\NC(=O)c1ccc2c(c1)OCO2	13942072	USJJOLNQLVBCLF-UUYOSTAYSA-N	362.385	3.731	50	40	FHGB	
CC(C)(C)C1CCC(C(=O)NNC(=O)COc2ccccc2Cl)CC1	14182230	SRBBEFPWBDLWLW-UHFFFAOYSA-N	366.889	3.719	50	40	FHGB	
CO[C@H]1CC[C@H](/C=C(\C#N)C2CCC([N+](=O)[O-])CC2)C[C@@H]1Br	16911486	OKDIJYAIKUNQCW-ZUHNWDQASA-N	371.275	3.850	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c(C)c1	408956665	XVOIFIFQXKTQGC-PDGQHHTCSA-N	359.429	3.751	50	40	FHGB	
CC(C)OC(=O)COc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2)cc1	409187592	SFWULSPJRYAGQB-ATVHPVEESA-N	364.401	3.563	50	40	FHGB	
O=C(CCl)Nc1ccccc1Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	3084072	OLNSWZLCXFKNSM-UHFFFAOYSA-N	367.770	3.832	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)cc1	3140219	XMYIELKPSPEEFW-HYARGMPZSA-N	353.466	3.579	50	40	FHGB	
O=C(Cn1ccc2ccccc21)N/N=C/c1ccc(Br)cc1	4676390	VCPGCRKIGQUBJA-YBFXNURJSA-N	356.223	3.554	50	40	FHGB	
CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(C(C)C)cc3)[C@@H]2C1	13479777	GAMUXOLTMHKTAC-NHCUHLMSSA-N	371.488	3.555	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)N2CCOCC2)c(C)n1-c1ccccc1Cl	409063093	GTZLLUBSOXCYIA-SFQUDFHCSA-N	369.852	3.513	50	40	FHGB	
Cc1ccc(N2C[C@H](C(=O)N/N=C\c3cccc4ccccc34)CC2=O)cc1	409165430	YEDNNLZNQXLZDC-QHSFOXILSA-N	371.440	3.651	50	40	FHGB	
CC(C)c1ccc(/C=N/NC(=O)CCNC(=O)c2ccccc2Cl)cc1	2675796	DCOPFHGEXDUSRF-YDZHTSKRSA-N	371.868	3.734	50	40	FHGB	
O=C(CSc1cc(Cl)ccc1Cl)NNC(=O)c1ccsc1	12671410	NKQSQANRGWUJMS-UHFFFAOYSA-N	361.275	3.608	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)cc1	12843985	MNFQMRAAFUPICI-OEAKJJBVSA-N	367.493	3.987	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2OC)c1	408741361	LMLZYESARNPKTK-XNTDXEJSSA-N	352.390	3.648	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)COc2ccc(C3SCCS3)cc2)o1	408570744	XZJKVEAUQIULPB-VCHYOVAHSA-N	362.476	3.596	50	40	FHGB	
COc1cc(OC)c(OC)cc1/C=C(/C#N)c1nc2ccc(F)cc2[nH]1	408567519	FLLLIHZMLPBBGU-SDQBBNPISA-N	353.353	3.792	50	40	FHGB	
COC(=O)c1ccccc1OP(=O)(c1ccccc1)c1ccccc1	3181311	IXTDKBSHKVUPTP-UHFFFAOYSA-N	352.326	3.781	50	40	FHGB	biogenic
Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c(C)n1-c1cccnc1	6266161	QSXXPCFXGOYPJT-BOPFTXTBSA-N	358.401	3.740	50	40	FHGB	
O=C(N/N=C/c1cc(Cc2ccccc2Cl)ccc1O)c1ccccn1	2341961	PVMLGZSKPCHPAB-YDZHTSKRSA-N	365.820	3.795	50	40	FHGB	
Cc1ccccc1C(=O)N/N=C/c1ccc(N(C)C)c(Br)c1	9201129	YEDIZFRVKIFVJQ-YBFXNURJSA-N	360.255	3.587	50	40	FHGB	
O=C(CSc1ccc(Cl)cc1)NNC(=O)[C@@H]1CCCc2ccccc21	12985280	GQMPJVFVSUKPOZ-QGZVFWFLSA-N	374.893	3.700	50	40	FHGB	
N#C/C(=C\c1ccc2c(c1)OCO2)C(=O)Nc1cccc(Br)c1	1211187	MARFDECPHDALIL-WUXMJOGZSA-N	371.190	3.723	50	40	FHGB	
CC(C)c1ccc([C@@H]2[C@@H]3CSCC=C3C(C#N)=C(N)C2(C#N)C#N)cc1	1438268	DOQZLYHJAPRIQA-RTBURBONSA-N	360.486	3.967	50	40	FHGB	
CC(C)(OC(=O)c1ccccc1)[C@H](Br)CBr	2045878	JMWHQWCBBDSMKV-SNVBAGLBSA-N	350.050	3.780	50	40	FHGB	
CSc1ccc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1	3617659	LSXFPXBXRBWLFX-GXDHUFHOSA-N	352.415	3.725	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)cc1OCC	6341967	BMFYPUOYPGOGFM-FOWTUZBSSA-N	364.376	3.782	50	40	FHGB	
Cc1ccc(OCCOc2ccc(Cl)cc2/C=C(/C#N)C(N)=O)cc1C	19799511	GSEPBHWMWIPDHN-YBEGLDIGSA-N	370.836	3.807	50	40	FHGB	
O=C(N/N=C\c1cn(Cc2ccc(F)cc2)c2ccccc12)c1cccnc1	33304441	BXVNYIIFIOAWBD-MXAYSNPKSA-N	372.403	3.988	50	40	FHGB	
COC(=O)Cn1cc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)c2ccccc21	408566969	BYGXFJXLYRRBPA-JYRVWZFOSA-N	374.375	3.894	50	40	FHGB	
C=CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccccc1	408815161	UNYBZTIWPIOXKZ-XDHOZWIPSA-N	359.223	3.778	50	40	FHGB	
COc1cc(Cl)cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)c1O	409229508	QAOUHLCWXOCWQD-YBEGLDIGSA-N	370.836	3.710	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2ccc(OCC)cc2)cc1OCC	409314377	SMFLEPQFPWNWRH-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)c(OCC)c1	409376986	DGRLNNRJKIILNO-BOPFTXTBSA-N	353.422	3.580	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)C2CCN(Cc3ccc(Cl)cc3)CC2)o1	1092095	JAUBLYAQRAINDR-CIAFOILYSA-N	359.857	3.604	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(C(=O)OCC)cc2)c1C	1187630	MAEZTGDNTYRZHZ-PDGQHHTCSA-N	366.417	3.741	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)c1	6159405	PEFWGJFNXUENMB-HYARGMPZSA-N	354.450	3.694	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)cc1OCC	7157414	BBOXAZMKHFLVNT-QGOAFFKASA-N	360.413	3.951	50	40	FHGB	
COc1ccc(C)cc1NC(=O)C(=O)NN=C1CCC(C(C)(C)C)CC1	59434019	LBMZESTWTQYODX-UHFFFAOYSA-N	359.470	3.651	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CSc2ccccc2)cc1OCC	408831082	POBWBFGUIUPUNI-DEDYPNTBSA-N	358.463	3.726	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C\c2ccc(-c3ccccc3C#N)o2)cc1C	409008486	XADQHIBKIQNYTM-MXAYSNPKSA-N	372.428	3.997	50	40	FHGB	
CCC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1	1444739	KUOXOPXBALDFFE-HJGVYBFFSA-N	368.433	3.848	50	40	FHGB	
COc1ccc(Cl)cc1-c1ccc(/C=N/NC(=O)c2ccncc2)o1	409039548	RHDJABUDNIVZKQ-SRZZPIQSSA-N	355.781	3.768	50	40	FHGB	
Cc1cc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)c(C)n1-c1ccccc1	409199767	JWJVJDJOHICYPS-SGSZHJQISA-N	356.429	3.852	50	40	FHGB	
COc1cccc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c1OC(C)C	409369973	INHHEYDBRHWMPV-PTNGSMBKSA-N	352.390	3.734	50	40	FHGB	
CN(C)C(=O)[C@@H](c1ccccc1)[PH](C)(c1ccccc1)c1ccccc1	104117854	QNNWVHSGTSJXTN-JOCHJYFZSA-N	363.441	3.847	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccc(F)cc1	59333711	ZTOCYPVUVYZRDO-BOPFTXTBSA-N	368.408	3.799	50	40	FHGB	
N#CC(C#N)=C(N)/C(C#N)=C(/C=C/c1cccc(Br)c1)C1CC1	104815343	SDSVHNDEWZMEJV-NKEYAZLUSA-N	365.234	3.952	50	40	FHGB	
Cc1ccccc1OCC(=O)N/N=C\c1ccc(Sc2ccccn2)o1	4568003	VHFWBLODEIFAPB-MTJSOVHGSA-N	367.430	3.663	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nc2ccccc2C(C)=O)ccc1O	408754927	LUZUBIYBOUJSEP-GDNBJRDFSA-N	350.374	3.539	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)NCCCc2ccccc2)cc1OC	409244465	DAGJMIHEDHAJDG-RGEXLXHISA-N	364.445	3.750	50	40	FHGB	
CC(C)(C)[Si](OCCBr)(c1ccccc1)c1ccccc1	195879157	WOTSEKGXOIGTRF-UHFFFAOYSA-N	363.371	3.958	50	40	FHGB	
C=CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccc(C)o1	14407502	AYXAWZWNYNCBTB-VCHYOVAHSA-N	363.211	3.679	50	40	FHGB	
O=C(CCl)NCCC(=O)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1	8733038	IBLBHNCTRVUBRG-UHFFFAOYSA-N	374.912	3.838	50	40	FHGB	
O=C(CCSc1ccccc1)N/N=C/c1ccc(OC2CSC2)cc1	5205761	NCYLHNOPVYEFQR-UDWIEESQSA-N	372.515	3.813	50	40	FHGB	
C/C(=N\NC(=O)c1cc(-c2ccc(Cl)cc2Cl)n[nH]1)c1ccncc1	4482990	JDNOCNIKOGXDRV-UFFVCSGVSA-N	374.231	3.933	50	40	FHGB	
COc1ccc(C(=O)/C(C#N)=C\c2ccc(O)c(Br)c2)cc1	71795569	UUDYVHXRDNOFMJ-JYRVWZFOSA-N	358.191	3.953	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)c1ccc(OC)c(OC)c1	408579259	FNQSKNBLXWHGQG-MHWRWJLKSA-N	353.374	3.865	50	40	FHGB	
Cc1ccc(CSCC(=O)N/N=C/c2ccc(Br)o2)cc1	408994835	JUNHXYDNTQXWSL-CAOOACKPSA-N	367.268	3.734	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)NC2CCCC2)c(C)n1-c1ccc(C#N)cc1	409194587	PUPWUGLPEIEPLI-UNOMPAQXSA-N	358.445	3.932	50	40	FHGB	
O=C(N/N=C\c1ccc2c(ccn2Cc2cccc(F)c2)c1)c1cccnc1	30960806	XJZYPPYFEILRHX-MXAYSNPKSA-N	372.403	3.988	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C/c1ccc(Br)cc1	875003	DIYXNASSNJVKNY-GIJQJNRQSA-N	367.630	3.632	50	40	FHGB	
CCCOc1ccc(/C=C(\C#N)C(=O)Nc2nnc(C(C)C)s2)cc1	1912680	AOTNPMLXEZNESQ-GXDHUFHOSA-N	356.451	3.996	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccc(C)cc1)c1ccc([N+](=O)[O-])cc1	59473409	XIOPKAMROGRVEV-XMHGGMMESA-N	357.435	3.677	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)Cc2ccc(C)cc2C)cc1OC	20195099	HZGNLWSCQBBZOI-HYARGMPZSA-N	354.450	3.794	50	40	FHGB	
CC(C)=NNC(=O)c1cc(-c2ccc([N+](=O)[O-])s2)nc2ccccc12	4785839	IKCMBPYKLOSUJZ-UHFFFAOYSA-N	354.391	3.997	50	40	FHGB	
Cc1nn(Cc2ccccc2)c(Cl)c1/C=N/NC(=O)c1ccc(F)cc1	6901708	QQFOXRMDOLZPQJ-SSDVNMTOSA-N	370.815	3.796	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)NC3CCCC3)o2)cc1	409196366	ZPGGGWXXNSKFDT-VBKFSLOCSA-N	364.401	3.699	50	40	FHGB	
C=C1CC(C(=O)N/N=C/c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)C1	408733606	MCSVNUCGBDBLHG-DJKKODMXSA-N	359.769	3.925	50	40	FHGB	
COc1ccccc1NC(=O)N/N=C\c1cc(C)n(-c2ccccn2)c1C	409247801	NZGZDBGQIWSLGZ-XKZIYDEJSA-N	363.421	3.653	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)c(F)c2)c1	66255743	HHBXWCHSMJBNLP-ATVHPVEESA-N	365.408	3.516	50	40	FHGB	
N#C/C(=C/c1ccc(NC(=O)Cc2ccc(Cl)cc2Cl)cc1)C(N)=O	98006972	YLOHXPDAWJWADF-QPEQYQDCSA-N	374.227	3.567	50	40	FHGB	
O=C(Cc1cccc2ccccc12)N/N=C/c1ccc2cccc(O)c2n1	15953321	KZVMNAFGURGZAA-OEAKJJBVSA-N	355.397	3.786	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CCCOc2ccc(Cl)cc2C)cc1	1949970	UCXJXHHTZXNWAG-FYJGNVAPSA-N	360.841	3.966	50	40	FHGB	
O=C(CCl)Nc1c(C(=O)Nc2ccc3c(c2)OCO3)oc2ccccc12	5107100	GASAHOHTIYVQCQ-UHFFFAOYSA-N	372.764	3.591	50	40	FHGB	
CC(C)(C)c1n[nH]c2c1[C@@H](c1cccc(C(F)(F)F)c1)C(C#N)=C(N)O2	806500	YKXVRSFKUWOUBA-LBPRGKRZSA-N	362.355	3.944	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C/c1cccn1-c1ccccc1	59247843	DCVLHHSUGIZYTH-FYJGNVAPSA-N	353.809	3.660	50	40	FHGB	
C/C(=N/NC(=O)COc1ccccc1C)c1ccc(Br)cc1	33319463	PULQAFXANFJXLJ-UYRXBGFRSA-N	361.239	3.677	50	40	FHGB	
CC(=O)OC1=C(C)C2=C3OC(=O)C(C)=C3CC[C@@]2(C)[C@@H](Cl)[C@@H]1Cl	5518993	YVGHSBLNSIYVSA-ISTRZQFTSA-N	357.233	3.979	50	40	FHGB	
Cc1ccc(-c2csc(NC(=S)NC(=O)CCCCl)n2)cc1	6923780	HDLHLSNCAQJHPG-UHFFFAOYSA-N	353.900	3.951	50	40	FHGB	
CC/C(=N\NC(=O)Cc1ccc(C)cc1C)c1ccc2c(c1)OCCO2	20195552	XJANZUCRVJADJF-RELWKKBWSA-N	352.434	3.548	50	40	FHGB	
CSC1=C(C#N)[C@@H](c2ccco2)C(C(=O)Nc2ccccc2)=C(C)N1	1505043	IDKHWZRWHWBCOL-KRWDZBQOSA-N	351.431	3.977	50	40	FHGB	
Cn1cc(/C=N/NC(=O)c2ccccc2Br)c2ccccc21	20760292	JCFGZRFCOJCPPC-VXLYETTFSA-N	356.223	3.705	50	40	FHGB	
CCOC(=O)/C(C#N)=C\Nc1ccc(Cl)cc1C(=O)c1ccccc1	5952669	MZQRSALFWOZXRB-OWBHPGMISA-N	354.793	3.953	50	40	FHGB	
Cc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1ccc2ccccc2c1	409107534	RWILZXZPNWDMBH-LFVJCYFKSA-N	373.456	3.749	50	40	FHGB	
N#C/C(=C\c1ccc(N2CCOCC2)o1)c1ccc(Br)cc1	1185208	RCXZTYORGXAGQA-SDNWHVSQSA-N	359.223	3.943	50	40	FHGB	
O=C(/C=C/c1ccccc1)NNC(=O)C(c1ccccc1)c1ccccc1	3663979	SDKCTLASWNXGFT-WUKNDPDISA-N	356.425	3.679	50	40	FHGB	
CC(=O)Nc1ccc(C(=O)NN(Cc2ccccc2)Cc2ccccc2)cc1	33028314	PTAAFJVRTMMGPM-UHFFFAOYSA-N	373.456	3.992	50	40	FHGB	
C/C(=N\NC(=O)C(O)(c1ccccc1)c1ccccc1)c1cccs1	5288027	HCAJUDPZHXPUOY-RCCKNPSSSA-N	350.443	3.524	50	40	FHGB	
O=C(COc1ccccc1Cl)N/N=C\c1cccn1-c1ccccc1	33586082	AOLPWNXKSKKNNS-BKUYFWCQSA-N	353.809	3.660	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)c(C)n1C[C@H]1CCCO1	8334331	BPEQIBVDTCYRBA-ZKTNYTPDSA-N	367.424	3.969	50	40	FHGB	
C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(Br)o1	409002210	ZCWOPNIIJRNGSJ-JSJZUPIVSA-N	353.241	3.673	50	40	FHGB	
COC(=O)c1cccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)c1	408723572	WUFWHGBQUYOMMS-YBFXNURJSA-N	354.387	3.559	50	40	FHGB	
COc1ccc(/C=N\NC(=O)Nc2ccc(Br)c(C)c2)cc1	408904076	DJDDGBSDGHYXML-ZDLGFXPLSA-N	362.227	3.922	50	40	FHGB	
Cc1cc(C(=O)O)ccc1-c1ccc(/C=N\NC(=O)c2cccs2)o1	4513480	KOPKPKBJCUFIDI-GRSHGNNSSA-N	354.387	3.779	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(OCc2ccccc2C#N)c(OC)c1	208676585	RQIUSPBKAQHPJB-VCHYOVAHSA-N	362.385	3.616	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NC2CC2)ccc1OCc1cccc(C)c1	409198229	AGNKTJJOPBILJZ-WOJGMQOQSA-N	362.429	3.768	50	40	FHGB	
N#C/C(=C\c1c[nH]c2ccccc12)C(=O)NCCc1c[nH]c2ccccc12	4544504	GTAUCQQATUYSFF-LFIBNONCSA-N	354.413	3.915	50	40	FHGB	
Cc1cccc(COc2cccc(C(=O)NNc3nc(C)cc(C)n3)c2)c1	25325163	LAPKPSKXZKPFKY-UHFFFAOYSA-N	362.433	3.738	50	40	FHGB	
CCn1cc(/C=N\NC(=O)COc2cccc3cccnc23)c2ccccc21	15978971	BUSDYEGZRWBEOU-CFRMEGHHSA-N	372.428	3.739	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccc(Cl)cc1)c1cc(O)ccc1O	4578442	UGMTWXNWQOXKBR-YBFXNURJSA-N	364.854	3.525	50	40	FHGB	
CCC(C)(C)[C@@H]1CCc2[nH]nc(C(=O)N/N=C\c3ccc(F)cc3)c2C1	33336187	YOQYZTXXADEVBO-JCRYTKJOSA-N	356.445	3.854	50	40	FHGB	
COC(=O)c1ccc([C@@H]2C(C#N)=C(C)NC3=C2C(=O)CC(C)(C)C3)cc1	100526502	UUCHSGMWXCSOKD-GOSISDBHSA-N	350.418	3.601	50	40	FHGB	
C=CCc1cc(/C=N/NC(C)=O)cc(OC)c1OCc1ccc(C)cc1	409021015	WWXKDKCBIOVSOT-LPYMAVHISA-N	352.434	3.781	50	40	FHGB	
CCN1C(=O)/C(=N\NC(=O)c2cc3cc(Cl)ccc3o2)c2ccccc21	6953697	OJEPQEWSOQXCBC-FXBPSFAMSA-N	367.792	3.587	50	40	FHGB	
N#C/C(=C\c1cc(Br)ccc1O)C(=O)Nc1ccccc1C#N	1453913	HFAMSADCLFQWFY-NTUHNPAUSA-N	368.190	3.572	50	40	FHGB	
COc1ccc(C(=O)N/N=C/C=C/c2cn(C(C)=O)c3ccccc23)cc1	1921510	FYUVRMARRGSSAW-MHORGHPUSA-N	361.401	3.739	50	40	FHGB	
COc1cccc(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)c1O	59515942	ZWOIMHCWSKRZKE-HAHDFKILSA-N	360.413	3.683	50	40	FHGB	
C/C(=N\NC(=O)[C@H]1CCCO1)c1ccc2c(c1)Nc1ccccc1S2	43973159	HDTCKITTXYMUFI-SVZNOHIVSA-N	353.447	3.914	50	40	FHGB	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2cc(C)ccn2)c1C	41817802	NHOGPKPHXRYFAZ-BFERYNQYSA-N	352.438	3.561	50	40	FHGB	
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccc(OC(F)F)cc1	655914	LROBOQBFVBGIEB-UHFFFAOYSA-N	371.796	3.573	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccc(C)cc1)c1ccc2c(c1)OCCO2	59474305	XFKRSVSVJRAYPF-RCCKNPSSSA-N	370.474	3.540	50	40	FHGB	
C#CCOc1ccc(Cl)cc1/C=N/NC(=O)Cc1ccc(C)cc1C	20194960	ZYLVZTSUTPLECO-LPYMAVHISA-N	354.837	3.662	50	40	FHGB	
CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(OC)cc1	408796960	FGWZUKQXVWQKHF-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C/c2ccc(N(CC)CC)cc2)cc1	6998961	HZUNHESXGVDYSE-CJLVFECKSA-N	351.450	3.862	50	40	FHGB	
Cc1cccc(C(=O)Nc2ccccc2C(=O)N/N=C/c2ccc(O)cc2)c1	409000458	YHKZISVUHOIEER-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)cc(OC)c1OC	16439797	HZCUFOCLBKJHJK-NTUHNPAUSA-N	372.808	3.911	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2C)ccc1OCC#N	3616341	FIKKUIUTMJZISX-GZTJUZNOSA-N	361.401	3.760	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)c2ccc(C)o2)o1	5547640	HBRUKKVBYFLAGG-VXLYETTFSA-N	369.333	3.529	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)COc2ccc(C)cc2C)cc1OCC	30843618	VHYFBCIVFZETET-XKZIYDEJSA-N	370.449	3.630	50	40	FHGB	
CO[P@](O)(=S)Oc1cc(Cl)c(Br)cc1Cl	1851871	SWZHPVYVLAUYFW-AWEZNQCLSA-N	351.973	3.998	50	40	FHGB	
COC(=O)Cn1cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)c2ccccc21	6950187	ZSLBFVYWUQCARS-GDNBJRDFSA-N	361.357	3.787	50	40	FHGB	
N#C/C(=C\c1ccc(C#N)cc1)C(=O)Nc1cccc(Br)c1	1212128	SXRWZYDWFGICPX-RIYZIHGNSA-N	352.191	3.866	50	40	FHGB	
Cc1ccccc1NC(=O)/C(C#N)=C/c1cn(CC(=O)O)c2ccccc12	4710508	SEOBWNMQIWXRID-XNTDXEJSSA-N	359.385	3.580	50	40	FHGB	
O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc(Cl)cc1	409005930	GOKFAVDIKHUSRO-UDWIEESQSA-N	372.812	3.612	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc(O)c([N+](=O)[O-])c1	408855794	DWDOWGGMSNRBRG-IZZDOVSWSA-N	373.752	3.508	50	40	FHGB	
COc1ccc(CCCC(=O)N/N=C/c2cc3c(cc2C)OCO3)c(C)c1	408905830	FJBPRTZLEJPDFU-WSDLNYQXSA-N	368.433	3.514	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)[C@H](C)Sc2ccccc2)cc1	831218	OCKRRWYWELQPMZ-HADWXUJASA-N	355.463	3.666	50	40	FHGB	
Cc1ccc(-c2nc3cc(N4C[C@@H](C(=O)Cl)CC4=O)ccc3o2)cc1	57327052	ZNGIMDWSSPZQIP-ZDUSSCGKSA-N	354.793	3.922	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(Br)o2)c1	18192458	JNTVOPYWJZTKRD-DHZHZOJOSA-N	361.195	3.986	50	40	FHGB	
O=C(N/N=C/c1cccnc1)c1cc2ccccc2n1Cc1ccccc1	18173156	UOYPTGRYNDYBOG-BUVRLJJBSA-N	354.413	3.849	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccc(Br)cc1)c1ccc(C)cc1	59720940	PSJWXXJVWBYEGU-DEDYPNTBSA-N	360.255	3.710	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)CCSc2ccc(C)cc2)c1	409129104	UJMAFZOIVASDOT-DEDYPNTBSA-N	358.463	3.645	50	40	FHGB	
O=C(N/N=C\c1ccc2c(ccn2Cc2cccc(F)c2)c1)c1ccncc1	409221037	JSRIQMULHYUAIK-QFEZKATASA-N	372.403	3.988	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)c2ccccc2O)c(OC(C)C)c1	14134742	DPROEUREBCBXDF-CIAFOILYSA-N	356.422	3.731	50	40	FHGB	
CC[C@H](Nc1ccc(OC)cc1)C(=O)N/N=C/c1c[nH]c2ccccc12	673224	OBAQDQGGGZOZQH-ZFJBLLOBSA-N	350.422	3.517	50	40	FHGB	
O=C(COc1cccc2cccnc12)N/N=C/c1cccn1-c1ccccc1	59248208	CNJHKOLZMSYDIU-BUVRLJJBSA-N	370.412	3.555	50	40	FHGB	
CCCOc1c(Cl)cc(/C=N/NC(=O)c2cccnc2)cc1OCC	3335223	HBECAMSWKBJKIC-SRZZPIQSSA-N	361.829	3.686	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)ccc1O	408566399	GCDZJNDGKIHVKX-HYARGMPZSA-N	354.450	3.781	50	40	FHGB	
C=CCc1cc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)ccc1OC	408819275	PRUOSWCBFMGEHJ-UYRXBGFRSA-N	362.429	3.656	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccc2)c(C)n1-c1ccc(N(C)C)cc1	408739831	FZGNAUNHYPQUSK-HZHRSRAPSA-N	360.461	3.924	50	40	FHGB	
COc1ccc(/C(C)=N\NC(=O)CCC(=O)Nc2ccc(C)cc2C)cc1	12447097	SWWKAXGQYZSCGN-KQWNVCNZSA-N	367.449	3.571	50	40	FHGB	
Cc1ccc(SCC(=O)NNC(=O)c2occc2-c2ccccc2)cc1	32904127	ZRAILYSFEZXWKO-UHFFFAOYSA-N	366.442	3.808	50	40	FHGB	
COc1ccccc1/C=N/NC(=O)CCC(=O)Nc1cccc(Cl)c1C	3083958	NTDZAPYDYANASM-CIAFOILYSA-N	373.840	3.526	50	40	FHGB	
CCOC(=O)N/N=C/c1c(C)nn(-c2cccc(C(F)(F)F)c2)c1Cl	3252087	BAHOCGYQGSJGMK-DNTJNYDQSA-N	374.750	3.933	50	40	FHGB	
CCc1ccccc1NC(=O)C/C(C)=N/NC(=O)CCc1ccccc1	4402029	IMFOUMYCSQVJHX-XQNSMLJCSA-N	351.450	3.703	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)N[C@H](C)CC)cc1OCC	408812201	CQCTZNYVSOIPOD-GULXKOIASA-N	360.841	3.572	50	40	FHGB	
COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2c(O)ccc3ccccc23)cc1	408887724	QPRCOMQKNHHGJQ-FOWTUZBSSA-N	372.380	3.878	50	40	FHGB	
COc1cc(Cl)c(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc1OC	408589315	LICMUUCILIBRTG-SRZZPIQSSA-N	360.841	3.667	50	40	FHGB	
N#C/C(=C\Nc1ccc(Br)cc1)S(=O)(=O)c1ccccc1	44842269	KKQKGRNTQNUNQE-RVDMUPIBSA-N	363.236	3.700	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1ccco1)c1ccccc1Cl	704610	CSJXTUUPRBJFDK-CIAFOILYSA-N	367.792	3.949	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)NC1CCCCC1)[C@H](Br)C2=O	6308792	VKMWSCRLAWWBDN-JLZZUVOBSA-N	356.304	3.594	50	40	FHGB	
Cc1cccc(-n2c(C)cc(/C=N/NC(=O)CNC3CCCCC3)c2C)c1	409383016	SVHZMFPJCIYXJZ-ZVHZXABRSA-N	366.509	3.775	50	40	FHGB	
CC(C)(C)c1ccc(C(=O)NNC2=CC(=O)C[C@@H](c3ccco3)C2)cc1	408751281	ABXPVUOCJUGIFF-HNNXBMFYSA-N	352.434	3.842	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(Br)cc2)ccc1O	208350495	CIAVRVINBRLYAH-WQLSENKSSA-N	373.206	3.709	50	40	FHGB	
CC(C)CCN1CSC2=C(C#N)[C@H](c3ccc(F)cc3)CC(=O)N2C1	20347973	GTWADJMHSZYFIT-INIZCTEOSA-N	359.470	3.887	50	40	FHGB	
Cc1nn(Cc2ccccc2)c(Cl)c1/C=N/NC(=O)c1ccoc1C	3538396	FCIXZCMMYGNJQP-KEBDBYFISA-N	356.813	3.559	50	40	FHGB	
O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1cccc(C(F)(F)F)c1	4544620	ZASFFVGYCRWDAD-QPSGOUHRSA-N	370.714	3.851	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(F)cc1	4784573	BUYQHHUBDJNBBI-JAIQZWGSSA-N	353.309	3.758	50	40	FHGB	
C=C(C)C(=O)Nc1cccc(/C(C)=N/NC(=O)c2cc(Cl)ccc2O)c1	5517835	ICUQVKJPXFHLEP-WSDLNYQXSA-N	371.824	3.714	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)Cc2coc3cc(C)c(C(C)C)cc23)n1	22233519	ZICPDVBSMLEONG-UHFFFAOYSA-N	352.438	3.957	50	40	FHGB	
Cc1cc(C)nc(SCC(=O)NN=C2c3ccccc3-c3ccccc32)n1	36290036	VCOYUHVFSLZIME-UHFFFAOYSA-N	374.469	3.735	50	40	FHGB	
CC[C@@H]1CCC2=C(C1)[C@H](c1ccccc1)[C@](C#N)(C(=O)OC)C(N)=C2C#N	254761930	YQRJFHQSMAWMSZ-LNHNDHHWSA-N	361.445	3.710	50	40	FHGB	
C[C@H]1C[C@@H]2[C@H]3CCC4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@@H](O)C[C@]2(C)/C1=C(\O)C=O	256967654	TYYMPHSFTLTHRI-WJINANFXSA-N	374.452	3.614	50	40	FHGB	
N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)Sc1nc2ccccc2[nH]1	408599318	SOFRKOZDLDHMMW-VZUCSPMQSA-N	366.358	3.857	50	40	FHGB	
O=C(N/N=C/c1c(F)cccc1Cl)c1ccc(Cl)c([N+](=O)[O-])c1	408827733	GPIQMLOBFNEWMW-CNHKJKLMSA-N	356.140	3.805	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(F)cc2F)o1)c1ccc([N+](=O)[O-])cc1	408975727	MCLJEILZFXWOEX-UFFVCSGVSA-N	371.299	3.897	50	40	FHGB	
C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CCl	1570003483	MBKAANDQMJJTRM-AKXKBWEISA-N	374.908	3.999	50	40	FHGB	
CCc1n[nH]c2c1[C@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2	987536	NEUWCJOAWCJQJC-LJQANCHMSA-N	372.428	3.769	50	40	FHGB	
O=C(CCl)Nc1ccc(C(=O)Nc2nnc(-c3ccccc3)s2)cc1	9062161	QASRRTBGVNMSOH-UHFFFAOYSA-N	372.837	3.635	50	40	FHGB	
Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2c(Cl)cccc2Cl)c1	59503430	KKTXUHRBOIKRKY-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
C#CCn1c(C)c(/C=N/NC(=O)c2ccc(OCC)cc2)c2ccccc21	20764152	LHFXVYBZAFBROS-HZHRSRAPSA-N	359.429	3.746	50	40	FHGB	
CC(C)(C)c1ccc(OCCCOc2ccc(/C=N/NC(N)=O)cc2)cc1	4673436	TVFFUTWSCIYQSQ-HZHRSRAPSA-N	369.465	3.834	50	40	FHGB	
C/C(=N\NC(=O)c1ccc2c(c1)OCO2)c1cc(Cl)ccc1Cl	5516986	JWJQUMTYUVUKAE-DJKKODMXSA-N	351.189	3.876	50	40	FHGB	
CCCOc1ccc(Br)cc1/C=C(\C#N)C(=O)N1CCCC1	409368493	YPHYQEVKXBPTSM-GXDHUFHOSA-N	363.255	3.767	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)Cc2ccc(OC)cc2)c2ccccc21	6328802	SCLSMQHWYFPIMD-HZHRSRAPSA-N	361.445	3.837	50	40	FHGB	
COc1ccccc1OCC(=O)N/N=C/c1ccc(Cl)cc1Cl	5515180	BCPJBMUJKHHALN-DJKKODMXSA-N	353.205	3.531	50	40	FHGB	
COc1ccc(NC(=O)CSc2ccccc2NC(=O)CCl)cc1	1332352	NSSBQJNNAMOWGB-UHFFFAOYSA-N	364.854	3.603	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc3c(s2)CC[C@@H](C)C3)c(O)c1	3380769	NPLUNRJFMMORCP-ZICWZVMQSA-N	358.463	3.741	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C2\SCC(=O)N2c2ccccc2C)c1	5047357	QPMQLDFWSOHTFO-SILNSSARSA-N	363.442	3.757	50	40	FHGB	
N#C/C(=C\c1ccccc1OCc1ccc(F)cc1)C(=O)N1CCCC1	409368607	DWJNSAFPWPSORD-QGOAFFKASA-N	350.393	3.934	50	40	FHGB	
O=C(CCCC(=O)Nc1ccc(Cl)c(Cl)c1)N/N=C/c1ccco1	409255379	JXCMONYNHCHDIG-VXLYETTFSA-N	368.220	3.846	50	40	FHGB	
C[C@@H](NC(=O)c1ccc(NC(=O)CBr)cc1)c1ccccc1	35605495	IFHYYVBBGMKHDT-GFCCVEGCSA-N	361.239	3.511	50	40	FHGB	
O=C(N/N=C/c1ccc(F)s1)c1ccc(Cn2cc(Cl)cn2)cc1	252494820	OFRAIIWUOMPPJO-UFWORHAWSA-N	362.817	3.549	50	40	FHGB	
Cc1ccc(C(O)(C(=O)NN(C)c2ccccc2)c2ccc(C)cc2)cc1	824850	JJTBABIQZSCFHG-UHFFFAOYSA-N	360.457	3.707	50	40	FHGB	
O=C(CNc1ccc(Cl)cc1)N/N=C/c1cccc(Br)c1	3153479	YWORPHJSBNSLFE-DJKKODMXSA-N	366.646	3.665	50	40	FHGB	
O=C(CCOc1cccc(Br)c1)N/N=C/C=C/c1ccco1	3659636	WJAKTYLDCACHPT-KUYIBZPLSA-N	363.211	3.626	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)c(OC)c1	4503311	DGNSILOFJYQBBT-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2ccc(C)s2)c(Br)c1	4526145	QPKYXXNLKLMHJZ-CAOOACKPSA-N	367.268	3.657	50	40	FHGB	
C/C(=N\NC(=O)COc1c(C)cc(Br)cc1C)c1ccco1	4672115	LDKZZSQSALUPRR-LDADJPATSA-N	365.227	3.578	50	40	FHGB	
COc1ccc(-c2ccc(CCC(=O)NNC(=O)C3CCCCC3)o2)cc1	8983958	XXNOIIROKMTXPX-UHFFFAOYSA-N	370.449	3.616	50	40	FHGB	
N#C/C(=C\c1cnn(-c2ccc(Cl)cc2)c1)C(=O)NC1CCCCC1	40139591	NUTYQHVXVHYCHW-XNTDXEJSSA-N	354.841	3.882	50	40	FHGB	
O=C(Br)[C@H](Br)c1ccc(Br)cc1	72207491	TZYLSVNNTRQRRC-SSDOTTSWSA-N	356.839	3.807	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(N(C)C)cc2)cc1OC	206244954	AHSSJWPLFBHOEB-VBKFSLOCSA-N	365.433	3.706	50	40	FHGB	
COc1ccc(NC(=O)N/N=C\c2ccc(N3CCCCC3)cc2)cc1	408959855	HALUKKFGXFVJJX-QNGOZBTKSA-N	352.438	3.841	50	40	FHGB	
COc1ccc(CC(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1	670945	QGNKDNXOTNBMDU-UHFFFAOYSA-N	374.849	3.567	50	40	FHGB	
O=C(Cc1ccc(Br)cc1)N/N=C/c1ccccc1Cl	3071762	UQCJUCPUQRGYCE-VCHYOVAHSA-N	351.631	3.795	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)N/N=C/c1ccccc1Cl)c(C)n2C	2211927	RTZFQUXZFNYEAC-SRZZPIQSSA-N	355.825	3.913	50	40	FHGB	
C/C(=N\NC(=O)COc1ccccc1F)c1ccc(Br)cc1	4965456	QTALSMVJHGKWRQ-YBFXNURJSA-N	365.202	3.507	50	40	FHGB	
NC(=O)Nc1cccc(C(=O)NN(Cc2ccccc2)Cc2ccccc2)c1	8096294	BKNHLQCPHBKHOG-UHFFFAOYSA-N	374.444	3.524	50	40	FHGB	
Cc1cc(C)c2c(c1)/C(=N\NC(=O)c1ccccc1-n1cccc1)C(O)=N2	9646000	JEDWLFGHNPWDHA-UHFFFAOYSA-N	358.401	3.830	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)cc(Cl)c1O	6410563	KDVNXJUBFHEKII-AAWHYMEISA-N	356.809	3.839	50	40	FHGB	
O=C(N/N=C/c1cc(Br)cc(Cl)c1O)c1cccs1	5582339	KZTJRABXUYUYSQ-GIDUJCDVSA-N	359.632	3.634	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc(N2CCCC2)cc1	706053	MXZLEDYBRJAKBI-IBGZPJMESA-N	363.461	3.738	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Cl)c(Cl)c1)=N\NC(=O)c1cccnc1	101904058	MSKHTEOICNEEDP-UFFVCSGVSA-N	365.220	3.523	50	40	FHGB	
O=[P@](O)(CCP(c1ccccc1)c1ccccc1)[C@@H](O)c1ccco1	1241505	FQKIQDWJTOQAIR-LJQANCHMSA-N	374.313	3.674	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)o1)c1ccccc1Br	4735474	NHWFGKUTBPUASJ-VIZOYTHASA-N	372.016	3.569	50	40	FHGB	
COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1ccc(Cl)cc1	5879691	PMVDSXWFONXZMW-MDWZMJQESA-N	372.808	3.911	50	40	FHGB	
CO[C@]1(C(=O)Nc2ccc(OCCBr)cc2)CCC[C@H](C)C1	225634728	YEXIDDHSTKHEFH-SUMWQHHRSA-N	370.287	3.994	50	40	FHGB	
O=C(N/N=C/c1cccc(O)c1)c1ccc(N2Cc3ccccc3C2)cc1	408729486	GFKSQNXZVTUBOR-YDZHTSKRSA-N	357.413	3.676	50	40	FHGB	
COC(=O)[C@H](Cc1ccccc1)P(=O)(c1ccccc1)c1ccccc1	667963	BSXVOEYIIHQNPT-NRFANRHFSA-N	364.381	3.785	50	40	FHGB	
Cc1cc(C(C)(C)C)ccc1OCC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1	832209	JXLDXUJFQYYDPV-CIAFOILYSA-N	369.421	3.730	50	40	FHGB	
C[C@H](Oc1cccc2ccccc12)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]	1434106	LJADSYQIHPWSAL-HADWXUJASA-N	363.373	3.666	50	40	FHGB	
C[C@@H]1[C@@H](c2ccc3c(c2)OCO3)C[C@H](Cl)C[C@@]12C=C1OCOC1=CC2=O	5664285	IDIAWFXBAIWWNZ-KXXATPMCSA-N	374.820	3.877	50	40	FHGB	
COc1cccc(/C=N/NC(C)=O)c1OCCCOc1cc(C)cc(C)c1	9514128	VUTZIWJSQQJAIO-HYARGMPZSA-N	370.449	3.630	50	40	FHGB	
N#C/C(=C\c1ccccc1)C(=O)Oc1cc(Br)ccc1C=O	408755125	YTPXWODDDJSSAW-RIYZIHGNSA-N	356.175	3.774	50	40	FHGB	
CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccc(Cl)cc1)c1ccccc1	408977030	CFMFVCRJHCVBJV-VYVDHXHBSA-N	373.840	3.668	50	40	FHGB	
CCCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1	5597580	QBGKTVUKTRGHNO-RVDMUPIBSA-N	351.362	3.929	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc(C)c2C)cc(OC)c1OC	7164299	RTSVORWKQMBXAB-CXUHLZMHSA-N	366.417	3.875	50	40	FHGB	
COC(=O)c1ccc(Cl)cc1-c1ccc(/C=N/NC(=O)c2ccco2)o1	8101728	AHNSBGLKCPEWPM-KEBDBYFISA-N	372.764	3.744	50	40	FHGB	
CC(C)(C)c1ccc([C@H]2C[C@@H]2C(=O)N/N=C\c2ccc(O)c(O)c2)cc1	30738459	YSMQCTMMMJDQNV-XHDDOUQKSA-N	352.434	3.649	50	40	FHGB	
C/C(=N/NC(=O)c1ccccc1OCCOc1ccccc1)c1ccco1	35242814	IEZRETVBZWYQPW-JWGURIENSA-N	364.401	3.891	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)c(OC)c1C	408967336	PZADISYRMBCYEM-LSHDLFTRSA-N	366.339	3.795	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(Cl)cc1)OCO2	409066701	MBKTXCRXZIPLNK-WUXMJOGZSA-N	356.765	3.623	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C\c2ccc(N3CCCC3)c(F)c2)c1	409094317	DAMGZOXJSIVBNR-WJDWOHSUSA-N	365.408	3.980	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccccc1)[C@H](Br)C2=O	4185831	JLKGVIGPYYRFHH-JLZZUVOBSA-N	350.256	3.784	50	40	FHGB	
C[C@H](CC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)c1ccccc1	5578948	YYVRBTRIQMKTDX-NOCBQHASSA-N	354.494	3.934	50	40	FHGB	
O=C(/C=C/c1ccco1)Oc1cccc(/C=N/NC(=O)c2ccccc2)c1	4784692	JQZGBVSAUYTHBV-NRLZKTNLSA-N	360.369	3.662	50	40	FHGB	
CC(C)N(C[C@H]1CCCCN1C(=O)OCc1ccccc1)C(=O)CCl	79392723	PUGGKFNANFVDKO-QGZVFWFLSA-N	366.889	3.654	50	40	FHGB	
CCc1sc(C(=O)NNC(=O)c2ccc(OC(F)(F)F)cc2)cc1C	6552635	NXSHVVWNUZMGGP-UHFFFAOYSA-N	372.368	3.592	50	40	FHGB	
Cc1ccc(C)c(OCC(=O)N/N=C/c2c(F)c(F)c(F)c(F)c2F)c1	6839571	JFVQTSHPMMRGMK-TXNBCWFRSA-N	372.293	3.528	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2C)cc1C(=O)O	12447063	GCAGWRYMOIWQCK-OQLLNIDSSA-N	350.374	3.556	50	40	FHGB	
COc1cc(OC)cc(C(=O)NNC2c3ccccc3-c3ccccc32)c1	15475218	UKWVKIOFPTZFCD-UHFFFAOYSA-N	360.413	3.708	50	40	FHGB	
Cc1sc2ncnc(SCC(=O)NNc3ccc(F)cc3)c2c1C	45971365	AZKXSQHKWHGWNR-UHFFFAOYSA-N	362.455	3.683	50	40	FHGB	
Cc1cccc(/C=N/NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1	408765741	NNUPBGINFWHGEZ-ZVHZXABRSA-N	369.424	3.613	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccccc1Br	711313	HLQVRBNRPRSKBT-HNNXBMFYSA-N	373.250	3.900	50	40	FHGB	
Cc1ccc2nc(Cl)c(/C=N/NC(=O)COc3ccccc3)cc2c1	408728752	SSYBOBQFGHIVOL-SRZZPIQSSA-N	353.809	3.726	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(CC)cc1)OCO2	409102629	DSYSAWXZMJSCPF-CXUHLZMHSA-N	364.401	3.922	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)[C@H]2[C@H](C=C(Cl)Cl)C2(C)C)ccc1O	83292562	HXJAIYPOVGPKRG-PHBNXIIUSA-N	371.264	3.832	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1	13923521	GBBPHLIVVPRKNW-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
CCCc1nn(C)c2c1[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2	706887	GJNGPPWWXJJHNO-ZDUSSCGKSA-N	363.248	3.898	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2ccc(F)cc2)cc(Cl)c1OC	7894206	CUZLWCGODBNYJO-KEBDBYFISA-N	350.777	3.650	50	40	FHGB	
CC[C@@H](Br)C(=O)NCCC(=O)Nc1ccc(C(C)(C)C)cc1	8733158	UJMPXUQYRWVJDB-CQSZACIVSA-N	369.303	3.602	50	40	FHGB	
Cn1/c(=N\NC(=O)Cc2c(Cl)cccc2Cl)sc2ccccc21	3327605	ZDDNUPHEZAIMEH-CAPFRKAQSA-N	366.273	3.721	50	40	FHGB	
CCn1c(C)cc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c1C	10037841	CERSMIHMKKPJJR-UNOMPAQXSA-N	360.461	3.872	50	40	FHGB	
C/C(=N\NC(=O)c1ccccn1)c1cccc(NC(=O)c2cccs2)c1	5895715	YBHBQGQGGRJOQI-LPYMAVHISA-N	364.430	3.549	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccc2c(c1)OCCO2)c1ccc(C(C)(C)C)cc1	409359262	AWLTUFVZDKBCRB-HZHRSRAPSA-N	366.461	3.838	50	40	FHGB	
CCCCOc1ccc(C(=O)N/N=c2\sc3ccccc3n2C)cc1	1958664	LOPYBFXLKLOPEE-VZCXRCSSSA-N	355.463	3.664	50	40	FHGB	
CC1(C)CC(=O)C/C(=N\NC(=O)COc2ccc(Cl)cc2Cl)C1	100037932	YVTZQTYIRSOZPH-YBFXNURJSA-N	357.237	3.624	50	40	FHGB	
Cc1ccccc1NNC(=O)C(O)(Cc1ccccc1)Cc1ccccc1	778176	VHDKGDXFBRBFQT-UHFFFAOYSA-N	360.457	3.655	50	40	FHGB	
COc1ccc(OC)c([C@H](O)P(=O)(c2ccccc2)c2ccccc2)c1	2032200	RSMCNCDZDWNBLF-OAQYLSRUSA-N	368.369	3.709	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1-n1cccc1	7889935	UZURCSAAUIQPGE-UDWIEESQSA-N	368.780	3.803	50	40	FHGB	
CCOc1ccc(/C(C)=N\NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)cc1	33147656	DQWQXJWAIGKEOW-MOSHPQCFSA-N	352.394	3.531	50	40	FHGB	
CN1CCC(=NNC(=O)CSC2c3ccccc3-c3ccccc32)CC1	57314445	COPHIAPZCYLJPB-UHFFFAOYSA-N	365.502	3.687	50	40	FHGB	
CCN(NC(=O)Cc1cc(=O)oc2cc(C)ccc12)c1ccc(C)cc1	69529012	XPGMVELFYDWTSA-UHFFFAOYSA-N	350.418	3.510	50	40	FHGB	
CN(C)C(=O)[C@H](c1ccccc1)[PH](C)(c1ccccc1)c1ccccc1	104117857	QNNWVHSGTSJXTN-QFIPXVFZSA-N	363.441	3.847	50	40	FHGB	
CCOC(=O)[C@@H]1CCC/C1=N\NC(=O)CCSc1ccc(Cl)cc1	408719408	DORWPBAQSPIUFY-CVALACBASA-N	368.886	3.658	50	40	FHGB	
O=[N+]([O-])c1ccc(S(=O)(=O)C[C@@H](Br)c2ccccc2)cc1	823772	HJJXHEUFCYYHCB-CQSZACIVSA-N	370.224	3.505	50	40	FHGB	
Cc1ccccc1NC(=O)/C(C#N)=C\c1cn(CC(=O)O)c2ccccc12	4959617	SEOBWNMQIWXRID-GDNBJRDFSA-N	359.385	3.580	50	40	FHGB	
COc1ccc(OCC(=O)NN=C(c2ccccc2)c2ccccc2)cc1	1392640	VMFPARGXQUUHHO-UHFFFAOYSA-N	360.413	3.643	50	40	FHGB	
CSc1ccc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc1	3281897	XNEMJYPRVFDAJM-LSHDLFTRSA-N	367.396	3.990	50	40	FHGB	
CN1/C(=C(/C#N)C(=O)COC(=O)CC2CCCC2)Sc2ccccc21	12651064	IIDDLMXWNKTZOZ-XMHGGMMESA-N	356.447	3.656	50	40	FHGB	
CN(C(=O)[C@@]12CC[C@@](C)(C(=O)[C@H]1Br)C2(C)C)c1ccccc1	2172562	FTAAUGWQDXBZLU-JEBQAFNWSA-N	364.283	3.808	50	40	FHGB	
COc1ccccc1/C=C(\C#N)c1nnc(NC(=O)c2ccccc2)s1	4478126	STUKXHSBCCEGLG-RVDMUPIBSA-N	362.414	3.863	50	40	FHGB	
COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1cccc(Cl)c1	16439827	XTORKXNBTIYCOT-NTUHNPAUSA-N	372.808	3.911	50	40	FHGB	
CCN(NC(=O)C[C@@H]1c2ccccc2C=CN1C(C)=O)c1ccc(C)cc1	52551402	SDUZCBNLYXMTNM-OAQYLSRUSA-N	363.461	3.817	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccccc1)c1sc2nc(C)nc(C)c2c1C	42644499	NBPVLSRYWJXQAZ-YDZHTSKRSA-N	367.478	3.569	50	40	FHGB	
CCc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c2ccco2)cc1	58895655	HDLXKCBSGWNDGZ-HYARGMPZSA-N	361.401	3.858	50	40	FHGB	
CC(=O)Oc1ccc(C)cc1C[C@@H](Br)CBr	103697570	IRLWFLREWFIRGZ-LLVKDONJSA-N	350.050	3.621	50	40	FHGB	
Cc1ccc(C(O)(C(=O)N/N=C/c2ccccc2)c2ccc(C)cc2)cc1	2311240	UYVJHGBJAGDQGE-LFVJCYFKSA-N	358.441	3.690	50	40	FHGB	
Cc1cccc(/C=N/NC(=O)COc2ccc(Cl)cc2Cl)c1O	4720886	ZJUGSZMLZRNGAU-UFWORHAWSA-N	353.205	3.537	50	40	FHGB	
Cc1ccc(-n2cccc2/C=N\NC(=O)c2cccc(O)c2)cc1Cl	409020596	QWQOUUOIMMSVEF-MTJSOVHGSA-N	353.809	3.909	50	40	FHGB	
C=CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)cc1OCC	5953495	NZHUPVRQDTVOLE-VBKFSLOCSA-N	364.401	3.901	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1	1215030	LREYPRVDKRRIPU-FYJGNVAPSA-N	363.373	3.911	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C/c1cc(Br)ccc1O)c1ccccc1	3326152	RNWICFCYANMZML-DGGAMASNSA-N	371.234	3.939	50	40	FHGB	
CCSC1=C(C#N)[C@H](c2ccccc2Cl)[C@H](C(=O)OC)C(O)=N1	9014934	YOYYWBVGEURTTI-STQMWFEESA-N	350.827	3.671	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)SCc1ccccc1)c1cccc([N+](=O)[O-])c1	20248566	VVWUDBQBKILBBH-NFECSFHCSA-N	357.435	3.757	50	40	FHGB	
N#CC1=C2SCN(Cc3ccco3)CN2C(=O)C[C@@H]1c1ccc(F)cc1	20348025	VMYIJAMNCHZUQT-MRXNPFEDSA-N	369.421	3.634	50	40	FHGB	
COc1cc(N2CCCCC2)ccc1/C=N\NC(=O)Nc1ccccc1	409240155	RPFMCSAIOOFMHS-QNGOZBTKSA-N	352.438	3.841	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1ccccc1Cl)c1ccco1	1105296	POKRRPMAYGBZGR-CIAFOILYSA-N	367.792	3.949	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2coc3ccc(C)cc3c2=O)cc1	2754756	NROHXQUFHKAORC-WSDLNYQXSA-N	364.401	3.654	50	40	FHGB	
CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(Br)cc2)cc1	3082686	YARWLNUFSNHUKP-YBFXNURJSA-N	374.238	3.562	50	40	FHGB	
Cc1ccc(CNC(=O)/C(C#N)=C\c2c[nH]nc2-c2ccc(F)cc2)cc1	5728569	RZJFZQSKVAGLQT-YVLHZVERSA-N	360.392	3.748	50	40	FHGB	
Cc1cccc(NC(=S)NNC(=O)c2cc3ccccc3cc2O)c1C	6632388	PTRRCUGHBAMZSB-UHFFFAOYSA-N	365.458	3.794	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2cc(OC)ccc2OC)cc1	6947471	BHNTYMXEYRLARN-PTNGSMBKSA-N	352.390	3.648	50	40	FHGB	
CCN(CC)c1ccc(C(=O)NNC(=O)c2cc(SC)ccc2C)cc1	12737462	UCKZCZZIMHNZOJ-UHFFFAOYSA-N	371.506	3.638	50	40	FHGB	
N#C/C(=C\c1ccc(OCc2ccccc2)cc1)C(=O)NCc1cccnc1	20522789	RUVSICVFDATNKI-FYJGNVAPSA-N	369.424	3.884	50	40	FHGB	
Cc1cc(/C=N/NC(=O)CC#N)cc(C)c1OCc1ccc(Cl)cc1	408857471	OKDLQYBTLXFFJO-SSDVNMTOSA-N	355.825	3.900	50	40	FHGB	
COc1ccccc1OCc1ccc(C(=O)N/N=C/c2ccco2)cc1	654855	UTZLHNIXQYJGDE-FYJGNVAPSA-N	350.374	3.631	50	40	FHGB	
COC(=O)c1ccc(/C=N\NC(=O)c2ccc(Cl)cc2Cl)cc1	33389022	RXAHOZFIZGZFET-OCKHKDLRSA-N	351.189	3.544	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc(C)c(C)c2)cc1[N+](=O)[O-]	409182668	MWZTWISOTQWSSO-RCCKNPSSSA-N	369.421	3.693	50	40	FHGB	
Cc1cc(/C=N/NC(=O)Cc2cccs2)c(C)n1-c1ccc(F)cc1	409197100	VVFSDKSVGRKSHS-CIAFOILYSA-N	355.438	3.988	50	40	FHGB	
O=C(CNc1ccccc1)N/N=C/c1ccc(OCc2ccccc2)cc1	4711382	CVVRWVDSFBUJNQ-BUVRLJJBSA-N	359.429	3.828	50	40	FHGB	
CCN(CC)c1ccc(C(=O)N/N=C(\C)CCc2ccc(O)cc2)cc1	5692508	YRLUVUXODZVEBU-CJLVFECKSA-N	353.466	3.977	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccccc1C(=O)O	20246289	PPHHXIYIJLDLEA-VURRPDKYSA-N	362.838	3.669	50	40	FHGB	
O=C(N/N=C\c1ccc(OC(=O)c2ccco2)cc1)c1ccc(Cl)cc1	30817640	UNJFNYFDXAQKAA-MTJSOVHGSA-N	368.776	3.916	50	40	FHGB	
CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(CC[C@@H](C)C2)[C@H]1c1ccccc1	35193545	SPSUTBNAUGSSCK-JSVDNDDVSA-N	361.445	3.710	50	40	FHGB	
Cc1ccccc1NC(=O)/C(C#N)=C\c1ccc(N2CCOCC2)c(F)c1	66255724	UBNSDSQJLUPLEM-ATVHPVEESA-N	365.408	3.516	50	40	FHGB	
CC(C)OC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(N)=C(C#N)C#N)o2)cc1	100634278	CQVBPRQOVPENIT-CXUHLZMHSA-N	372.384	3.679	50	40	FHGB	
COc1cccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1	108057527	DCUQYOFZHBVKTJ-VCHYOVAHSA-N	355.375	3.582	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc2c(c1Cl)OCO2	851156	SQKXJOOCPSPXJK-AWEZNQCLSA-N	372.808	3.520	50	40	FHGB	
CCCCc1ccc(OCC(=O)N/N=C/c2ccc(N(C)C)cc2)cc1	3174722	DYWYOOGPOWURDQ-PXLXIMEGSA-N	353.466	3.624	50	40	FHGB	
CCN(CC)c1ccc(C(=O)N/N=C/C=C/c2ccccc2[N+](=O)[O-])cc1	3212985	ZWKHDLCUAHZHEH-IGPSSODJSA-N	366.421	3.870	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(C34CC5CC(CC(C5)C3)C4)c2[C@H]1c1ccco1	4171145	PADVCXCRTPQXOQ-KWGKBLMISA-N	362.433	3.689	50	40	FHGB	
CCOC(=O)[C@H](CC)/C(C)=N/NC(=O)C(c1ccccc1)c1ccccc1	5909845	ULRIZCNZAPMIEO-KMYAOZERSA-N	366.461	3.900	50	40	FHGB	
O=C(CSc1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1	6506018	UFBLGKQHFZRWON-UHFFFAOYSA-N	355.246	3.547	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1	7209866	KNFXRBMGGOWFFP-RVDMUPIBSA-N	362.820	3.846	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1cccnc1	13596220	IZTIHJRYWASDRG-JMIUGGIZSA-N	370.752	3.667	50	40	FHGB	
COc1cc(OC)c(/C(C)=N/NC(=O)c2cccc(Cl)c2)c(OC)c1	20159143	CNZQHJLOYHIHHE-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
CC(C)[C@H]1C(=O)OC(=O)N1C(=O)OCC1c2ccccc2-c2ccccc21	100096307	ZQASWXRVGKYFLJ-SFHVURJKSA-N	365.385	3.939	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@@H]1C[C@H]1c1ccccc1	84525434	RWLQMNWECRZJKB-WJEFAGDFSA-N	352.478	3.544	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)c2ccccc2Cl)cc1[N+](=O)[O-]	408591843	VPRKPDIWQCDSSH-YBFXNURJSA-N	361.785	3.801	50	40	FHGB	
O=C(O)c1cccc(-n2cccc2/C=N/NC(=O)c2cccc(Cl)c2)c1	409098942	MVSGBXYYTIZTKA-CIAFOILYSA-N	367.792	3.593	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=C(\C#N)C(=O)Nc1cccc(C(=O)O)c1	33671410	ZXXLXNGQIMYZDA-RIYZIHGNSA-N	370.792	3.983	50	40	FHGB	
C/C(CC(=O)Nc1c(C)cc(C)cc1C)=N\NC(=O)c1ccccc1F	4402062	AISAIQGGSLIFAC-HZHRSRAPSA-N	355.413	3.885	50	40	FHGB	
COc1cccc(SCC(=O)/C(C#N)=C2/Nc3ccccc3N2C)c1	40068661	ILCIJHSAGDNFGQ-CYVLTUHYSA-N	351.431	3.653	50	40	FHGB	
C/C(=N/NC(=O)[C@@H]1COc2cc3ccccc3cc2O1)c1ccc(C)cc1	4893922	CBSDTIKTICOLJP-XUVWKZFSSA-N	360.413	3.828	50	40	FHGB	
C[C@@H]1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc(OC(F)(F)F)cc1	3135165	CFJHPNILZRCIJV-RFAUZJTJSA-N	364.323	3.646	50	40	FHGB	
FC(F)(F)C(F)(F)C(F)(F)[C@@H](Br)CBr	103527532	BTZKXQHJFPEDEC-REOHCLBHSA-N	355.873	3.978	50	40	FHGB	
Cc1cc(C(=O)NNc2ccnc3cc(Cl)ccc23)ccc1[N+](=O)[O-]	8720755	SMMNNNCXHCRRTO-UHFFFAOYSA-N	356.769	3.862	50	40	FHGB	
Cc1cccc(C(=O)Nc2ccccc2C(=O)N/N=C/c2ccccc2O)c1	409000125	DTSCLJLEKMSYNR-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
N#C/C(=C/c1ccccc1Br)C(=O)NCCc1ccccc1	211493985	NBERHQBERRULQY-VBKFSLOCSA-N	355.235	3.715	50	40	FHGB	
C[C@H](I)C[C@](F)(OC(F)(F)F)C(F)(F)F	16159359	MGSMUGDXPQAOBJ-IMJSIDKUSA-N	354.003	3.965	50	40	FHGB	
O=C(O)/C=C\C(=O)Nc1ccc2c(c1)[C@@H](Br)c1ccccc1-2	17311948	JTIYJRIPYLNEHT-QWPQOLDESA-N	358.191	3.731	50	40	FHGB	
C/C(=N\NC(=O)CNc1cccc2ccccc12)c1cccc([N+](=O)[O-])c1	1092668	QUKIDDCTQVSVKH-HYARGMPZSA-N	362.389	3.700	50	40	FHGB	
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1ccccc1O	5528738	YTOHAVNXTPAHPR-XTTRTJGBSA-N	353.205	3.617	50	40	FHGB	
CCCOc1ccccc1/C=N\NC(=O)c1ccc(OC)c(OCC)c1	6324725	SYHKLCMUAZNYCO-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
O=C(/C=C/c1ccc(F)cc1)NNC(=O)C(c1ccccc1)c1ccccc1	6338040	VNBIIBSNIPWOAA-DTQAZKPQSA-N	374.415	3.818	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc1OC	408549696	XEIBEEMKLFNHNK-LSHDLFTRSA-N	366.339	3.795	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2c(C)nn(-c3ccc(F)cc3)c2Cl)c(C)o1	2658853	USAUEZIJPXUVAG-ZVBGSRNCSA-N	374.803	3.947	50	40	FHGB	
CC(C)Oc1cccc(NC(=O)/C(C#N)=C\c2ccc(OCC#N)cc2)c1	408776118	LYUMRZCDTWVQJP-ATVHPVEESA-N	361.401	3.922	50	40	FHGB	
C/C(=N\NC(=O)c1cccs1)c1ccc(NC(=O)c2ccco2)cc1	5382144	NWZUCBXWLHRRCS-UDWIEESQSA-N	353.403	3.747	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(C[C@H](C)CC2)[C@@H]1c1ccccc1	221956137	AQSFJZCHQMDSTI-LNHNDHHWSA-N	361.445	3.710	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc(Br)cc2)o1)C(=O)NC1CC1	7164048	OZAJJVUXNMRUKJ-FMIVXFBMSA-N	357.207	3.895	50	40	FHGB	
O=C(NNC(=S)Nc1ccccc1)C(c1ccccc1)c1ccccc1	654651	ZOXCYDOKRIICBM-UHFFFAOYSA-N	361.470	3.836	50	40	FHGB	
Cc1ccc2nc(C)cc(SCC(=O)N/N=C/c3ccc(O)cc3)c2c1	871084	KBZNWADKRVQAQR-SRZZPIQSSA-N	365.458	3.800	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C\c1ccc(O)c(Br)c1)c1ccccc1	4544451	SXYVRMOFZHJYDQ-CDCQXCROSA-N	371.234	3.939	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2cccc(Br)c2)cc1C	5337665	OFISKLSTNIRAGP-KEBDBYFISA-N	360.255	3.628	50	40	FHGB	
COc1ccc(OC)c(/C=C2\C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)c1	19824595	ODFLYPQEPWQGEL-OVCLIPMQSA-N	358.401	3.712	50	40	FHGB	
Cc1ccc(-c2cc(C(=O)N/N=C/c3c[nH]c4ccccc34)[nH]n2)cc1C	19825638	RKMNKNWELMQARO-FSJBWODESA-N	357.417	3.939	50	40	FHGB	
C/C(=N\NC(=O)NC[C@@H]1CCCO1)c1cc2c(ccc3ccccc32)o1	98055368	WXZYJGRWLBWCSD-NSMHLIOHSA-N	351.406	3.788	50	40	FHGB	
Cc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1	2730548	YPRIMQWZLDBZBT-XNTDXEJSSA-N	350.378	3.515	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)c2cccs2)o1	4682193	IYZZCVLOFSSJCP-VCHYOVAHSA-N	371.374	3.689	50	40	FHGB	
O=C(CCn1c2ccccc2c2ccccc21)N/N=C/c1ccc(O)cc1O	4719077	ZVMZEBJIZFLTQE-OEAKJJBVSA-N	373.412	3.746	50	40	FHGB	
COc1ccccc1OCC(=O)N/N=C/c1ccc(Cl)c(Cl)c1	6182638	IVAQGECKLISKHL-DJKKODMXSA-N	353.205	3.531	50	40	FHGB	
Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3ccc(Cl)cc3)c2)n1	6189257	SZICEQGQSJDMDD-WSDLNYQXSA-N	366.852	3.966	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1OCC	59401641	ZJHPZGILVUJQLH-FYJGNVAPSA-N	372.490	3.868	50	40	FHGB	
O=C(CNc1ccc(Br)cc1)N/N=C/c1cccc(Cl)c1	59514217	MWVUNKBDAQYXPI-DJKKODMXSA-N	366.646	3.665	50	40	FHGB	
O=C(N[C@@H](CSc1ccccc1)[C@@H](O)CCl)OCc1ccccc1	86860384	YMCLVAZUQJPLTE-IRXDYDNUSA-N	365.882	3.673	50	40	FHGB	in-vitro
COc1cc(Cl)cc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)c1	408869447	RVVWZDVEKVBRRG-LFYBBSHMSA-N	357.753	3.802	50	40	FHGB	
N#C/C(=C/c1ccc(Sc2ccc(Cl)cc2)o1)C(=O)N1CCOCC1	409093414	ZYBHPMYEGFRHOU-QBFSEMIESA-N	374.849	3.850	50	40	FHGB	
N#C/C(=C\c1ccccc1OCc1ccccc1F)C(=O)N1CCCC1	409367714	JBFHAZDHBFSZOX-QGOAFFKASA-N	350.393	3.934	50	40	FHGB	
Cc1ccc(-c2ccc(/C=C(\C#N)C(=O)N3CCCC3)o2)c([N+](=O)[O-])c1	409372145	PEDVSXWWYAVYTH-SDNWHVSQSA-N	351.362	3.693	50	40	FHGB	
O=C=Nc1cc(S(=O)(=O)c2ccc(Cl)c(N=C=O)c2)ccc1Cl	1672258	XADGVNLZVITQBQ-UHFFFAOYSA-N	369.185	3.761	50	40	FHGB	
Cc1ccc(Oc2nc3c(C)cccn3c(=O)c2C=C(C#N)C#N)c(C)c1	5552260	IUTHJYJOZVVXOS-UHFFFAOYSA-N	356.385	3.843	50	40	FHGB	
C/C(=N\NC(=O)CSc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1	7993691	BUVRIGHHWNDHTC-WOJGMQOQSA-N	363.826	3.881	50	40	FHGB	
CCOc1ccccc1[C@@H]1C(C#N)=C(N)Nc2oc(-c3ccccc3)nc21	12412468	YYOLERIXFUQUHP-QGZVFWFLSA-N	358.401	3.992	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)[C@H](C)Oc2cc(C)cc(C)c2)cc1OC	31776141	RBMSJJQFZBQKRO-GLFIFPSUSA-N	370.449	3.628	50	40	FHGB	
CC1=C(C#N)C(=O)N(C)C(=O)/C1=C/c1ccc(-c2ccc(Cl)cc2)o1	100798062	LQCLEUALZRLOMV-OQLLNIDSSA-N	352.777	3.822	50	40	FHGB	
O=C(CCCl)N1N=C(c2ccccc2)C[C@H]1c1ccccc1[N+](=O)[O-]	256027868	HFROCFXDPXFAFB-KRWDZBQOSA-N	357.797	3.901	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C\c2ccc(OCC)cc2OCC)cc1	408711665	DNXGNHXNVBVLCS-JCMHNJIXSA-N	370.449	3.576	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nc2ccccc2C(C)=O)ccc1OC	408763113	HNJMGBZYJDNFMG-WJDWOHSUSA-N	364.401	3.842	50	40	FHGB	
Cc1ccc(C(O)(C(=O)NNc2ccccc2C)c2ccc(C)cc2)cc1	778177	QHTUZNACQWZCDI-UHFFFAOYSA-N	360.457	3.991	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)cc1)c1cc(Cl)ccc1O	5944527	LSMMRPWIJFURMU-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
CCOc1c(Cl)cc(/C=N/NC(=O)c2ccc(F)cc2)cc1OC	7894215	RWGONXDGMBZXRQ-KEBDBYFISA-N	350.777	3.650	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc(Cl)c1O	408794885	TZJARLSFOWIJNK-KPKJPENVSA-N	358.781	3.696	50	40	FHGB	
O=C(Nc1ccc(Br)cc1Br)C(Cl)Cl	1085607	FETCUQLAQZOSHI-UHFFFAOYSA-N	361.848	3.954	50	40	FHGB	
CCN(CC)c1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1	704417	BIQFYCQVMDCQNU-IBGZPJMESA-N	365.477	3.984	50	40	FHGB	
C/C(CC(=O)NC12CC3CC(CC(C3)C1)C2)=N\NC(=O)c1ccccc1C	4713764	KVBLQWMDVPZRBW-BUVRLJJBSA-N	367.493	3.576	50	40	FHGB	
N#Cc1ccc(C(=O)N/N=C/c2ccccc2OCc2ccccc2)cc1	57787124	DIJDBPCJEYMJOW-BUVRLJJBSA-N	355.397	3.901	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(OC)cc2OC)cc1	103169406	QNOAQYOEKQZSOW-PTNGSMBKSA-N	352.390	3.648	50	40	FHGB	
N#CC1=C2SCN(Cc3ccco3)CN2C(=O)C[C@H]1c1cccs1	20347969	WKCARMWWWUBUOD-CYBMUJFWSA-N	357.460	3.556	50	40	FHGB	
O=C(N/N=C/c1ccc[nH]1)c1ccc(COc2cccc3cccnc23)cc1	3526014	UIPIRPSFXHQIOT-AFUMVMLFSA-N	370.412	3.906	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)c(Cl)c1	4815531	TZISYZWHDQVBLC-QGMBQPNBSA-N	352.177	3.974	50	40	FHGB	
COC(=O)Cn1cc(/C=C(\C#N)C(=O)Nc2cccc(C)c2)c2ccccc21	4811534	MPMSHSOKAKDOTN-LFIBNONCSA-N	373.412	3.668	50	40	FHGB	
COc1cccc(CC(=O)N/N=C\c2ccc(-c3ccc(C#N)cc3)o2)c1	409022059	DFLIHHUOGOLYNV-UCQKPKSFSA-N	359.385	3.520	50	40	FHGB	
N#CCOc1ccccc1/C=N/NC(=O)C(c1ccccc1)c1ccccc1	408817507	WBFKQNPAFHQQLD-KOEQRZSOSA-N	369.424	3.871	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2OC)cc1OC	13575296	VUNOJNFMLGWPAX-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
Cc1cc2c(cc1/C=N/NC(=O)c1ccncc1)[C@@H](C)CC(C)(C)N2C	208214691	HYFHZCRJKSBQSL-LUILSVGHSA-N	350.466	3.876	50	40	FHGB	
O=C(N/N=C/c1ccc(N2CCCC2)cc1)c1ccccc1-n1cccc1	1102249	WOEOGPJOVKJBTP-HAVVHWLPSA-N	358.445	3.841	50	40	FHGB	
CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)CCl	1465621	DQCCEHYOCXXDMM-UHFFFAOYSA-N	353.827	3.778	50	40	FHGB	
COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)Nc2ccccc2)o1	4511023	HEYQRNBSKAYEED-FYJGNVAPSA-N	363.373	3.889	50	40	FHGB	
CCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)cc1	5719402	OBLGIWUTLLRGDG-HYARGMPZSA-N	351.450	3.635	50	40	FHGB	
O=C(N/N=C/c1c(Cl)cccc1Cl)C(=O)Nc1cccc(Cl)c1	7782421	ADZHIXMZDFSGFU-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)c2cccs2)o1	59197663	WGKMWTXORROWCR-VCHYOVAHSA-N	371.374	3.689	50	40	FHGB	
CC(C)(OO)C1=C[C@@]23CC[C@H]4[C@](C)(C(=O)O)CCC[C@@]4(C)[C@H]2C[C@@H]1OO3	85666093	HAPYGVXWHYQMIJ-HZTOIDEUSA-N	366.454	3.961	50	40	FHGB	
COc1cc(Cl)c(/C=C(\C#N)C(=O)NCCc2ccccc2)cc1OC	408804430	FXJHJOQFNRNIDK-MHWRWJLKSA-N	370.836	3.623	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)OC)c(Cl)c2)o1	408995976	CGZOXFJUPMNBRM-XYOKQWHBSA-N	359.765	3.857	50	40	FHGB	
Cc1nocc1[C@@H]1C(C#N)=C(N)N(c2ccccc2)C2=C1C(=O)CC(C)(C)C2	1073701	BGOCFPZHMGUIKZ-IBGZPJMESA-N	374.444	3.924	50	40	FHGB	
CCCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2C)[C@@H](C#N)C(O)=N1	2310117	YONWMCQRGAWENO-RHSMWYFYSA-N	369.446	3.610	50	40	FHGB	
N#C/C(=C/c1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1Br	3254428	VRARRDGAOXFZFT-XFXZXTDPSA-N	372.178	3.903	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1C	8088176	DSNLOOCEEXEGID-UHFFFAOYSA-N	364.401	3.550	50	40	FHGB	
C=C(C)[C@@H]1CC=C(C)/C(=N/NC(=O)COc2ccc(C(=O)OCC)cc2)C1	12137591	NMGDDAGGWJRPFF-QGSQVHNNSA-N	370.449	3.647	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccncc1	36137558	GQKQZGARZFFSIG-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
Cc1occc1C(=O)NNC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1	58292860	LNQFUGOCSCCKLG-INIZCTEOSA-N	373.409	3.522	50	40	FHGB	
O=C(N/N=C\c1ccc(-c2cccc(Cl)c2Cl)o1)c1cnccn1	67194087	FTDDYQPMYQJCLZ-WNFQYIGGSA-N	361.188	3.807	50	40	FHGB	
O=C(/C=C/c1ccco1)Oc1cccc(/C=N/NC(=O)c2cccs2)c1	67197078	NBXTZQIMPKQDRG-QEXYRNNXSA-N	366.398	3.724	50	40	FHGB	
CCN1C(=O)/C(=C2/Sc3ccccc3N2CC)S/C1=N/CCCl	100505612	GWSMBCNILMPTRX-QCOSOPDLSA-N	367.927	3.978	50	40	FHGB	
O=C(CNc1cccc2ccccc12)N/N=C/C=C/c1cccc([N+](=O)[O-])c1	3034481	ANBIACVFJNJEGN-BELFRPKZSA-N	374.400	3.975	50	40	FHGB	
C[C@@]12CO[C@]3(P(c4ccccc4)c4ccccc4)C(=O)[C@]1(C)CC[C@H]23	100746570	VVUKNXGGDLPMKO-RYFAJOAYSA-N	350.398	3.851	50	40	FHGB	
CCCCCOc1ccc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1	59447334	GCZVEXUSPCYGNM-RCCKNPSSSA-N	369.421	3.857	50	40	FHGB	
N#C/C(=C\c1ccccc1C(=O)O)C(=O)Nc1ccc(Br)cc1	408925944	VDXGVTDSXPHDSI-FMIVXFBMSA-N	371.190	3.693	50	40	FHGB	
N#Cc1ccccc1COc1ccc(/C=N/NC(=O)c2ccc(O)cc2)cc1	408742035	OXAVQZUINPYLKK-ZVHZXABRSA-N	371.396	3.607	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2cc(Cl)cc(OC)c2O)cc1	408746309	YIAHRPVYDJUACW-JYRVWZFOSA-N	372.808	3.999	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2c(C)n(C)c3ccccc23)cc1	96840698	SDTKTYCVSLGKJW-ATVHPVEESA-N	359.429	3.719	50	40	FHGB	
CC(C)(C)c1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	17157763	JMYMTKDYKQXVJJ-UHFFFAOYSA-N	354.494	3.962	50	40	FHGB	
COc1cc(/C=N\NC(=O)C2c3ccccc3Oc3ccccc32)ccc1O	32705914	MVISFCQPDCVRRF-QRVIBDJDSA-N	374.396	3.789	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C(/CC(=O)c1ccsc1)C(F)(F)F	4100562	SLMSNOZRTVENJP-ZHZULCJRSA-N	354.353	3.598	50	40	FHGB	
Cc1cccc(C)c1OCC(=O)N/N=C/c1c(Cl)[nH]c2ccccc12	5100407	SGORCRJNUUOMEU-UFFVCSGVSA-N	355.825	3.967	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)c(C)n1C[C@H]1CCCO1	7638595	LTDNJQJJRIPWRD-FVECTHPASA-N	367.424	3.969	50	40	FHGB	
O=C(CBr)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1	35605221	PBJRRWYKYUKTKM-UHFFFAOYSA-N	373.678	3.736	50	40	FHGB	
COc1cc2ccccc2cc1C(=O)N/N=C/c1ccc(O)c(Cl)c1	106564779	QPSICKLRAIGHPZ-SRZZPIQSSA-N	354.793	3.971	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2cccc3ccccc23)c([N+](=O)[O-])c1	1054236	XNKHJDULZZFIJK-CIAFOILYSA-N	363.373	3.586	50	40	FHGB	
O=C(N/N=C/c1c(O)ccc2ccccc12)c1cccc(Cn2cccn2)c1	1081730	LNOIXWYGXTWFRZ-OEAKJJBVSA-N	370.412	3.554	50	40	FHGB	
O=C(CCC(=O)NC1CCCCC1)N/N=C/c1ccc(Cl)cc1Cl	3663499	PEOXBGAXFHLGEF-RGVLZGJSSA-N	370.280	3.673	50	40	FHGB	
O=C(CSc1cccc2ccccc12)N/N=C/c1ccc2c(c1)OCO2	4545139	UJMPIQLQNWPNDN-SRZZPIQSSA-N	364.426	3.811	50	40	FHGB	
CC(C)(Oc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1	8988340	RYQOWTBHLOAVPN-YBFXNURJSA-N	361.785	3.556	50	40	FHGB	
COc1ccccc1CC(=O)N/N=C(\C)c1ccccc1C(F)(F)F	98055310	OJBAVXUAZKDCSP-WSDLNYQXSA-N	350.340	3.797	50	40	FHGB	
N#C/C(C(=O)CSc1ccccc1C(=O)O)=C1\Nc2ccccc2S1	103430778	BRIDBIGFFBNLJO-ATVHPVEESA-N	368.439	3.999	50	40	FHGB	
CCO[C@](C)(C(=O)Nc1ccc(OCCBr)cc1)C1CC1	225723021	DLGXWSRTFRMJBP-INIZCTEOSA-N	356.260	3.604	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2cc3cccc(OC)c3o2)cc1OC	408548882	MSQPWHMFAXDURD-SRZZPIQSSA-N	368.389	3.531	50	40	FHGB	
C[C@]12CCCC[C@H]1[C@@H]2C(=O)N/N=C\c1ccc(-c2cccc(C(=O)O)c2)o1	408718722	BUZLFKLDRLRPRL-JYRGILPZSA-N	366.417	3.921	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1	409359347	IVSHWTKQKBSSGM-LPYMAVHISA-N	362.385	3.646	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)Cc2cc(C)ccc2C)cc1OCC	409360839	FZODTDYUZQREEW-HMAPJEAMSA-N	354.450	3.794	50	40	FHGB	
COc1ccc2cc(/C=N/NC(=O)c3ccccc3C)c(Cl)nc2c1	3304753	GACZXSCBLKMJPY-SRZZPIQSSA-N	353.809	3.969	50	40	FHGB	
CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccccc2)sc2c1CCC2	4860613	ZUIMQMMBCHEZFH-KAMYIIQDSA-N	366.442	3.959	50	40	FHGB	
N#C/C(=C/c1ccc(Sc2ncccn2)c([N+](=O)[O-])c1)c1ccccn1	35045108	NFHSGHZDENSKKQ-UVTDQMKNSA-N	361.386	3.995	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N/NC(=O)c3ccccc3N)o2)c([N+](=O)[O-])c1	38534778	JPXKHINZXIOVMW-SRZZPIQSSA-N	364.361	3.509	50	40	FHGB	
CCn1ccnc1S[C@H](C)C(=O)/C(C#N)=C1/Nc2ccccc2S1	103076709	LKSSPDHTXAXSNH-VSORXJBLSA-N	356.476	3.906	50	40	FHGB	
C[C@@H]1[C@@H](c2ccccc2)O[P@@](=O)(N(CCCl)CCCl)N1C	301054501	WSTLBKXVNMSQSJ-BRZCCTTDSA-N	351.214	3.966	50	40	FHGB	
Cc1cc(C)c2c(c1)/C(=N\NC(=O)c1cc3c(s1)CCCC3)C(O)=N2	103390764	GXZREEBDJHKALK-UHFFFAOYSA-N	353.447	3.979	50	40	FHGB	
CC[C@]1(C)Cc2c(sc(NC(=O)[C@@H](C)Br)c2C#N)CO1	1239268	TXVLOHFDOKENJV-XLKFXECMSA-N	357.273	3.583	50	40	FHGB	
CCCC[C@@H](Br)C(=O)Nc1c(C(=O)OC)[nH]c2ccccc12	5093472	KJXIZLNHSMXDKN-LLVKDONJSA-N	367.243	3.847	50	40	FHGB	
CCC/C(CCCCCCCC/C(CCC)=N/NC(N)=O)=N/NC(N)=O	13801482	KIECDWLOPKKAHU-KBNZVFGVSA-N	368.526	3.756	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)c2cc(Cl)cc(Cl)c2O)cc1	4705050	PARVTLSYRRUERE-DJKKODMXSA-N	352.221	3.529	50	40	FHGB	
COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cc2Cl)[nH]1	96035438	RLMAIRODFPMJAB-RMKNXTFCSA-N	364.188	3.654	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1Cc1ccccc1F	408875811	LCORBSQXHFDDLU-VGOFMYFVSA-N	358.800	3.861	50	40	FHGB	
CCCn1nc(C)c(Cl)c1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	253401039	MIPRCIREECCKPR-CQSZACIVSA-N	374.872	3.706	50	40	FHGB	
Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3cccc(Cl)c3)cc2)n1	6189214	MQJNDZQMFZWXDN-WSDLNYQXSA-N	366.852	3.966	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccnc1Cl	5713808	NILUJXWBAFVNBF-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
Cc1n[nH]c2c1[C@@H](c1ccc(-c3cccc(Cl)c3)o1)C(C#N)=C(N)O2	818761	RWTIUDVCBQDVDM-MRXNPFEDSA-N	352.781	3.850	50	40	FHGB	
CCCCOc1ccc(/C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	34765753	YPUDKMITKIESQL-MOSHPQCFSA-N	371.393	3.546	50	40	FHGB	
I[C@H]1c2ccccc2[C@@H]1I	100112396	NDFPAKDLGIXZHH-YUMQZZPRSA-N	355.944	3.652	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccccc1OCc1cccc([N+](=O)[O-])c1	408777989	NPVJRWJWEFVTCQ-BOPFTXTBSA-N	365.389	3.605	50	40	FHGB	
COCCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2c(C)cccc2C)c1C	408805422	AYJDZHLERAYHSF-DEDYPNTBSA-N	365.477	3.771	50	40	FHGB	
CC(=O)Nc1ccc(-n2c(C)cc(/C=N\NC(=O)c3ccccc3)c2C)cc1	408994938	IDBARCXGNCDMGN-UCQKPKSFSA-N	374.444	3.816	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@H]1c1ccccc1F	705920	BQGKWIVFWMSVIV-QGZVFWFLSA-N	364.376	3.608	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1O	59145583	YASUXVKONKETPI-RIYZIHGNSA-N	367.361	3.553	50	40	FHGB	
C=CCSC1=C(C#N)[C@H](c2ccc(Cl)cc2)[C@H](C(=O)OC)C(O)=N1	9089199	QZNHHLLQAANDLC-KBPBESRZSA-N	362.838	3.837	50	40	FHGB	
CCOc1ccccc1OCC(=O)N/N=C/c1cccc(Cl)c1Cl	5467365	FHJUAJMFZKJTPV-KEBDBYFISA-N	367.232	3.921	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(Cl)cc2)c(OC)c1	409194613	QEMHBAUDMBWIDS-FYJGNVAPSA-N	359.857	3.959	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C/c2cccc(OC(C)=O)c2)c1	408764208	QPONCVWLNFRMMQ-MHWRWJLKSA-N	350.374	3.556	50	40	FHGB	
Cc1ccc(C)c(NC(=O)CCC(=O)N/N=C/c2c[nH]c3ccccc23)c1	2132341	HGSLIFFVXWAFMH-YDZHTSKRSA-N	362.433	3.654	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2c(Cl)cccc2Cl)cc1[N+](=O)[O-]	5618267	FCDDZZYTWQJZJN-QGMBQPNBSA-N	352.177	3.974	50	40	FHGB	
O=[N+]([O-])c1ccc([C@H](O)P(=O)(c2ccccc2)c2ccccc2)s1	3170014	UBYKCMFAADNPNM-QGZVFWFLSA-N	359.343	3.661	50	40	FHGB	
O=C(N/N=C/c1cccc(Cl)c1Cl)C(=O)Nc1cccc(Cl)c1	59386459	DMBPASPUERJPPT-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(Br)o1	408999711	SDWBVJJBYWRGFZ-DTQASYIRSA-N	367.268	3.814	50	40	FHGB	
COc1ccc([C@H]2C3=C(CCCCC3)C(C#N)=C(N)C2(C#N)C#N)cc1OC	36611881	LXHZTPSOWXXKIG-FQEVSTJZSA-N	374.444	3.832	50	40	FHGB	
CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(CCCCC2)[C@H]1c1ccccc1	19594805	VEVBBFJWPSYTNH-DENIHFKCSA-N	361.445	3.854	50	40	FHGB	
Cc1cccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccc(O)cc3)cc2)c1	5176098	RBHOFQLFVAZIFR-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
COc1cc(/C=C(/C#N)c2nc3ccc(C)cc3[nH]2)c([N+](=O)[O-])cc1O	51093193	XZWRKEXPJPRHML-SDQBBNPISA-N	350.334	3.558	50	40	FHGB	
CC1CCN(c2ccc(N3C[C@H](C(=O)Cl)CC3=O)cc2Cl)CC1	57332367	IVTDSMRCGMXCHP-GFCCVEGCSA-N	355.265	3.695	50	40	FHGB	
COc1ccc(O)c(/C=C(\C#N)C(=O)Nc2ccc(Br)cc2)c1	1453973	OAOCKUKIWJIJFE-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
O=C(NN(Cc1ccccc1)Cc1ccccc1)c1cccc([N+](=O)[O-])c1	4592061	CUYVJBHZBZAZHX-UHFFFAOYSA-N	361.401	3.942	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NC2CCCC2)cc1Cl	409190872	ACOBSALONKBSFX-JYRVWZFOSA-N	363.244	3.971	50	40	FHGB	
COc1cc(OC)cc(C(=O)NNc2nc3cc(C)cc(C)c3s2)c1	4121459	VYJRYYHHBUFGGP-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
C[C@H]1CN(c2ccc(/C=C(\C#N)c3nc4ccccc4n3C)o2)C[C@H](C)O1	4134669	QPLPZBAEMBDUPW-SEYCNFAISA-N	362.433	3.844	50	40	FHGB	
O=C(N/N=C/c1ccccn1)c1cc(-c2ccc(Cl)c(Cl)c2)[nH]n1	9089128	GAZXWNJKRDJDBJ-AWQFTUOYSA-N	360.204	3.542	50	40	FHGB	
COC(=O)c1ccc(NC(=O)/C(C#N)=C\c2c(F)cccc2Cl)cc1	223174319	FYZHKEVQIFDQJC-XFXZXTDPSA-N	358.756	3.811	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)cc1OC	1501480	RHULAHFIJYZNJU-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
Cc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2)cc1	5746589	LYKZTQKZJNMYOZ-FQEVSTJZSA-N	356.429	3.766	50	40	FHGB	
Cc1ccc2sc(NNC(=O)c3cc4ccccc4oc3=O)nc2c1C	4121432	CRBOIGXVNJWYMC-UHFFFAOYSA-N	365.414	3.776	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc(Cl)cc1	16678651	NKQBBZALAVFDTN-UDWIEESQSA-N	374.828	3.858	50	40	FHGB	
C[C@]12CC[C@H]3[C@@H](CC[C@H]4CCCC[C@]34C)[C@@H]1CC/C2=N\NC(=O)C(=O)O	118916281	CTISYMLRZAHCNS-ZYRTZVQVSA-N	360.498	3.976	50	40	FHGB	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@](C)(C#N)CCOC(C)C)c1C	98059558	TVAIAKWSJYLSEH-PRWBYUBPSA-N	370.497	3.636	50	40	FHGB	
CCCCCCCN1C(=O)/C(=N\NC(=O)c2ccncc2)c2ccccc21	3222759	CLNNUNUKRSGHNP-NMWGTECJSA-N	364.449	3.533	50	40	FHGB	
COc1ccc(OC)c(C(=O)c2oc3ccccc3c2NC(=O)CCl)c1	862766	DPRWITYSBCQKFQ-UHFFFAOYSA-N	373.792	3.858	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc(OC(F)F)cc1	2700161	IMYWEALSTHDPMS-HNNXBMFYSA-N	360.360	3.739	50	40	FHGB	
C/C(=N/NC(=O)c1ccccn1)c1ccc(NC(=O)C2CCCCC2)cc1	5888637	WOUPCCRKTXOIQX-IWIPYMOSSA-N	364.449	3.754	50	40	FHGB	
CCCOc1c(Br)cc(/C=C(\C#N)C(=O)OCC)cc1OC	13147877	SUYIFAMYZARWNA-KPKJPENVSA-N	368.227	3.717	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)c(OC(F)F)c2)c1	16409968	IYEVKCGNENJGOW-MDWZMJQESA-N	374.343	3.851	50	40	FHGB	
O=P(c1ccccc1)(c1ccccc1)[C@H](c1ccco1)N1CCOCC1	33354971	GRTJLNVTZHJJFL-OAQYLSRUSA-N	367.385	3.625	50	40	FHGB	
N#C/C(C(=O)Nc1ccc(Cl)cc1)=C1/C(=O)Nc2ccc(Cl)cc21	39555993	WFDZHHWFBOKPCX-SQFISAMPSA-N	358.184	3.861	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cc2)cc1C(=O)O	409157638	VZRZHUOKRSAGFU-UKTHLTGXSA-N	370.792	3.983	50	40	FHGB	
O=C(CBr)c1scc(Br)c1Br	2511029	BJDAJEITGHVUFQ-UHFFFAOYSA-N	362.868	3.851	50	40	FHGB	
COc1ccccc1/C=C/C=N/NC(=O)CSc1nc2ccccc2o1	2706295	LAOAEDSPNNHFBB-HOGMWEGNSA-N	367.430	3.744	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CC#N)ccc1OCc1ccccc1Cl	4513428	PQRSCFJTWVORIU-WSDLNYQXSA-N	371.824	3.681	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)cc1	6880842	FOUYQOGVMVEONF-FYJGNVAPSA-N	352.390	3.994	50	40	FHGB	
Cc1ccccc1-n1c(C)c(Br)c(/C=N/NC(=O)CC#N)c1C	20243771	BOETXSRUTOJZGR-KEBDBYFISA-N	373.254	3.529	50	40	FHGB	
C/C(CC(=O)Nc1ccccn1)=N\NC(=O)c1ccc(Cl)cc1Cl	100510121	NHAUSVMHMVQIJM-UFFVCSGVSA-N	365.220	3.523	50	40	FHGB	
CCCCCCC/C(=N/NC(N)=O)c1c(C)nn(-c2ccccc2)c1O	100933949	KMBQXWHPYAEKSN-PGMHBOJBSA-N	357.458	3.619	50	40	FHGB	
COc1ccc(Cl)cc1/C=N/NC(=O)c1cc2cccc(OC)c2o1	408971671	LHGFCHMLWQEWOP-KEBDBYFISA-N	358.781	3.867	50	40	FHGB	
COc1cccc2cc(C(=O)N/N=C/c3cn(CC#N)c4ccccc34)oc12	409375774	PBTUVMGUJJSTCO-FSJBWODESA-N	372.384	3.684	50	40	FHGB	
Cc1cc(C)c2c3c(c(=O)oc2c1C)[C@@H](c1ccccc1)C(C#N)=C(N)O3	585181958	LEQIZQPHBMXVDN-KRWDZBQOSA-N	358.397	3.936	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2ccc(C(=O)O)cc2)cc1Cl	48324290	OPFDASZBBGBWSQ-JYRVWZFOSA-N	356.765	3.592	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)CCCC(=O)N/N=C/c1cccs1	4599077	UBPCQLXETJKONK-YBFXNURJSA-N	363.870	3.969	50	40	FHGB	
CCOC(=O)/C(C#N)=C1/C(=O)N(Cc2ccccc2Cl)c2ccccc21	409388137	KLEBWQCRKSEJBY-OBGWFSINSA-N	366.804	3.727	50	40	FHGB	
CCCCOc1ccc2ccccc2c1/C=C(/C#N)C(=O)N1CCOCC1	409008317	VSSFKXMKEGQLSW-SDXDJHTJSA-N	364.445	3.784	50	40	FHGB	
COc1cc(/C=N/NC(N)=O)cc(Cl)c1OCc1ccccc1Cl	13747290	CGRIJNIQAWOVGI-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
CCOC(=O)/C(C#N)=C1/Nc2ccc(Cl)cc2[C@@H](c2ccccc2)N1	6463275	BERXTRQWLVGNPF-KCGBVJQISA-N	353.809	3.743	50	40	FHGB	
O=C(N/N=C/c1ccccc1OC(F)F)c1ccc(Br)cc1	1462609	JOWJGNJJBBOZAE-DJKKODMXSA-N	369.165	3.814	50	40	FHGB	
O=C(OC[C@H](Br)CBr)c1ccccc1Cl	2045580	LLYXWJQLCPTCNB-SSDOTTSWSA-N	356.441	3.655	50	40	FHGB	
N#CC1=C(SCc2ccccc2)NC(=O)C[C@@H]1c1cccc([N+](=O)[O-])c1	6448671	RHHUMTVSXDOENJ-MRXNPFEDSA-N	365.414	3.867	50	40	FHGB	
COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)c2ccc(F)cc2)o1	8812150	DPNPZDRZPQHZKG-WSDLNYQXSA-N	366.348	3.636	50	40	FHGB	
O=C(NNc1ccc2ccccc2n1)C(O)(c1ccccc1)c1ccccc1	12570151	FSSVAUBTKJMARN-UHFFFAOYSA-N	369.424	3.614	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2ccco2)c(C)n1-c1ccc2ncccc2c1	17167497	AAXBTLVDJMULGS-QRVIBDJDSA-N	358.401	3.999	50	40	FHGB	
N#CC1=C2SCN(Cc3ccco3)CN2C(=O)C[C@H]1c1ccc(F)cc1	20348023	VMYIJAMNCHZUQT-INIZCTEOSA-N	369.421	3.634	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)ccc1OC	28495803	PGIJADQEWFZUJX-GYZOOYGHSA-N	350.418	3.878	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1cccs1)c1ccccc1F	58871338	MHUNWAMRIXSKAO-CIAFOILYSA-N	367.405	3.903	50	40	FHGB	
C[C@](CCl)(CC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21	72481816	IOAUVNOTPSLZIT-HXUWFJFHSA-N	373.836	3.997	50	40	FHGB	
Cn1cc(/C=C(\C#N)C(=O)NC2CCCC2)c(-c2cc3ccccc3o2)n1	98055257	SCAGSBLFQNPAJY-XNTDXEJSSA-N	360.417	3.799	50	40	FHGB	
CN(C)c1ccc(/C=C/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1	408544904	YMMDKFJVRDAUJO-CZMAMTTRSA-N	361.401	3.553	50	40	FHGB	
O=C(NNc1ccccc1Cl)C(O)(c1ccccc1)c1ccccc1	799123	QWFXZZXMNCKBLN-UHFFFAOYSA-N	352.821	3.719	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2cc(C)ccc2C(C)C)c(OC)c1	711519	XSSGHEURLRYIGB-WSDLNYQXSA-N	370.449	3.665	50	40	FHGB	
Cc1ccc(C)c(OCCn2cc(/C=C(\C#N)C(N)=O)c3ccccc32)c1	1243989	ZEYUVNHOSYFVPR-SFQUDFHCSA-N	359.429	3.729	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)N(C)C)c(C)n1-c1ccc(Br)cc1	4705365	OZHVHWRKFNRYBA-XNTDXEJSSA-N	372.266	3.852	50	40	FHGB	
CC(=O)Nc1ccc2nc(NC(=O)[C@@H](Br)C(C)C)sc2c1	20133525	HFVGEJFVOQCLFW-LBPRGKRZSA-N	370.272	3.613	50	40	FHGB	
Cn1cc(/C=N/NC(=O)c2ccc(Br)cc2)c2ccccc21	1106562	CYVSVWKTXRSHCJ-VXLYETTFSA-N	356.223	3.705	50	40	FHGB	
Cc1cccc(NC(=O)CCC(=O)N/N=C/c2cccc(Cl)c2)c1C	3101401	UOEOTUZDHYPVLE-CIAFOILYSA-N	357.841	3.826	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)[C@H](C)Oc2ccc(C)cc2)cc1	943283	SEVMINYPAMYNSN-HINJULBWSA-N	353.466	3.759	50	40	FHGB	
Cc1c(C(=O)N/N=C\c2ccc(Cl)cc2Cl)sc(N)c1C#N	15225495	IDMVZRAIIAIXCU-SWNXQHNESA-N	353.234	3.581	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(F)cc1	5579765	BUYQHHUBDJNBBI-RGVLZGJSSA-N	353.309	3.758	50	40	FHGB	
CCOc1cc(/C=C(\C#N)c2ccc(OC)cc2)ccc1OCC(=O)O	408580104	AFMIJXUNCHWRHB-MHWRWJLKSA-N	353.374	3.621	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2cccc(OC(C)C)c2)ccc1O	408784271	PZDYNHAYWPPHJR-DHDCSXOGSA-N	352.390	3.734	50	40	FHGB	
CCCCc1ccc(NC(=O)CCNC(=O)[C@H](Br)CC)cc1	8733010	RJSMETWZPNXHFL-OAHLLOKOSA-N	369.303	3.648	50	40	FHGB	
COC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2cccc(OC(C)C)c2)cc1	408779783	KIJIWFXPOFMVBW-BOPFTXTBSA-N	364.401	3.806	50	40	FHGB	
COc1cccc(/C=N/NC(=O)CCSc2ccc(C)cc2)c1OC	409126899	BVIWZZKMAKCYJE-DEDYPNTBSA-N	358.463	3.645	50	40	FHGB	
C#CCn1c(C)c(/C=N/NC(=O)Cc2ccc(Cl)cc2)c2ccccc21	409373813	ZEHACTCZBSJADU-OEAKJJBVSA-N	363.848	3.929	50	40	FHGB	
O=C(N/N=C\c1cc(Br)ccc1O)c1cc2ccccc2o1	83329043	ROGBATNLCBWRCE-NVMNQCDNSA-N	359.179	3.665	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)C23CC4CC(CC(C4)C2)C3)cc1OC	5480048	FOMOUVXQELIVMV-LPYMAVHISA-N	356.466	3.760	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CC#N)ccc1OCc1ccc(Cl)cc1	3088407	FAOQEYWPCFQZGL-WSDLNYQXSA-N	371.824	3.681	50	40	FHGB	
Cc1cc(NC(=O)N/N=C/c2cc(C)n(C)c2C)ccc1Br	4681213	TVYLLCYGVZUJCK-GIJQJNRQSA-N	363.259	3.868	50	40	FHGB	
Cc1cc(Cl)ccc1NC(=O)/C(C#N)=C/c1ccc(N2CCOCC2)o1	5006524	VUZLJDBXWUHOBR-SDNWHVSQSA-N	371.824	3.624	50	40	FHGB	
Cc1[nH]c2ccccc2c1/C=C(\C#N)C(=O)N1CCN(c2ccccc2)CC1	5881628	STXNNXKRRPBCDV-OBGWFSINSA-N	370.456	3.732	50	40	FHGB	
O=C(NNC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1ccco1	12998306	LMYSVSVFWSUHJC-KRWDZBQOSA-N	352.415	3.574	50	40	FHGB	
N#C/C(=C\c1ccc(OCc2ccccc2F)cc1)C(=O)N1CCCC1	36761489	SLGZJHGVMYYOLH-QGOAFFKASA-N	350.393	3.934	50	40	FHGB	
C=CCOC(=O)C1=C(C)NC(SC)=C(C#N)[C@@H]1c1ccc(OCC)cc1	100872289	MVXCHTFHIZMSFQ-SFHVURJKSA-N	370.474	3.873	50	40	FHGB	
C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1cccc(OC2CSC2)c1	408869968	UOEFYBZDCQBYFX-XLTHYULKSA-N	372.515	3.812	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)Cc2cc(C)ccc2C)c(OCC)c1	409362736	JYZURUKRZZVRFB-HMAPJEAMSA-N	354.450	3.794	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2O)cc1Br	1453937	NPNZVPLPSBRZMF-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1ccc(OC(=O)c2ccccc2)cc1	1458085	AUDDWTDQUJCOIX-JJIBRWJFSA-N	372.424	3.989	50	40	FHGB	
Nc1c(C(=O)N/N=C/c2ccccc2)sc(=S)n1-c1ccccc1	1633231	RYVNVHBCCXWZPT-YBFXNURJSA-N	354.460	3.614	50	40	FHGB	
O=C(CSc1cc(Cl)ccc1Cl)NNC(=O)c1ccc(F)cc1	2626936	NWAGWHIGVLAPNO-UHFFFAOYSA-N	373.236	3.686	50	40	FHGB	
COCCn1c(C)cc(/C=N/NC(=O)CC23CC4CC(CC(C4)C2)C3)c1C	6825537	VAJMSAKHZOYYLJ-OEAKJJBVSA-N	371.525	3.808	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OCC	7892553	KQTAFVDZWJWFOD-DEDYPNTBSA-N	371.393	3.546	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2ccc(OCCC)cc2)cc1OC	20197904	HLIZMHBXKHFOJE-PXLXIMEGSA-N	368.433	3.813	50	40	FHGB	
N#C/C(=C/c1ccccc1C(=O)O)C(=O)Nc1cccc(C(F)(F)F)c1	223169741	HTWGNLKRNCSMAY-WQLSENKSSA-N	360.291	3.949	50	40	FHGB	
COc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1OCc1cc(C)cc(C)c1	408882272	QONGCVNQRMZBNO-FRKPEAEDSA-N	370.836	3.937	50	40	FHGB	
CC1(CC(=O)N/N=C/c2ccc(-c3ccc(Cl)cc3)o2)OCCCO1	59426570	GGGCJJAMKVNFRL-UDWIEESQSA-N	362.813	3.593	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1Cl	59434371	CYROZRHFQPJRBN-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)O[C@H](c1ccc(Br)cc1)C(C#N)=C2N	5727688	JPMXUVCVQIIJKI-QGZVFWFLSA-N	373.250	3.900	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc(Cl)c1O	408798062	UCRQLOQAENMXSL-VZUCSPMQSA-N	373.752	3.508	50	40	FHGB	
C/C(=N/NC(=O)c1ccncc1)c1cccc(NC(=O)C2CCCCC2)c1	5888938	LETVKDUFEFZGRP-IWIPYMOSSA-N	364.449	3.754	50	40	FHGB	
CCC[C@@H](Br)C(=O)Nc1nc2ccc(N(C)C)cc2s1	20132786	CUPDYTPJSWEKCZ-SNVBAGLBSA-N	356.289	3.864	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2ccc(Sc3ccccn3)o2)c1	1434255	PZZOIRPCQKHZRZ-UDWIEESQSA-N	353.403	3.598	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C\c2ccccc2)cc1Br	31895848	RZGPZTYHVFSCGE-UNOMPAQXSA-N	361.239	3.541	50	40	FHGB	
N#C/C(=C/c1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Br)cc1	408745460	SMNMDLYHMSQBQW-LCYFTJDESA-N	371.190	3.693	50	40	FHGB	
O=C(Cc1csc(-c2cccc(F)c2)n1)NNc1ccccc1[N+](=O)[O-]	15631796	ZURUDUINZFOMLS-UHFFFAOYSA-N	372.381	3.543	50	40	FHGB	
COc1ccc(C[C@H](C)Oc2ccc(/C=C/C=O)cc2OC)cc1OC	49181093	PUDXYWKCEYLTMQ-NFAHFFEMSA-N	356.418	3.935	50	40	FHGB	biogenic,in-vitro
C=CCc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)cc(OC)c1O	408814799	WFQUEPYKFLVBFI-UZUMKDMXSA-N	362.429	3.914	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)CCCc1ccc(OC)cc1C	408910263	JFFRTIGSPXNMNL-PXLXIMEGSA-N	354.450	3.875	50	40	FHGB	
COc1cc(C)ccc1C(=O)N/N=C/c1cc(C)n(-c2ccccn2)c1C	409235411	PLUHQEJPDARVDX-YDZHTSKRSA-N	362.433	3.570	50	40	FHGB	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]	1054410	RHUZTHYXCVNDBQ-CNRHGSOZSA-N	363.373	3.666	50	40	FHGB	
O=C(N/N=C/c1c(Cl)cccc1Cl)c1cncc(Br)c1	3186358	DYAUDFGKIUTOIJ-CNHKJKLMSA-N	373.037	3.915	50	40	FHGB	
CCc1[nH]nc2c1[C@@H](c1ccc(OC3CCCC3)cc1)C(C#N)=C(N)O2	4631722	FDMVLNZTQIIFJS-KRWDZBQOSA-N	350.422	3.512	50	40	FHGB	
COc1cc(Cl)c(/C=N\NC(=O)c2cc3ccccc3o2)cc1OC	6421466	NYYOXQNTALWVCB-JMIUGGIZSA-N	358.781	3.867	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)cc1	9110993	DQWQXJWAIGKEOW-DEDYPNTBSA-N	352.394	3.531	50	40	FHGB	
N#Cc1ccc(C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)cc1	60809689	KWFWJRKXNCFMET-BUVRLJJBSA-N	355.397	3.901	50	40	FHGB	
Cc1cccc(Cl)c1NC(=O)/C(C#N)=C/c1cccc(OCC(=O)O)c1	408926209	WCVWSKPSRBSNHO-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
N#C/C(=C\c1cccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1O	5020870	HMZYWRHJDVUWET-XNTDXEJSSA-N	359.341	3.999	50	40	FHGB	
N#CC1=C(N)Oc2n[nH]c(-c3ccccc3)c2[C@H]1c1ccc(F)cc1F	6720050	LIMXAXJRTJBFSS-HNNXBMFYSA-N	350.328	3.573	50	40	FHGB	
C=CCOC(=O)/C(C#N)=C/c1c(C)nn(Cc2ccc(C)cc2)c1Cl	8321847	PEYWBUSIKRQEIN-MHWRWJLKSA-N	355.825	3.838	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)NC1CCCC1	14178445	NZRBQLQESIYPSL-SDNWHVSQSA-N	351.362	3.821	50	40	FHGB	
COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccc(F)c(Cl)c2)cc1	17861828	JRTYWGAPALXECG-GXDHUFHOSA-N	366.801	3.738	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2C)cc(OC)c1OC	3616307	PPLGTXLEWQZOQX-CXUHLZMHSA-N	366.417	3.875	50	40	FHGB	
C/C(=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1)C12CC3CC(CC(C3)C1)C2	4144296	NSHKPZMPTJWJGA-BKUYFWCQSA-N	355.438	3.846	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)c(Cl)c2)cc(OC)c1O	4723464	PGUREDQPODGQJF-AWNIVKPZSA-N	372.808	3.917	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OCc1ccccc1F	6827555	VIVXBOQFVZFYSK-YVLHZVERSA-N	368.408	3.845	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)Cn2c(-c3ccccc3)cc3ccccc32)n1	11274143	FRGKIOPKXQZDKM-UHFFFAOYSA-N	371.444	3.858	50	40	FHGB	
Cc1sc2nc(/C(C#N)=C\c3ccc([N+](=O)[O-])cc3)nc(O)c2c1C	57547837	UWDSZFLNBIHTGZ-GHXNOFRVSA-N	352.375	3.986	50	40	FHGB	
O=c1c2ccccc2n2c(CCl)nnc2n1-c1cccc2ccccc12	408712668	GBCATBXDZDPWKG-UHFFFAOYSA-N	360.804	3.925	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1cc(C)ccc1C	408802704	GHZNBVSPQJJPKS-LDADJPATSA-N	360.413	3.870	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N/NC(=O)Cc3ccccc3)o2)c([N+](=O)[O-])c1	409047398	MNAUHRFMKRIVAB-FYJGNVAPSA-N	363.373	3.856	50	40	FHGB	
C=CCOc1ccc(Br)c(/C=N/NC(=O)c2cccs2)c1	2773745	BSIZYEMUKFYULS-LICLKQGHSA-N	365.252	3.839	50	40	FHGB	
COc1ccc(C(=O)NNc2nc3c(C)cc(C)cc3s2)cc1OC	4121450	PJZBAWVWBAOOIX-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
Cc1ccc([C@@H]2CC(=O)N3CN(Cc4ccco4)CSC3=C2C#N)cc1	20348329	JLBLZNGEXKXTTM-KRWDZBQOSA-N	365.458	3.803	50	40	FHGB	
Cc1ccc(S(=O)(=O)[C@H](Br)CC(=O)c2ccccc2)cc1	1563781	SXPOELYKAYLQQL-INIZCTEOSA-N	367.264	3.763	50	40	FHGB	
C=CCOc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc1OC	6899389	NSNTTZOJRZGMTM-VTYXAESKSA-N	354.450	3.862	50	40	FHGB	
CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc1OCC	8846172	HJCYKYRPHWETMU-FQEVSTJZSA-N	365.433	3.674	50	40	FHGB	
CC(C)(C)C1=C(C#N)[C@@H](c2ccc(Br)cc2)NC(=S)N1	409371497	KGJNCFVMCMAVHR-GFCCVEGCSA-N	350.285	3.792	50	40	FHGB	
CCn1c(SCC(=O)N/N=C/c2ccccc2C)nc2ccccc21	4951504	QTPFCCHJIZEVDX-UDWIEESQSA-N	352.463	3.607	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)cc(Cl)c1OC	7156886	DVJGPMZQBNWVTJ-CXUHLZMHSA-N	370.836	3.971	50	40	FHGB	
CCc1ccccc1NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C	15423193	YRYGITXFXJFLGF-OAHLLOKOSA-N	369.303	3.503	50	40	FHGB	
CCO[Si](CCO[C@H](CC)O[C@H]1CCCS1)(OCC)OCC	299888445	JUOVIGBDJWCFHQ-LSDHHAIUSA-N	352.569	3.657	50	40	FHGB	
CC(=O)Oc1cccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)c1	408758675	OYFQGUFDSMRGIH-DJKKODMXSA-N	351.189	3.683	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)Cc2ccc(CC)cc2)cc1OCC	409362474	GKQULBRGBRXPNX-JCMHNJIXSA-N	354.450	3.739	50	40	FHGB	
CC(C)(C)C1=C(C#N)[C@H](c2ccc(Br)cc2)NC(=S)N1	409371503	KGJNCFVMCMAVHR-LBPRGKRZSA-N	350.285	3.792	50	40	FHGB	
O=C(N/N=C/c1cn(Cc2ccc(F)cc2)c2ccccc12)c1cccnc1	1092515	BXVNYIIFIOAWBD-DHRITJCHSA-N	372.403	3.988	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@H]1c1cccc(F)c1	2272621	YXVLNIYJPCALHM-KRWDZBQOSA-N	364.376	3.608	50	40	FHGB	
O=C(N/N=C/c1ccc(O)c(O)c1)[C@@H]1CC1(c1ccccc1)c1ccccc1	5602575	PYAJTUMHESZCMR-WWJLXRQJSA-N	372.424	3.554	50	40	FHGB	
C/C(=N/NC(=O)c1ccoc1C)c1ccc(NC(=O)C2CCCC2)cc1	13108575	PEFBCBFGFRBDCM-XKZIYDEJSA-N	353.422	3.871	50	40	FHGB	
COc1ccc(Cl)cc1/C=C(\C#N)C(=O)Nc1ccc(C(=O)O)cc1	53103257	ZGOBZVDERVUQCG-MDWZMJQESA-N	356.765	3.592	50	40	FHGB	
O=C1CC([P+](c2ccccc2)(c2ccccc2)c2ccccc2)=C(O)O1	95749422	CXYNGWAHZKOMJQ-UHFFFAOYSA-O	361.357	3.655	50	40	FHGB	
O=C1c2cc([N+](=O)[O-])ccc2-c2c(NC(=O)C(Cl)Cl)cccc21	1710705	HIPIRHHLSRPDFR-UHFFFAOYSA-N	351.145	3.548	50	40	FHGB	
C/C(=N\NC(=O)CCSc1ccc(C)cc1)c1cccc([N+](=O)[O-])c1	409122067	YQJQJBDBASNPCM-XMHGGMMESA-N	357.435	3.926	50	40	FHGB	
Cc1cccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccccc3O)cc2)c1	1434192	YSQRASYESHZAAJ-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
O=C(N/N=C/c1ccc(OC(F)F)cc1)c1ccccc1-n1cccc1	3226710	OXJPRMKCVRYKOF-LPYMAVHISA-N	355.344	3.843	50	40	FHGB	
COc1ccc(CC(=O)N/N=C\c2ccc(C(C)(C)C)cc2)cc1OC	100306693	OHUPCACKBNEUHU-HMAPJEAMSA-N	354.450	3.694	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1ccc(CC)cc1	408824986	INEFGSQYAZASOY-SFQUDFHCSA-N	364.401	3.892	50	40	FHGB	
COc1cc(/C=N/NC(=O)Cc2ccc(C)cc2C)cc(Cl)c1OC	20195138	AFZAWODHWMFXKK-SRZZPIQSSA-N	360.841	3.667	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2ccccc2)c(C)n1-c1ccc2c(c1)OCO2	408997711	SMKWGRKKJDSROY-UUYOSTAYSA-N	361.401	3.587	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N\NC(=O)c1ccc(OC)c(OC)c1	409325266	XKMDLCAPDFLIAE-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
Cc1cccc(Cl)c1NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)cc1	408885560	BZCAZZSBJBLZNR-NTEUORMPSA-N	370.792	3.658	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)c2ccc(F)cc2)c(OC)c1	3227761	QVDKGCDINMXVMT-XNTDXEJSSA-N	369.348	3.524	50	40	FHGB	
N#CC1=C(N)Oc2oc3ccccc3c(=O)c2[C@@H]1c1cccc(Cl)c1	1073563	BWULDWUFYWIJML-OAHLLOKOSA-N	350.761	3.665	50	40	FHGB	
O=C(O)c1ccc(COc2ccccc2/C=N/NC(=O)c2ccccc2)cc1	977324	QLTYVDSXFHSRIA-OEAKJJBVSA-N	374.396	3.728	50	40	FHGB	
CCCOc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1OCC	1837030	HMWDDSCUVNZYFI-IBGZPJMESA-N	368.433	3.689	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)N(C)C)c(C)n1-c1ccc([N+](=O)[O-])c(Cl)c1	59334513	WLYAQTJSABHXHU-ZSOIEALJSA-N	372.812	3.651	50	40	FHGB	
Cc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c(C)n1Cc1ccccc1	409250094	POZIVPFYHCFVCO-OYKKKHCWSA-N	363.436	3.985	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/c2c[nH]c3ccccc23)c2ccccc2n1	98087202	ZSZWWOCMZRMUMC-FSJBWODESA-N	358.401	3.554	50	40	FHGB	
C=C(C)C(=O)OCCOC(=O)/C(C#N)=C/c1ccc(-c2ccccc2)o1	3014302	SWJNZOVKBYAFAX-FOWTUZBSSA-N	351.358	3.516	50	40	FHGB	
Cc1ccc(-c2csc(N(C[C@@H]3CCCO3)C(=O)CCl)n2)cc1	932688	MZVQJTLXOCIVTE-AWEZNQCLSA-N	350.871	3.869	50	40	FHGB	
C/C(CC(=O)Nc1ccccc1F)=N\NC(=O)C12CC3CC(CC(C3)C1)C2	100089944	YCELSYPFTIYEAL-ZMOGYAJESA-N	371.456	3.863	50	40	FHGB	
O=C(N/N=C/c1c(F)cccc1Cl)c1cc(-c2ccc(F)cc2)n[nH]1	4599109	HOIMNAFTXNXNLK-ZVBGSRNCSA-N	360.751	3.772	50	40	FHGB	
CCc1cc(C)cc(OCCOc2ccccc2/C=N/NC(=O)OC)c1	4525979	IVIACABWHJFKRP-KGENOOAVSA-N	356.422	3.705	50	40	FHGB	
CC/C(=N\NC(=O)c1ccc(N(CC)CC)cc1)c1cc(F)ccc1O	5659194	VPBDIONRYBCXBM-RELWKKBWSA-N	357.429	3.922	50	40	FHGB	
CC(C)Oc1ccc(C(=O)NNC(=O)CCc2ccccc2Cl)cc1	9952474	NQAPHJOCSMOTMS-UHFFFAOYSA-N	360.841	3.521	50	40	FHGB	
COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccc(Br)o1	408800200	NRBDLNLLOAXSIY-DHZHZOJOSA-N	361.195	3.905	50	40	FHGB	
O=C(c1cccc(OC(F)F)c1)[C@H](Br)CBr	309549361	JLSMXAFXBLFYEY-MRVPVSSYSA-N	357.976	3.629	50	40	FHGB	
CO[C@H](C(=O)N/N=C(\C)c1ccc(Br)cc1)c1ccccc1	5282510	XDXMZEIWNIHLQO-QUYZQLMHSA-N	361.239	3.677	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N/NC(=O)c1cc(OC)cc(OC)c1	6207805	RZKMMYRJALXOIJ-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)c2ccc(NC(=O)Cc3ccccc3)cc2)cc1	6272688	PXRQFOGNEYLVDK-LFVJCYFKSA-N	371.440	3.940	50	40	FHGB	
C=CCc1ccccc1OCC(=O)N/N=C/c1ccccc1Br	1429079	GLKWMJVQENKPHT-UDWIEESQSA-N	373.250	3.707	50	40	FHGB	
CC[C@H](C)c1ccc(OCC(=O)N/N=C/c2ccc(OC)c(OC)c2)cc1	1319374	FNAPUPYNWONIFB-NSMHLIOHSA-N	370.449	3.746	50	40	FHGB	
Cc1ccc(NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C)c(C)c1	8733172	VSZIQXUVNQEYGJ-HNNXBMFYSA-N	369.303	3.558	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)c1	20102490	WRNVUVRVSUEYOO-LPYMAVHISA-N	370.449	3.530	50	40	FHGB	
COc1ccccc1NC(=O)/C(C#N)=C/c1ccc(O)c(Br)c1	23724102	HSVLRQDZKDDJAK-XYOKQWHBSA-N	373.206	3.709	50	40	FHGB	
Cc1cc(/C=N/NC(=O)CN2CCCCC2)c(C)n1-c1ccccc1Cl	58917275	ZEBJVGZFNUFWEB-LPYMAVHISA-N	372.900	3.684	50	40	FHGB	
COc1ccc(CC(=O)N/N=C\c2ccc(Cl)cc2Cl)cc1OC	59515920	WBLLZTNQFAMJOJ-JMIUGGIZSA-N	367.232	3.703	50	40	FHGB	
CCCc1n[nH]c2c1[C@H](c1cc(Cl)cc(Cl)c1O)C(C#N)=C(N)O2	1438057	NFPWWZIRTMIQKT-GFCCVEGCSA-N	365.220	3.593	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2c(-c3ccccc3)nc3ccccn23)c(C)o1	3188137	LKXBEQANZBKNSV-LPYMAVHISA-N	358.401	3.975	50	40	FHGB	
COc1ccccc1NC(=O)/C(C#N)=C/c1ccc(OC(F)F)c(OC)c1	3330431	QMQHHFIFWMCGQR-UKTHLTGXSA-N	374.343	3.851	50	40	FHGB	
O=C(OCCCCCl)[C@H]1CC=CC[C@@H]1C(=O)OCCCCCl	5373390	LBTPPVFWGKEQJP-KBPBESRZSA-N	351.270	3.693	50	40	FHGB	
C=CCOc1ccccc1/C=N/NC(=O)c1cccc(Br)c1	78516521	WUWGJVGYNDYMPI-XDHOZWIPSA-N	359.223	3.778	50	40	FHGB	
COc1cc(/C=C(/C#N)c2cc(OC)c3c(c2)OCO3)cc(OC)c1OC	96137297	IPLKCSHESAUCOE-RZNTYIFUSA-N	369.373	3.514	50	40	FHGB	
Cc1cccc(C(=O)N/N=C(\CC(=O)c2cccs2)C(F)(F)F)c1	103764745	FZNFGMUQTDLOSV-XSFVSMFZSA-N	354.353	3.978	50	40	FHGB	
NNC(=O)c1cn(C(=O)C(c2ccccc2)c2ccccc2)c2ccccc12	226366241	WVYFHDTXWBSSGG-UHFFFAOYSA-N	369.424	3.717	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccccc1[N+](=O)[O-]	408598989	NBCHNWZZTIEIIF-HYARGMPZSA-N	373.368	3.524	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)CCSc2ccc(Cl)cc2)o1	408996157	LFIFKOZDFDYBPW-WOJGMQOQSA-N	351.859	3.632	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)ccc1O	409136048	WFTFNZDKGZRHOO-MQMKENTISA-N	358.463	3.730	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(OC)c(OC)c3)cc2c1	409186571	DXHGQELBFPOSCB-MTJSOVHGSA-N	368.389	3.613	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)Cc1ccc(C)cc1	409364790	PIGMWAGVMYLYBN-LFVJCYFKSA-N	356.425	3.853	50	40	FHGB	
CN(C)c1ccc([C@@H](O)P(=O)(c2ccccc2)c2ccccc2)cc1	1064471	YGZOJJVDSWQLDW-NRFANRHFSA-N	351.386	3.758	50	40	FHGB	
O=P(CCOCCN1CCCCC1)(c1ccccc1)c1ccccc1	2257312	HRFHHLHAUODWAQ-UHFFFAOYSA-N	357.434	3.503	50	40	FHGB	
Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)c2ccccc2O)o1	4827651	FHBWBRIIHJLCBL-RGVLZGJSSA-N	365.345	3.633	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)cc1OC	5653889	ZSHOCDDKGCTJKV-BRFSQIRFSA-N	350.418	3.878	50	40	FHGB	
N#C/C(=C\c1cc2c(cc1Cl)OCO2)C(=O)Nc1cccc([N+](=O)[O-])c1	6241292	BLNTWOZFGPUXQT-NYYWCZLTSA-N	371.736	3.523	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1)N/N=C/c1ccc(O)c(Br)c1	46589813	ADBKMXBGUKTBMB-GIJQJNRQSA-N	367.630	3.501	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccn2)c(C)n1CC(C)C	98053387	JKCYFLJAUWEPED-ZVCOJXFSSA-N	350.466	3.940	50	40	FHGB	
CC(C)N(C(=O)OCc1ccccc1)[C@H]1CC[C@H](NC(=O)CCl)CC1	100177892	UWXDOTWCMIZPEQ-CALCHBBNSA-N	366.889	3.700	50	40	FHGB	
COc1cccc(/C=N/NC(=O)c2ccc(N3Cc4ccccc4C3)cc2)c1	408728968	BHSKSVJXWDKVBI-ZVHZXABRSA-N	371.440	3.979	50	40	FHGB	
CCc1ccccc1NC(=O)/C(C#N)=C\c1ccc(O[C@H](C)C(=O)O)cc1	408854464	GGJDPYDXHCRKQC-MTOJCTJASA-N	364.401	3.647	50	40	FHGB	
COc1cc(/C=N/NC(=O)/C=C/c2ccc(Cl)cc2)cc(OC)c1OC	409060009	ULXZPXQFGGIZSG-XZHCKZKCSA-N	374.824	3.529	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CSCc2ccc(C)cc2)cc1	59473649	MQQCGSJZFIGYJR-FYJGNVAPSA-N	354.475	3.943	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2ccc(NC(C)=O)cc2)cc1Cl	2657740	KIFYPSFRCYRWIL-ZROIWOOFSA-N	369.808	3.853	50	40	FHGB	
COc1cc(C(=O)N/N=C/c2ccc3ccccc3c2)cc(OC)c1OC	3576329	RJSPQNXJGDPTBE-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1nc2ccccc2s1	4981344	XTTBLQQYGHCGBT-VZUCSPMQSA-N	351.343	3.997	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2ccccc2Cl)c([N+](=O)[O-])c1	408898075	KGKUNYVCHJCJDO-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccc(-c3cccc(C(F)(F)F)c3)o2)[nH]n1	18121979	RCOCRBWSTKXXLV-ZVBGSRNCSA-N	362.311	3.761	50	40	FHGB	
Cc1ccc(-n2cccc2/C=N/NC(=O)c2ccc(O)cc2)cc1Cl	409010748	KXERYIXNGZBUJX-CIAFOILYSA-N	353.809	3.909	50	40	FHGB	
COc1ccc(/C(C#N)=C/c2cc(Cl)ccc2OCC(=O)O)cc1OC	408583609	VVDZAEJZFZGWNT-VGOFMYFVSA-N	373.792	3.885	50	40	FHGB	
CCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)NC(C)(C)C)o2)cc1	1512817	ICXMYQCRCKTNES-FOWTUZBSSA-N	366.417	3.945	50	40	FHGB	
C/C(N)=C(\C#N)C(=O)CSc1nc2ccccc2n1-c1cccc(C)c1	104719037	NXHHMWIGPPYTEW-PEZBUJJGSA-N	362.458	3.751	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CC2(C)SCCS2)cc1OCC	6964176	IGKXSCLZMSXXIF-LDADJPATSA-N	368.524	3.520	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@H]1c1ccc(C)cc1	629544	VPUYSAARIPPTHH-SFHVURJKSA-N	360.413	3.777	50	40	FHGB	
O=c1ccc(/N=C/c2ccc(N(CCCl)CCCl)cc2)ccc1O	1760622	YJNYYVQHOYUIOW-FYJGNVAPSA-N	365.260	3.787	50	40	FHGB	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(CCC)cc2)cc1	2288655	XCQFGZXZNMUYKB-UHFFFAOYSA-N	354.450	3.893	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CSCc2ccccc2C)cc1	3089385	HSMSVYIAIDJYIZ-FYJGNVAPSA-N	354.475	3.943	50	40	FHGB	
CCCCCOc1ccc(O[C@@H](C)C(=O)N/N=C/c2ccccc2O)cc1	3167084	SWGSKQIYCSMBHZ-PZBNQXIHSA-N	370.449	3.879	50	40	FHGB	
O=C(N/N=C/c1cccc(Br)c1)c1ccc(N2CCCC2)cc1	7384621	HGNGVPIETNRIKC-DEDYPNTBSA-N	372.266	3.813	50	40	FHGB	
CC[C@@H](C)Oc1c(Cl)cc(/C=N/NC(=O)c2ccccn2)cc1OC	33685071	YMAGHBHMVLZHRL-KIHMUJGBSA-N	361.829	3.685	50	40	FHGB	
CC(=O)Nc1cccc([C@@H](C)NC(=O)NNc2cccc(Cl)c2C)c1	45719406	AESLTTHLBIELGN-GFCCVEGCSA-N	360.845	3.994	50	40	FHGB	
COC(=O)c1sccc1NC(=O)/C(C#N)=C/c1cccc2[nH]ccc12	61717808	KTFXKJPSNISCQX-FMIVXFBMSA-N	351.387	3.562	50	40	FHGB	
CCCCCCC[C@@H](O)CCC(=O)N/N=C/c1ccc(OC)c(OC)c1	98001317	IWLBZWFKZXUSCU-WNSCPLKPSA-N	364.486	3.656	50	40	FHGB	
CC(=O)c1ccc(-c2ccc(/C=N\NC(=O)Cc3ccc(F)cc3)o2)cc1	409230510	DZHIMHHMTLNGQC-QRVIBDJDSA-N	364.376	3.981	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CNc2ccc3ccccc3c2)ccc1O	1434483	VDBLMXITKWJVEG-YDZHTSKRSA-N	363.417	3.506	50	40	FHGB	
Cc1ccccc1/C=N\NC(=O)[C@H]1COc2ccc(C(C)(C)C)cc2O1	4523681	SYUOTTUFRSULQS-JJUBJSHISA-N	352.434	3.583	50	40	FHGB	
CCCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2n[nH]c(CCC)c21	9042123	LULTXHRYZIUVTI-QGZVFWFLSA-N	352.438	3.759	50	40	FHGB	
N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3\C[C@H]4C=CC[C@@H]34)cc2)cc1	20791467	HXGHNTSONLLCSQ-HDJDIMQGSA-N	357.413	3.672	50	40	FHGB	
O=C(N/N=C\c1ccc(Cl)cc1)C(O)(c1ccccc1)c1ccccc1	31729857	ONWGJPDBNJONCO-HAHDFKILSA-N	364.832	3.726	50	40	FHGB	
C/C(=N/NC(=O)c1cc(-c2ccc(Cl)s2)n[nH]1)c1ccccc1O	100925478	BLWLPHWGGFAPJF-NVMNQCDNSA-N	360.826	3.651	50	40	FHGB	
C[C@@]12CC[C@H]3[C@@](P(c4ccccc4)c4ccccc4)(OC[C@]31C)C2=O	222180158	VVUKNXGGDLPMKO-ZDFPQIBNSA-N	350.398	3.851	50	40	FHGB	
COc1ccc(N2Cc3ccc(C(=O)N/N=C\c4ccccc4)cc3C2)cc1	408822656	QKEGWCYNOOQLNP-OYKKKHCWSA-N	371.440	3.979	50	40	FHGB	
C[C@H]1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc(OC(F)(F)F)cc1	3135164	CFJHPNILZRCIJV-VFZGTOFNSA-N	364.323	3.646	50	40	FHGB	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc3ccccc23)cc1C	11007041	PCFQEUOBGIIHMM-UHFFFAOYSA-N	363.417	3.688	50	40	FHGB	
CCCCSC1=C(C#N)[C@H](c2ccccc2OCC)[C@@H](C#N)C(=O)N1	17016331	OEFOPYWMSATOTR-RHSMWYFYSA-N	355.463	3.707	50	40	FHGB	
O=C(COc1ccc2ccccc2c1)N/N=C\c1ccc(Br)o1	32114535	RWWQYHYDLYERAR-GRSHGNNSSA-N	373.206	3.724	50	40	FHGB	
CCOc1ccc(C(=O)NN)cc1COc1ccc(-c2ccccc2)cc1	224550350	ZEDJVUNAABVUHP-UHFFFAOYSA-N	362.429	3.935	50	40	FHGB	
COc1ccc(/C=N/NC(=O)C(c2ccccc2)c2ccccc2)cc1OC	1243408	YXUGWJUJXADXOX-LFVJCYFKSA-N	374.440	3.986	50	40	FHGB	
N#CC1=C(N)N2C(=C(C#N)[C@H]1c1c(F)cccc1Cl)Nc1ccccc12	2345161	KWXHGCBLWLVPSH-INIZCTEOSA-N	363.783	3.937	50	40	FHGB	
CCCCc1ccc(NC(=O)C(=O)N/N=C/c2c[nH]c3ccccc23)cc1	3083582	WPAMSQUBPSTCPF-OEAKJJBVSA-N	362.433	3.599	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccccc1C)c1cccc(Br)c1	4180675	LLYOGYWXRXJVPM-DEDYPNTBSA-N	360.255	3.710	50	40	FHGB	
N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1ccc(C(=O)O)cc1	6428773	VBIZFOJIIGOESB-UKTHLTGXSA-N	371.190	3.693	50	40	FHGB	
CC(C)c1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1	20086650	PXKBONKGHLPZQJ-GOSISDBHSA-N	370.408	3.951	50	40	FHGB	
CCOC(=O)N/N=C\c1ccc(OC/C=C/c2ccccc2)c(OC)c1	32578357	RIIQGXZGAUBNGR-SLRCWVGKSA-N	354.406	3.867	50	40	FHGB	
C[C@]12CC[C@H]3[C@@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@@H]1CC[C@@]2(O)C#N	59213663	VRSHJJXUDZAQKD-SJFWLOONSA-N	357.494	3.947	50	40	FHGB	biogenic
COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(Cl)cc2)c(OC)c1	408868539	MWBHTOPVEPZJMP-OQLLNIDSSA-N	356.809	3.581	50	40	FHGB	
Cc1cc2c(cc1/C=N\NC(=O)c1cc3cc(Cl)ccc3o1)OCO2	409022820	GGZQHMQGRFCEAA-ZBKNUEDVSA-N	356.765	3.887	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1C)OCO2	409094628	FBPUHIIYQOTQKN-LZYBPNLTSA-N	364.401	3.977	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/c1c(C)nn(-c2ccccc2)c1Cl	863187	GBHSOPPDSYQXTH-CIAFOILYSA-N	368.824	3.607	50	40	FHGB	
CC[C@@]1(C)Cc2c(sc(NC(=O)[C@@H](C)Br)c2C#N)CO1	1239267	TXVLOHFDOKENJV-CLAHSXSESA-N	357.273	3.583	50	40	FHGB	
CN(NC(=O)c1ccccc1F)c1nc(C(F)(F)F)nc2ccccc12	1404493	LTSPIZFHEVXVHI-UHFFFAOYSA-N	364.302	3.569	50	40	FHGB	
CCOC(=O)COc1ccccc1/C=C(\C#N)c1nc2cc(C)ccc2[nH]1	4454013	XFXPGJWTMNPQST-LFIBNONCSA-N	361.401	3.877	50	40	FHGB	
N#C[C@]1(c2ccccc2)O[C@@H](C(=O)c2ccccc2)C[C@@H]1Br	4783368	RABTWZKKSGXMPG-SOLBZPMBSA-N	356.219	3.841	50	40	FHGB	
Br[C@H]1CSc2n(c3ccccc3[n+]2Cc2ccccc2)C1	4868301	VPCCNKQDDMJXRN-CQSZACIVSA-N	360.300	3.846	50	40	FHGB	
COc1ccc(C(=O)N/N=C\c2cc([N+](=O)[O-])c(Cl)cc2Cl)cc1	8116750	PDTFAPWDEWXOGL-LSCVHKIXSA-N	368.176	3.674	50	40	FHGB	
C/C(CCc1ccccc1)=N/NC(=O)C(=O)Nc1cccc2ccccc12	59515800	GMSBCGZDZAZABY-JLPGSUDCSA-N	359.429	3.903	50	40	FHGB	
CCCn1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(C2CC2)n1	253397965	GIFIDTSFDVPVAJ-QGZVFWFLSA-N	366.465	3.621	50	40	FHGB	
O=C(N/N=C/c1ccc(COc2ccccc2[N+](=O)[O-])o1)c1cccs1	409091172	PZTPFCPOEJASIU-VCHYOVAHSA-N	371.374	3.592	50	40	FHGB	
O=C1CCC/C(=N/NC(=O)c2cc(-c3cccnc3)nc3ccccc23)C1	103449530	YBUODEJURUQUDZ-IWIPYMOSSA-N	358.401	3.526	50	40	FHGB	
COc1cc(/C=C(\C#N)c2nc(N)c3ccccc3n2)ccc1OC(F)F	24567083	PCMWCFFCFINPCK-XYOKQWHBSA-N	368.343	3.886	50	40	FHGB	
Cc1nc2sccn2c1C(=O)N/N=C/c1ccc(Cl)c(Cl)c1	59459516	MJOQQIYKZKBVAR-REZTVBANSA-N	353.234	3.775	50	40	FHGB	
Cc1ccccc1C(=O)N/N=C(\CC(=O)c1cccs1)C(F)(F)F	100103816	SQEMXHRNPFWNNF-XSFVSMFZSA-N	354.353	3.978	50	40	FHGB	
CCC[C@H](C)c1ccc(OCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1	1444741	KUOXOPXBALDFFE-OOXYOOLHSA-N	368.433	3.848	50	40	FHGB	
C#CCOC1(c2ccccc2)[C@@H]2CCC[C@@H]1C2I	100547434	FMFHAGCYRDGRHL-WXLSXGNJSA-N	352.215	3.765	50	40	FHGB	
Cc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c(C)n1-c1ccc(C#N)cc1	409249768	VNFSQXHIZAUJHY-QFEZKATASA-N	374.419	3.798	50	40	FHGB	
COC(=O)N/N=C/c1ccc(OCCCOc2ccc(C)c(C)c2)cc1	9434880	IVYLEKDDPKHRFQ-KGENOOAVSA-N	356.422	3.841	50	40	FHGB	
COc1ccc(NC(=S)NNC(=O)c2ccc(Cl)cc2Cl)cc1	39603220	VRNVNCHSAWXEST-UHFFFAOYSA-N	370.261	3.633	50	40	FHGB	
O=C(N/N=C/c1ccc(F)s1)c1ccc(COc2ccc(F)cc2)o1	252488317	IOYCQOUUWNJWLV-AWQFTUOYSA-N	362.357	3.962	50	40	FHGB	
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=N/NC(=O)c1ccco1	8043714	RZGIUCZPUJSIBN-DJKKODMXSA-N	363.204	3.844	50	40	FHGB	
N#C/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	6241259	NXSCWNOXFLVJML-IZZDOVSWSA-N	372.724	3.702	50	40	FHGB	
COc1ccc(CC(=O)N/N=C(\C)c2ccc(Br)s2)cc1	695844	KNWHSYXVUVZDRT-LICLKQGHSA-N	367.268	3.602	50	40	FHGB	
CC(=O)Nc1ccc(-c2csc(NNC(=O)c3ccc(C)cc3)n2)cc1	708625	SWEGTJKIQAWAFT-UHFFFAOYSA-N	366.446	3.834	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=N/NC(=O)[C@H](C#N)c3ccccc3)c2c1	409204959	MMLRJTQHVAOOQK-ANRKENSESA-N	373.412	3.614	50	40	FHGB	
N#C/C(=C/c1ccc(Br)o1)C(=O)NCCCc1ccccc1	409249544	USMOIXXCTKVKME-KAMYIIQDSA-N	359.223	3.698	50	40	FHGB	
C#CCn1cc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)c2ccccc21	15225921	BIGBYVVGQDVWAQ-AQTBWJFISA-N	369.424	3.506	50	40	FHGB	
CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1c(Cl)cc(Cl)cc1Cl	16693856	VHIWQJQNGFHVDC-POHAHGRESA-N	370.623	3.781	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C/c1cccc(C(F)(F)F)c1	6888789	LLROCZXZTBQTFI-ZVBGSRNCSA-N	356.731	3.888	50	40	FHGB	
Br[C@H]1C=CC=CN1C/C=C\CN1C=CC=C[C@H]1Br	104092770	SSAJWEKHEUXTEL-YOQOKRQFSA-N	372.104	3.756	50	40	FHGB	
CCOC(=O)/C(C#N)=C/NCc1ccc(N(C)c2ccccc2)c(F)c1	84791148	WXSOPCFTINRVFO-JQIJEIRASA-N	353.397	3.654	50	40	FHGB	
CC(=O)Nc1ccc(C(=O)N/N=C\c2cc(Cl)ccc2OC(C)C)cc1	33654778	SREYYSMBYRZXLR-NHDPSOOVSA-N	373.840	3.850	50	40	FHGB	
O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)N/N=C/c1ccccc1	408977451	DLVHSXRXKGASKF-OHQZHEALSA-N	371.440	3.698	50	40	FHGB	
CC[C@H](C)NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C	36750425	LFBRYHWILFLTCE-QCUKBLKESA-N	351.450	3.924	50	40	FHGB	
FC(F)(F)[C@H](Br)COC[C@@H](Br)C(F)(F)F	1083807991	OVGIBYXHSJQMIX-QWWZWVQMSA-N	367.909	3.655	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)cc1Cl)c1cncc(Br)c1	1051948	ZFHSLXJSMHIRGS-NGYBGAFCSA-N	373.037	3.915	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)NCc2ccccc2)c(OC)c1	2315426	ZFSAMCRWDSRHTG-CPNJWEJPSA-N	363.461	3.765	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc1OC	3576429	LTNPJFRRCVMOMU-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
C/C(=N\NC(=O)c1cccnc1)c1ccc(NC(=O)c2cccs2)cc1	5895722	PPKXIGYTKCQSFY-LPYMAVHISA-N	364.430	3.549	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N/NC(=O)CN3CCCCC3)c2C)cc1C	28216578	JTDYPHOERZVIEB-OEAKJJBVSA-N	366.509	3.647	50	40	FHGB	
C=CCc1cc(/C=C(/C#N)C(=O)N(C)C)cc(Br)c1OCC	59334802	UFEHZBKSKZOXTK-ZROIWOOFSA-N	363.255	3.571	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2o1	408967670	WPIYSNCFDNXXNL-FYJGNVAPSA-N	374.356	3.896	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	59436903	AMJALXQZIVWEEH-YBFXNURJSA-N	359.769	3.577	50	40	FHGB	
COC(=O)Cn1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)c2ccccc21	59396260	KVHVDOQDKAZNDX-WJDWOHSUSA-N	373.412	3.668	50	40	FHGB	
COc1ccc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)c(OC)c1OC	408569919	RAODYFYLBWZPQO-WQLSENKSSA-N	353.353	3.792	50	40	FHGB	
C/C(=N\NC(=O)c1csc2c1CCCC2)c1ccc(-n2ccnc2)cc1	4619386	FIRPVSKREPKGEA-HYARGMPZSA-N	364.474	3.967	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2ccc(Cl)cc2Cl)cccc1[N+](=O)[O-]	5921561	GPGTXBOQXUGTHQ-QGMBQPNBSA-N	352.177	3.974	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Cl	408792144	IQQQQXIAWZETSG-KPKJPENVSA-N	357.753	3.802	50	40	FHGB	
COc1cc(Cl)c(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1OC	66202233	SFJOHZJXIOBPIN-KEBDBYFISA-N	367.232	3.703	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2cc(OC)c(OC)cc2C)cc1	78325979	FEASQAWBHFFFMD-GDNBJRDFSA-N	352.390	3.567	50	40	FHGB	
CC(=O)N/N=C/c1c(-c2ccccc2)nc2sc(C3CCCCC3)nn12	41074120	MLYPBKQTSJLGCY-UDWIEESQSA-N	367.478	3.976	50	40	FHGB	
CN(/N=C/c1ccc(OC2CSC2)cc1)C(=O)OCc1ccccc1	8091056	OCZYGLWTFOBVBO-RGVLZGJSSA-N	356.447	3.783	50	40	FHGB	
COc1ccc(CC(=O)N/N=C\c2c(Cl)cccc2Cl)cc1OC	4507790	LTKONOPGYJRHAL-JMIUGGIZSA-N	367.232	3.703	50	40	FHGB	
CN(NC(=O)c1cccc(C(F)(F)F)c1)c1c(Cl)c(Cl)nn1C	1395764	YSYRSPWEIGIXMR-UHFFFAOYSA-N	367.158	3.527	50	40	FHGB	
O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCCC1)Nc1ccccc1	4782792	OPEPXXIFXYBKSU-XSFVSMFZSA-N	367.409	3.741	50	40	FHGB	
CC(=O)OC1=C(C)C2=C3OC(=O)C(C)=C3CC[C@]2(C)[C@@H](Cl)[C@@H]1Cl	6050439	YVGHSBLNSIYVSA-PVUWLOKVSA-N	357.233	3.979	50	40	FHGB	
C=CCn1cc(/C=N/NC(=O)Cc2ccc(OCC)cc2)c2ccccc21	10315687	LLILYJBAWUOTRR-HZHRSRAPSA-N	361.445	3.919	50	40	FHGB	
Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)Cc2ccccc2)o1	14134929	DAZLXXPLHDOEOX-FYJGNVAPSA-N	363.373	3.856	50	40	FHGB	
Cc1ccc(Cl)cc1-c1ccc(/C=N/NC(=O)CC2(C)OCCO2)o1	59463238	GZZFDXLTJJCFHR-RGVLZGJSSA-N	362.813	3.512	50	40	FHGB	
C/C(O)=C(/C#N)C(=O)Nc1cc(Br)ccc1Br	100001996	UVSVTDVJQAJIFG-SOFGYWHQSA-N	360.005	3.506	50	40	FHGB	
CCCCn1c(CCl)nc2cc(S(=O)(=O)N(CC)CC)ccc21	3287126	NNLFXKNFSRGPCQ-UHFFFAOYSA-N	357.907	3.606	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@H](C)SCc2ccccc2)ccc1O	4714622	WAVZYCWFJOLCTE-PVGUKEHMSA-N	358.463	3.563	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1	4953648	NTWPFIGOMQPIHR-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	5712739	HMMUZXOTQDQYQM-GXDHUFHOSA-N	367.361	3.548	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)cc(Cl)c1O	6410564	KDVNXJUBFHEKII-AZZDOICSSA-N	356.809	3.839	50	40	FHGB	
N#CC1=C2SC[C@@](O)(c3ccco3)N2C(=O)C[C@H]1c1ccc(Cl)cc1	12274958	HTPUSOGNMGTVSA-SCLBCKFNSA-N	372.833	3.576	50	40	FHGB	
O=C(Cc1ccccc1Cl)NNC(=O)c1cc2c(s1)CCCCC2	36329657	DDHWWCIGBXCJIK-UHFFFAOYSA-N	362.882	3.674	50	40	FHGB	
O=C(NNC(=O)c1cc(F)ccc1-c1ccccc1)c1ccccc1F	42568322	VDYLZBLGOHULOK-UHFFFAOYSA-N	352.340	3.707	50	40	FHGB	
CC(=O)N/N=C/c1c(OCc2ccc(C(=O)O)cc2)ccc2ccccc12	409015445	SBLNJPVHQUFEQU-WSDLNYQXSA-N	362.385	3.587	50	40	FHGB	
O=C(NNC(=S)NCCCc1ccccc1)c1ccc2ccccc2c1	408585936	LFUUMHGZRFYGQY-UHFFFAOYSA-N	363.486	3.582	50	40	FHGB	
COc1cccc(CC(=O)N/N=C\c2cc(C)n(-c3ccccc3)c2C)c1	408780402	CCFYLGXTILQHQO-HAHDFKILSA-N	361.445	3.796	50	40	FHGB	
C[C@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1	1092201	ODWWIJNRECTXDI-HADWXUJASA-N	362.389	3.699	50	40	FHGB	
CCOC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@H]2c1ccc(F)cc1	1428101	BZYDUJLMNAUQCV-AWEZNQCLSA-N	358.394	3.591	50	40	FHGB	
COc1cccc(NC(=S)C(C#N)=C2N(C)c3ccccc3N2C)c1	2647763	JLPRYZRZXKPSOI-UHFFFAOYSA-N	350.447	3.756	50	40	FHGB	
COc1ccc(C(=O)NNc2nc3c(C)c(C)ccc3s2)c(OC)c1	4121424	OQANJIHRWMKBRF-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
CC(C)c1ccc(OCC(=O)N/N=C\C=C\c2cccc([N+](=O)[O-])c2)cc1	4515197	PTQXEHWRMQPPCU-PWXLJDLCSA-N	367.405	3.912	50	40	FHGB	
CCOc1cc(C(=O)N/N=C2/C[C@@H]3C=CC[C@H]23)cc(OCC)c1OCC	5463673	KVNSPZJFCLHDFD-UUTVVRALSA-N	358.438	3.565	50	40	FHGB	
O=C/C(=C/Nc1cc([N+](=O)[O-])ccc1O)c1nc2cc(Cl)ccc2o1	5740738	MZIOACKUPMJWRR-CLFYSBASSA-N	359.725	3.747	50	40	FHGB	
N#C/C(=C\c1ccc(O)c(Br)c1)C(=O)Nc1ccc(F)cc1	6221675	ANRDXQHXTBJMGA-YRNVUSSQSA-N	361.170	3.839	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)c2ccccc2C(=O)c2ccc(C)c(C)c2)n1	12880492	VTEBXLTWDPVLBN-UHFFFAOYSA-N	374.444	3.698	50	40	FHGB	
CCN(CC)c1ccc(C=NNC(=O)COc2cccc(Cl)c2)cc1	19877959	AUUOHBULODOHHT-UHFFFAOYSA-N	359.857	3.715	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2cc(Cl)c(OC)cc2OC)cc1	20764279	PNLOWPBPMGKZQK-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
C=C(C)[C@@H]1CC=C(C)/C(=N\NC(=O)COc2ccc(C(=O)OCC)cc2)C1	33566371	NMGDDAGGWJRPFF-LLWUOSFCSA-N	370.449	3.647	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1F	34690236	IAHZYDCJZDEXCL-PTNGSMBKSA-N	353.353	3.635	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cccc(Cl)c1)OCO2	409067404	CVRGBPITWWSYMQ-LFYBBSHMSA-N	356.765	3.623	50	40	FHGB	
CC(=O)n1cc(/C=N/NC(=O)CCc2c[nH]c3ccccc23)c2ccccc21	1500805	MPGDMLGLKLPKQK-ZMOGYAJESA-N	372.428	3.866	50	40	FHGB	
COC(=O)N/N=C/c1cc(C)n(-c2ccc(Br)cc2)c1C	2262543	WIYLXLNUBWUENR-RQZCQDPDSA-N	350.216	3.547	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)cc1	3168510	OMTPQDJUIMGTTG-CIAFOILYSA-N	373.840	3.526	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2C)c1C	4087244	WBJQFTQCHHVEMY-GZTJUZNOSA-N	371.868	3.726	50	40	FHGB	
C/C(=N/NC(=O)c1ccccn1)c1cccc(NC(=O)C2CCCCC2)c1	5888673	CZXYHNJJXHLAOH-IWIPYMOSSA-N	364.449	3.754	50	40	FHGB	
C/C(=N/NC(=O)CSc1nc2ccccc2[nH]1)c1ccccc1Cl	16712308	WKYHKBDOBPUKJD-NHDPSOOVSA-N	358.854	3.849	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Br)ccc1O)c1ccc(Cl)cc1	27498804	KMGLJKVALDXYDZ-GIJQJNRQSA-N	367.630	3.962	50	40	FHGB	
O=P(Cl)(N(CCCl)CCCl)N(CCCl)CCCl	77319429	QXUFUUCHZZBJNO-UHFFFAOYSA-N	364.468	3.893	50	40	FHGB	in-vitro
Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2C)cc1	409101508	UKCQFSZZOCLGQC-RGEXLXHISA-N	361.445	3.686	50	40	FHGB	
O=C(CNc1ccc2ccccc2c1)N/N=C/c1cc(Cl)ccc1O	816708	SXLWZYHINUOQNC-SSDVNMTOSA-N	353.809	3.761	50	40	FHGB	
Cn1cc(/C=N/NC(=O)COc2cccc3ccccc23)c2ccccc21	880986	QKRYZFKUELKZLT-YDZHTSKRSA-N	357.413	3.861	50	40	FHGB	
CCCN1CCC2(CC1)C(C#N)=C(N)Oc1c2sc2nc(C)cc(C)c12	4075103	RPXYJZGALJCEHV-UHFFFAOYSA-N	368.506	3.743	50	40	FHGB	
CCCCOc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1OC	4548502	CZYUEOGOVRDEBS-LJQANCHMSA-N	368.433	3.689	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2[N+](=O)[O-])cc1	5712867	DAOIOMOOJGXBBD-RVDMUPIBSA-N	351.362	3.848	50	40	FHGB	
CC(C)C1=C/C(=N\S(=O)(=O)c2ccccc2)[C@](C)(Cl)[C@H](Cl)C1=O	102782109	AMKNSIWVDQASDH-TXRWQHQPSA-N	374.289	3.586	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C)cc1C(=O)O	409151506	BQIYSPJAPDXKEI-XNTDXEJSSA-N	350.374	3.638	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc3c4c(cccc24)CC3)cc1[N+](=O)[O-]	409185999	UUHSUCJKBCFXAB-WSDLNYQXSA-N	359.385	3.919	50	40	FHGB	
CC(=O)c1cc[n+](Cc2ccc(N(CCCl)CCCl)cc2)cc1	1615553	BSKNYCPCTQTLPT-UHFFFAOYSA-N	352.285	3.509	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1cccc(OC(=O)/C(C#N)=C/c2ccccc2)c1	2888759	NGRVDWKSEVZXCL-IDXRHMDNSA-N	372.380	3.669	50	40	FHGB	
COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)cc1F	12697173	UTPKCJLPOZPLOZ-RIYZIHGNSA-N	351.786	3.826	50	40	FHGB	
COc1ccc(-c2n[nH]cc2/C=C(/C#N)C(=O)N[C@H](C)c2ccccc2)cc1	5728445	MTSKPMKTNZHSGT-PWDRBQJJSA-N	372.428	3.870	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1ccccc1Cl	408835422	YSAOXVCIDZEEMH-GXDHUFHOSA-N	370.792	3.983	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1	33793823	RYHLGLNADQYCLJ-VCHYOVAHSA-N	355.375	3.582	50	40	FHGB	
CCCC(=O)Nc1ccc(C(=O)N/N=C/c2c(C)[nH]c3ccccc23)cc1	671333	BIDZLDPZFHAHJN-LPYMAVHISA-N	362.433	3.979	50	40	FHGB	
Cc1ccc(C(=O)N/N=C(/CC(=O)c2cccs2)C(F)(F)F)cc1	4481145	GQOKUNOAZLYGSC-ZHZULCJRSA-N	354.353	3.978	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1Cl	6189951	MLQLNWQGLUTJCW-SSZFMOIBSA-N	367.836	3.722	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)cc1	8228898	YXWVTGVUTOJTOX-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
Cc1ccc(C)c(OCC(=O)N/N=C/C=C/c2ccc([N+](=O)[O-])cc2)c1C	12859372	SMTLAYUCCRCNLQ-KRDWPCQQSA-N	367.405	3.714	50	40	FHGB	
Cc1[nH]c2ccccc2c1C(=O)/C(C#N)=C\c1ccc(OCC(=O)O)cc1	48275831	FQFPYDLIAOVUPM-GDNBJRDFSA-N	360.369	3.730	50	40	FHGB	
COc1cccc(C(=O)N/N=C(\C)c2ccc(N3CCCCC3)cc2)c1O	98055309	LHJWDXMSUFMANC-PXLXIMEGSA-N	367.449	3.545	50	40	FHGB	
CO[C@]1(C(=O)Nc2ccc(OCCBr)cc2)CCC[C@@H](C)C1	225634671	YEXIDDHSTKHEFH-CXAGYDPISA-N	370.287	3.994	50	40	FHGB	
COc1cccc(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)c1OC	408565849	BKUUGZAOLZSJRF-HYARGMPZSA-N	354.450	3.694	50	40	FHGB	
CC1(C)CCC2=C(C1=O)[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2	939045	NLVARNKOPMWQRD-AWEZNQCLSA-N	373.250	3.900	50	40	FHGB	
C/C(=N\NC(=O)[C@@H]1CCCO1)c1ccc2c(c1)Nc1ccccc1S2	43973156	HDTCKITTXYMUFI-GKXUUXLPSA-N	353.447	3.914	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2CC)cc1OC	408872747	PTBPWQFJVQIYCO-QGOAFFKASA-N	360.413	3.815	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Sc1ccc(C)cc1)c1ccc2c(c1)OCCO2	409120836	VAWOYYGCFFBKDK-HBBMIWKISA-N	370.474	3.787	50	40	FHGB	
C=CCOC(=O)C1=C(C)NC(SC)=C(C#N)[C@H]1c1ccc(OCC)cc1	100872287	MVXCHTFHIZMSFQ-GOSISDBHSA-N	370.474	3.873	50	40	FHGB	
CCN(CC)c1ccc(/C=C(/C#N)C(=O)Nc2ccccc2F)c(O)c1	408807523	DBYMHMQTFIKVDD-PTNGSMBKSA-N	353.397	3.923	50	40	FHGB	
N#C/C(=C\c1ccc(F)cc1F)c1nc(N)nc(Nc2ccccc2)n1	14093506	HRDSRDMLDUGSHY-XYOKQWHBSA-N	350.332	3.540	50	40	FHGB	
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=C(\C#N)C(=O)NC(C)C	6429180	AYWIZJCMZFCAEK-KPKJPENVSA-N	363.248	3.919	50	40	FHGB	
CCOc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1ccccc1C	409004614	AULJVDJYIWWJPZ-UHFFFAOYSA-N	361.401	3.842	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N\NC(=O)c3ccc(C)o3)o2)c([N+](=O)[O-])c1	408718693	XAYUWTIEPGVTTL-GRSHGNNSSA-N	353.334	3.829	50	40	FHGB	
CCC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])o2)cc1	1085500	PIRNLNUHVNBFJD-OTGIAGGSSA-N	359.382	3.621	50	40	FHGB	
Cc1ccc(C)c(OCC(=O)N/N=C/c2ccc(Br)cc2)c1	3151349	ZTXIRNSTUSWAIL-VXLYETTFSA-N	361.239	3.595	50	40	FHGB	
CC(C)(C)c1ccc([C@@H]2C[C@H]2C(=O)N/N=C\c2ccc(C(=O)O)cc2)cc1	30802738	XYIDJLMIMJSDJT-KFZMYSCVSA-N	364.445	3.936	50	40	FHGB	
N#CC1=C2SCN(C3CCCC3)CN2C(=O)C[C@H]1c1ccc(F)cc1	20347998	UNBVKIRRLVMAQK-INIZCTEOSA-N	357.454	3.783	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)c1ccncc1	2316695	WKRNOTUHKRECCQ-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
C=CCn1c([P@](=O)(c2ccccc2)N2CCCCC2)nc2ccccc21	3179583	PRHVVAJGGCRDGR-AREMUKBSSA-N	365.417	3.937	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1OC	408548815	LPLJGGFTCKQXRC-WSDLNYQXSA-N	364.401	3.635	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1cn(Cc2ccccc2C#N)c2ccccc12	408781881	FSELHZGKDOFMEG-ODLFYWEKSA-N	368.440	3.993	50	40	FHGB	
N#CC1=C(SCc2ccc([N+](=O)[O-])cc2)NC(=O)C[C@@H]1c1cccs1	409136244	SAUNDSSAVJWPNC-ZDUSSCGKSA-N	371.443	3.928	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)COc2cc(Cl)ccc2Cl)cc1	1103491	ZWKXQFMHBFBUAV-KEBDBYFISA-N	366.248	3.589	50	40	FHGB	
Cc1nn(C)c2ncc(C(=O)NN(c3ccccc3)c3ccccc3)cc12	12981016	OQBXMNJREFYKDQ-UHFFFAOYSA-N	357.417	3.760	50	40	FHGB	
O=C(N/N=C(/Cc1nc2ccccc2[nH]1)c1ccccc1)c1ccccc1	33340928	NFPYLTDFSMUVMH-QQTULTPQSA-N	354.413	3.940	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=C(/C#N)C(=O)NCc2ccccc2)cc1	408949289	AMMPCKFOVYUNBA-CYVLTUHYSA-N	370.456	3.767	50	40	FHGB	
COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1ccc(C)cc1C	860949	XINPBSMWFPHFCA-UHFFFAOYSA-N	361.401	3.760	50	40	FHGB	
O=C(/C=C(\C(=O)O)c1ccccc1)NNc1ccc(Cl)cc1Cl	1398084	YVVCNSGFQSAIFN-XFXZXTDPSA-N	351.189	3.605	50	40	FHGB	
COc1cccc(/C=N/NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)c1O	5531619	YVMWYZVJDTVFGF-VURRPDKYSA-N	364.854	3.685	50	40	FHGB	
BrC[C@H]1CN=C(N2CCS/C2=N\c2ccccc2)S1	5600817	OADFGEJHVYNVLW-CQINNJSPSA-N	356.314	3.589	50	40	FHGB	
COc1ccc2cc(-c3cc(C(=O)NN)nn3-c3ccc(C)cc3)ccc2c1	59472509	UCVMPOLDVPSCNH-UHFFFAOYSA-N	372.428	3.613	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)CSCc2ccc(OC)cc2)cc1	59473398	XGUQYBFVDSTRPN-RCCKNPSSSA-N	372.490	3.868	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	408814505	PONIQBIRHUERGG-FYJGNVAPSA-N	362.389	3.808	50	40	FHGB	
O=C(NNc1nc(-c2ccc(Br)cc2)cs1)C(F)(F)F	1415090	JNPXZSKGRMAXSI-UHFFFAOYSA-N	366.162	3.578	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cc2)cc(OC)c1O	1195562	JWVHRXAIZMRRNB-KPKJPENVSA-N	358.781	3.608	50	40	FHGB	
Cc1[nH]c2ccccc2c1/C=N/NC(=O)Cc1ccc(Br)cc1	9203213	HOWVHGZHZXVULY-RGVLZGJSSA-N	370.250	3.932	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@@H]1C[C@@H]1c1ccccc1	84525435	RWLQMNWECRZJKB-BXJVNKMFSA-N	352.478	3.544	50	40	FHGB	
C/C(CC(=O)Nc1c(C)cc(C)cc1C)=N\NC(=O)COc1ccccc1	6997101	PBEOANMERMBZMV-HAVVHWLPSA-N	367.449	3.512	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2Cl)cc1OC	408787491	AWISEHHMIORBTJ-RVDMUPIBSA-N	366.804	3.906	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c(Cl)cc1OC	409221673	UQHADVATAHDKAX-NHDPSOOVSA-N	364.804	3.579	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(O[C@@H](C)C(=O)O)cc2)c(C)c1	408845330	MBGYUHZFLCXAHT-ZCQLHAAUSA-N	364.401	3.701	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1c(C)cc(C)c(/C=C(\C#N)C(=O)OCC)c1C	33706210	ZTCMATLCSLUDDY-CZCYGEDCSA-N	366.417	3.552	50	40	FHGB	
CCCCCCCCCCCC[C@H](Br)C(=O)NCC(N)=O	73372233	YLYYKUPMRFKGEZ-AWEZNQCLSA-N	363.340	3.662	50	40	FHGB	
N#CC1=C(N)Oc2cc([N+](=O)[O-])ccc2[C@@H]1c1c(O)ccc2ccccc12	5904551	INHSLGIAEHYIMM-SFHVURJKSA-N	359.341	3.672	50	40	FHGB	
Cc1cc(N2CCCC2)ccc1/C=N/NC(=O)COc1ccc(Cl)cc1	408961734	VAAHQIWMXCDYGR-LPYMAVHISA-N	371.868	3.778	50	40	FHGB	
COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1cc(Cl)c(O)c(OC)c1	408806838	BXCVBYWKPQBKCK-NTUHNPAUSA-N	372.808	3.917	50	40	FHGB	
CC[C@@H](C)n1nc(C)c(Cl)c1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2	253401013	MGXQOFHRCFNDRF-OTYXRUKQSA-N	360.845	3.631	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)N/N=C\c1cn(C)c3ccccc13)c(C)n2C	13142460	BWKJLYHWTSAXBJ-FMCGGJTJSA-N	374.444	3.751	50	40	FHGB	
Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)c2ccccc2O)o1	14134750	HACIXQWMUBTNOU-RGVLZGJSSA-N	365.345	3.633	50	40	FHGB	
COc1ccc([C@H](O)P(=O)(c2ccccc2)c2ccccc2)cc1OC	2168899	DKBNQYFVQDKKPR-OAQYLSRUSA-N	368.369	3.709	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2Cl)cc1	1603115	PSEPXXHEWWMKIK-KEBDBYFISA-N	366.248	3.589	50	40	FHGB	
O=C(Oc1ccc(/C=N/NC(=O)c2ccco2)cc1)c1cccc(Cl)c1	408755179	PYZAGLRYRSLXAW-CIAFOILYSA-N	368.776	3.916	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)COc2ccccc2C)cc1OCC	408871332	XUERBUVBBZDNFG-HYARGMPZSA-N	370.449	3.712	50	40	FHGB	
CCN(CC)c1ccc(/C=N\NC(=O)COc2cccc(C)c2C)cc1	30838747	UABFZRFUTQEVDC-HMAPJEAMSA-N	353.466	3.679	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)c(Cl)c1)c1cncc(Br)c1	18173277	YAGFDTLFOHQLNC-BLLMUTORSA-N	373.037	3.915	50	40	FHGB	
COc1ccc(-c2ccc(/C=N/NC(=O)c3ccccc3)o2)c([N+](=O)[O-])c1	5513372	CBZZLDGOKMCOOV-UDWIEESQSA-N	365.345	3.627	50	40	FHGB	
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)NC1CC1	2759216	UGVBIQADBUFNNS-GHRIWEEISA-N	354.413	3.725	50	40	FHGB	
CCOC(=O)COc1ccc(/C=C(/C#N)Cn2cnc3ccccc32)cc1	408691616	INTTWLYZEUNLKP-BOPFTXTBSA-N	361.401	3.585	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)cc(Cl)c1O	409048801	UCXINMPUEWYJKW-GQNMFNQTSA-N	350.846	3.721	50	40	FHGB	
O=C(NNc1ncnc2sc3c(c12)CCCC3)c1cccc(Cl)c1	714967	WHVOMFWULHDHBQ-UHFFFAOYSA-N	358.854	3.980	50	40	FHGB	
N#CC1=C(N)OC2=C(C(=O)CCC2)[C@H]1c1cc2ccccc2nc1Cl	804016	XWZFVFZWDLCTBG-INIZCTEOSA-N	351.793	3.703	50	40	FHGB	
C[C@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc(N(C)C)cc1	1092219	WTVPSJCGXTVDMA-PFRBSUFTSA-N	360.461	3.857	50	40	FHGB	
O=[N+]([O-])c1cccc([C@@H](O)P(=O)(c2ccccc2)c2ccccc2)c1	2168893	QLXOWXFKQSJWCJ-IBGZPJMESA-N	353.314	3.600	50	40	FHGB	
CC(=O)NC(=C(Cl)Cl)P(=O)(c1ccccc1)c1ccccc1	3109701	YCRLKVOEFZAGNO-UHFFFAOYSA-N	354.173	3.741	50	40	FHGB	
CC/C(=N\NC(=O)c1ccccc1O)c1cc(Cl)cc(Cl)c1O	6541526	PUBBQOAUBXIWAL-CPNJWEJPSA-N	353.205	3.949	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OCc1cccc(F)c1	6827553	ZOCPGTQMGAGABD-MFOYZWKCSA-N	368.408	3.845	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)c2ccc(C3SCCCS3)cc2)n1	14512967	DYGAQLSVAASKHB-UHFFFAOYSA-N	360.508	3.719	50	40	FHGB	
O=C(CC[C@H](O)c1ccccc1)N/N=C/c1ccc(Cl)cc1Cl	83324980	ODIGWASUIDPOOW-YODDIOPGSA-N	351.233	3.957	50	40	FHGB	
CC/C(=N\NC(=O)CSCc1ccccc1)c1ccc2c(c1)OCCO2	408719787	LIRYOXHCEHTZNB-HEHNFIMWSA-N	370.474	3.622	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)NC(C)C)o2)cc1Cl	408786677	MAKZDQKIQZPKGR-JYRVWZFOSA-N	372.808	3.818	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)c(OC)c1	409110414	VXGQDHZYWMRQJP-PVGUKEHMSA-N	358.463	3.643	50	40	FHGB	
O=C(CNC1CCCCC1)N/N=C/c1ccccc1OCc1ccccc1	409380373	LVDGAWXBYFQGJC-BUVRLJJBSA-N	365.477	3.638	50	40	FHGB	
Cc1ccc(C(C)C)c(OCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])c1	2674755	HZKHJJFVNYVCOS-RGVLZGJSSA-N	355.394	3.556	50	40	FHGB	
Cn1ccnc1SCC(=O)/C(C#N)=C1/Nc2cc(Cl)ccc2S1	104489102	VFNINRJPVGJPBS-UVTDQMKNSA-N	362.867	3.688	50	40	FHGB	
CSc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1	408961849	ONOUCYXNFHJDKB-VCHYOVAHSA-N	355.375	3.827	50	40	FHGB	
CC(=O)[C@@]1(O)[C@H](Cl)C[C@@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@@H]3CC[C@@]21C	1772492809	FCNFDODVDQKBAV-UDCXOBGGSA-N	368.945	3.927	50	40	FHGB	
CC[C@H](Nc1ccc(C)cc1C)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1	654989	CTKHDSSFNLWURH-RONKMWSCSA-N	354.410	3.552	50	40	FHGB	
COc1ccc(/C=N/NC(N)=O)cc1OCc1c(Cl)cccc1Cl	657946	CSPPYKFJJVTPRV-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
N#Cc1ccc(C(=O)N/N=C/c2cccn2-c2ccc(Cl)cc2)c(F)c1	1101278	CKFMNDOTYQMOJS-FSJBWODESA-N	366.783	3.905	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1	4723453	SDSSCPKLCMKECB-YRNVUSSQSA-N	359.769	3.940	50	40	FHGB	
O=C(CN(Cc1ccccc1)Cc1ccccc1)N/N=C/c1ccc(O)cc1	5515948	PDOHNQPFBNOIGE-BUVRLJJBSA-N	373.456	3.545	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccc(F)cc3)o2)cc1	8812140	GLLLNSWPJOQPJD-WSDLNYQXSA-N	366.348	3.636	50	40	FHGB	
N#CC1=C(SCc2ccc([N+](=O)[O-])cc2)NC(=O)C[C@H]1c1cccs1	409136242	SAUNDSSAVJWPNC-CYBMUJFWSA-N	371.443	3.928	50	40	FHGB	
O=C(Cc1ccc(Br)cc1)N/N=C/c1cc(Cl)ccc1O	4735307	CNXLEAMLIQXWDH-GIJQJNRQSA-N	367.630	3.501	50	40	FHGB	
CO[C@H](C(=O)N/N=C(\C)CC(=O)Nc1ccc(Cl)cc1)c1ccccc1	5288805	KNPUDCMVFUKPQM-ZFJBLLOBSA-N	373.840	3.548	50	40	FHGB	
COCCOC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccccc1	6209385	ASQQNIGCSADYRZ-NBVRZTHBSA-N	373.412	3.636	50	40	FHGB	
O=C(N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21)c1ccccc1F	6229360	AEKUWNXJHCNPBP-GFMRDNFCSA-N	373.387	3.507	50	40	FHGB	
Cc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	12851724	MPGUTLMBCSMITB-HNNXBMFYSA-N	363.417	3.768	50	40	FHGB	
N#C/C(=C/c1ccc(F)cc1)c1nnc(NC(=O)c2ccccc2)s1	13115424	WIHQSLYNQRRXMF-UVTDQMKNSA-N	350.378	3.994	50	40	FHGB	
CCCn1ccnc1SCC(=O)/C(C#N)=C1/Sc2ccccc2N1C	97026896	WVVAREZZKWMRBE-GHRIWEEISA-N	370.503	3.932	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)cc1[N+](=O)[O-]	100177051	DGXSHMSRISYRIG-FUIRCSSXSA-N	359.426	3.660	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1cc(Br)c(N2CCCCC2)o1	408864549	XDLYEDXDSDPQHF-FLIBITNWSA-N	353.216	3.502	50	40	FHGB	
CO[C@@H](c1cc2c(cc1Br)OCO2)[C@H](C)Br	1602877	CXJZDLJNUKOMEA-UPONEAKYSA-N	352.022	3.649	50	40	FHGB	
CC(C)[C@H](Br)C(=O)Nc1nnc(-c2ccc(F)cc2)s1	4070334	ZLDKPSXUIRBUQB-JTQLQIEISA-N	358.236	3.702	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)Nc3ccccc3)o2)cc1	58822775	HPFJRUJRWPUMOV-FYJGNVAPSA-N	363.373	3.889	50	40	FHGB	
O=C(N/N=C1/CCn2cccc21)c1cc(-c2ccncc2)nc2ccccc12	96794637	FQVGNLJJNHIZFF-PLRJNAJWSA-N	367.412	3.636	50	40	FHGB	
Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)CNC2CCCCC2)c1C	409370072	KKLZSTKFUSYIEV-ZVHZXABRSA-N	366.509	3.775	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(F)cc2)o1)c1ccc2c(c1)OCO2	45330875	QLSWNXYZRZGBRJ-UFFVCSGVSA-N	352.321	3.578	50	40	FHGB	
N#C/C(=C\c1ccc(OC(=O)c2ccc(Cl)c(Cl)c2)cc1)C(N)=O	83317562	QWLLMTRVRKQGGP-KPKJPENVSA-N	361.184	3.605	50	40	FHGB	
C/C(=N\NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1	5222521	CUJADZLTLXPBOJ-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
O=C(CCl)Nc1cc(-c2nc3ncccc3o2)ccc1Br	226328278	XHHRAVPSCOPETF-UHFFFAOYSA-N	366.602	3.830	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@H]1c1cc(F)ccc1F	987174	SYEGWBLVXAVHPX-ZDUSSCGKSA-N	356.357	3.635	50	40	FHGB	
C[C@]12CCCC[C@H]1[C@@H]2C(=O)N/N=C/c1ccc(-c2ccc(C(=O)O)cc2)o1	1194169	GMECDSONWHNXFI-LAGLJQQHSA-N	366.417	3.921	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl)c1cccnc1	5674075	MYDGKQPJBLSHRL-JZOCJUILSA-N	352.221	3.696	50	40	FHGB	
C=CCOc1ccc(/C=C(\C#N)C(=O)NCCc2ccccc2)cc1OC	7065672	RYIBMBLIDJOFSI-XMHGGMMESA-N	362.429	3.526	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2ccccc2Br)cc1	7068671	FDPLKOHQXBGJTI-GDNBJRDFSA-N	371.234	3.681	50	40	FHGB	
CC(C)(C)C(=O)NNC(=O)NCCC(c1ccccc1)c1ccccc1	32935942	QOLPVLSIKKBBPE-UHFFFAOYSA-N	353.466	3.585	50	40	FHGB	
CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)NC(C)C)o2)cc1	213138112	MJYLCJYJECTKGX-WJDWOHSUSA-N	352.390	3.555	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@H]1c1ccsc1	705783	XBOCHQNTSIPRQJ-HNNXBMFYSA-N	352.415	3.530	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2ccccc2-c2ccccc2)cc1	855739	NMODLZBQQHQNSZ-HZHRSRAPSA-N	360.413	3.891	50	40	FHGB	
Cn1cc(/C=N/NC(=O)CNc2ccc3ccccc3c2)c2ccccc21	1054880	NFXXFCLHFVRJBX-ZMOGYAJESA-N	356.429	3.894	50	40	FHGB	
CC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1	1319306	YWHNMSYJZHVUGD-MQMKENTISA-N	355.394	3.637	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1	1445324	QUSMDBQKBXGSQE-HYARGMPZSA-N	353.466	3.679	50	40	FHGB	
Cc1c(C(=O)NN=C2c3ccccc3-c3ccccc32)nc2ccccn12	3315997	GBTFLARHAWTOPJ-UHFFFAOYSA-N	352.397	3.806	50	40	FHGB	
CC(=O)[C@@]1(O)[C@H](Cl)C[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C	4083352	FCNFDODVDQKBAV-BIFBXPJCSA-N	368.945	3.927	50	40	FHGB	biogenic
COc1ccc(CC(=O)N/N=C(\C)c2ccc3c(c2)CCCC3)cc1OC	4515209	RNZCYSHJCUZAOC-HZHRSRAPSA-N	366.461	3.666	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2nnc(C(C)C)s2)cc1OC	9329446	BPTNAGACLKQKQR-MDWZMJQESA-N	372.450	3.614	50	40	FHGB	
CCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCO3)c1C	13137354	ZHSIOQYUZIMTTH-CXUHLZMHSA-N	351.406	3.789	50	40	FHGB	
COc1cccc(/C=N\NC(=O)c2ccc(Cl)cc2Cl)c1OC	33726185	QSVVABPDMFZYPG-OCKHKDLRSA-N	353.205	3.775	50	40	FHGB	
O=C1S[C@@H](Nc2cccc3ccccc23)C(=O)N1CCBr	36626557	AVHHXOCVNMDBQO-CYBMUJFWSA-N	365.252	3.668	50	40	FHGB	
C=CCOC(=O)C1=C(C)NC(SCC)=C(C#N)[C@H]1c1ccccc1OC	40486418	GTJKBIPJNIWVPW-GOSISDBHSA-N	370.474	3.873	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Br)cn1C)[C@@H]1C[C@@H]1c1ccccc1	98055456	LLPTXZMRYOWKSX-RBXCXTNXSA-N	360.255	3.697	50	40	FHGB	
Cc1ccccc1NC(=O)N/N=C\c1cc(Br)c(N(C)C)o1	408856285	JSYVSEYRCVRFKF-MFOYZWKCSA-N	365.231	3.572	50	40	FHGB	
O=C(CSc1ccc(Cl)cc1)N/N=C/c1ccc(O)c(Cl)c1	409215520	AJNZJHPJLYXBBT-QGMBQPNBSA-N	355.246	3.941	50	40	FHGB	
CN(C)NC(=O)c1cc(-c2ccc(Br)cc2)nc2ccccc12	8032922	FYHXYUJPYCVSGC-UHFFFAOYSA-N	370.250	3.871	50	40	FHGB	
N#CCOc1ccc(/C=N/NC(=O)c2cc3cc(Cl)ccc3o2)cc1	6471914	GSCRDPAYEAADEN-SRZZPIQSSA-N	353.765	3.752	50	40	FHGB	
O=[N+]([O-])c1ccc(NCCSSc2ccccn2)c([N+](=O)[O-])c1	307761631	ZDIDQXPALCSQTL-UHFFFAOYSA-N	352.397	3.750	50	40	FHGB	
CCN(CC)c1ccc(NC(=O)/C(C#N)=C\c2ccc([N+](=O)[O-])cc2)cc1	408773788	XHOIHYMXVJEWIA-SSZFMOIBSA-N	364.405	3.987	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)CSc2ccc(C)cc2)cc1	408860921	INSQQFVXRDYWEA-KGENOOAVSA-N	355.463	3.586	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@@H](C)SCc2ccccc2)ccc1O	831111	WAVZYCWFJOLCTE-MQMKENTISA-N	358.463	3.563	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2)c(Br)cc1O	5720117	NRLKEUJCTPHDDS-GHXNOFRVSA-N	373.206	3.709	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1-c1ccc2ncccc2c1	12929904	VTTILHWEXGOPAK-AFUMVMLFSA-N	369.428	3.801	50	40	FHGB	
Cc1ccccc1C(=O)N/N=C/c1ccc(OC(=O)c2ccccc2)cc1	1458065	GDJRMTISYVELHW-HZHRSRAPSA-N	358.397	3.978	50	40	FHGB	
COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc(F)c(Cl)c2)cc1	102673295	JRTYWGAPALXECG-UVTDQMKNSA-N	366.801	3.738	50	40	FHGB	
BrC[C@H]1CN=C(Nc2ccccc2Br)S1	822695	ZCGOFPRUTCUETF-ZETCQYMHSA-N	350.079	3.727	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	3211501	BXXBIIOHQMWPRR-UDWIEESQSA-N	374.828	3.858	50	40	FHGB	
O=C(N/N=C/c1ccncc1)c1cn(-c2ccccc2)nc1-c1ccccc1	3251370	HIPBYNAQQIGKJO-BUVRLJJBSA-N	367.412	3.698	50	40	FHGB	
O=C(O[C@@H]1CSSC[C@H]1OC(=O)c1ccccc1)c1ccccc1	4013926	NWKNUTLWGCRXGK-HZPDHXFCSA-N	360.456	3.833	50	40	FHGB	
C/C(=N/NC(=O)CCc1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1	13138862	IHEMNQNLXSYQFG-BKUYFWCQSA-N	350.378	3.549	50	40	FHGB	
N#C/C(=C\c1ccc(SCCO)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1	15009036	NQYXDMXBYIPQOD-UKTHLTGXSA-N	366.402	3.620	50	40	FHGB	
O=C(COc1cccc(Cl)c1)N/N=C\c1ccc(Br)cc1	30802299	CGXFFMUCDFCVBU-NVMNQCDNSA-N	367.630	3.632	50	40	FHGB	
Cn1cccc1C(=O)NP(=O)(N1CCCCCC1)N1CCCCCC1	102133585	UYIFXYOJEVNTKF-UHFFFAOYSA-N	366.446	3.615	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N\NC(=O)c3ccccc3O)o2)cc1[N+](=O)[O-]	408866678	HWZFZNVZVTXMDR-JAIQZWGSSA-N	365.345	3.633	50	40	FHGB	
CC(=O)NC(C#N)=C(Sc1ccc(N)cc1)Sc1ccc(N)cc1	526052184	CBSQZORCNVZQAT-UHFFFAOYSA-N	356.476	3.564	50	40	FHGB	
O=C(CCc1ccccc1)NNC(=O)COc1ccc(-c2ccccc2)cc1	2618812	ZXYHONIXQVTPJA-UHFFFAOYSA-N	374.440	3.513	50	40	FHGB	
COc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1Cl	804204	LWVYTNRWIWRGSA-INIZCTEOSA-N	358.825	3.799	50	40	FHGB	
CCCc1ccc(/C=N/NC(=O)c2cc(Br)ccc2OC)o1	8812975	HLFCMUNZKHPHNN-VCHYOVAHSA-N	365.227	3.767	50	40	FHGB	
N#CS[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1	3201181	SUPFUWVTWNBJEG-HNNXBMFYSA-N	352.868	3.574	50	40	FHGB	
C#C/C=C/C[C@@H](OC(C)=O)[C@H]1C/C=C/C[C@@H](Br)[C@@H](CC)O1	101043582	ZFYWONYUPVGTQJ-FDHAWTECSA-N	355.272	3.775	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C/c2c(OC)ccc3ccccc23)cc1	10475851	JULCMQQEAJBCQD-HZHRSRAPSA-N	362.429	3.940	50	40	FHGB	
N#C/C(=C/C=C/c1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cc1	2652972	HSKJPWWSEZFGIC-LLLGHMJXSA-N	359.429	3.625	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)NCc1ccccc1)O[C@H](C)C2	13137659	ATKGEZUQYNVPNY-GDXCHIGESA-N	362.429	3.632	50	40	FHGB	
Cc1nc(SCC(=O)C(C#N)=C2Nc3ccccc3N2)c2ccccc2n1	4241798	NWBXLLJNKFULQR-UHFFFAOYSA-N	373.441	3.872	50	40	FHGB	
COc1ccc(OC)c([C@@H]2[C@H]3C[C@H](C)CC=C3C(C#N)=C(N)C2(C#N)C#N)c1	4631521	NRWDKGSHVNWVQS-PSGMQZRDSA-N	374.444	3.543	50	40	FHGB	
CO[C@@H](C(=O)N/N=C(\C)c1ccc(Br)cc1)c1ccccc1	5282503	XDXMZEIWNIHLQO-PUMYGXPMSA-N	361.239	3.677	50	40	FHGB	
CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1OCC	8916583	RHYYPNRBEGUGOT-FQEVSTJZSA-N	366.417	3.798	50	40	FHGB	
Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1	989059	IVFOSTAVTWMVPY-LJQANCHMSA-N	360.392	3.846	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)Cc2ccc(OCC)cc2)cc1OC	10475967	AWKXOQTVIGUSBH-PXLXIMEGSA-N	370.449	3.576	50	40	FHGB	
N#CCn1cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)c2ccccc21	408676320	HMGCBYWWCBYYAE-BUVRLJJBSA-N	371.444	3.529	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)cc1OC	409114000	PEXWXSAUHFLSBQ-PVGUKEHMSA-N	358.463	3.643	50	40	FHGB	
CSc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1	15225913	SWKUBROTQXLBCR-SDXDJHTJSA-N	363.486	3.664	50	40	FHGB	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc([N+](=O)[O-])s1	1445114	RPMTYOOWXQHVSN-ZGXHQARYSA-N	369.402	3.727	50	40	FHGB	
CCOC(=O)c1sc(NC(=O)c2ccc(C#N)cc2)c(SC#N)c1C	7345694	IQMBNJNEQWLVBN-UHFFFAOYSA-N	371.443	3.930	50	40	FHGB	
CC(=O)Nc1cccc(/C(C)=N/NC(=O)[C@H](C)Sc2ccccc2)c1	831070	DCQIEHDFFRRMCT-HADWXUJASA-N	355.463	3.666	50	40	FHGB	
COc1ccc(Br)c(/C=N/NC(=O)c2ccc(Cl)cc2)c1	3174953	ZPXNPRYRPXGXRH-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)c1ccc2c(c1)OCO2	3474936	DYXKHWYDALYAIR-YDZHTSKRSA-N	374.396	3.758	50	40	FHGB	
COc1ccccc1/C(C)=N/NC(=O)CSc1nc2ccccc2s1	4535884	PTJMPHWGIHHAOC-UDWIEESQSA-N	371.487	3.937	50	40	FHGB	
CCC(=O)NNc1nc(SC)nc2sc3c(c12)C[C@@](C)(CC)OC3	5266679	RBIYOOPQVCAVMH-MRXNPFEDSA-N	366.512	3.508	50	40	FHGB	
N#C/C(=C\c1c[nH]c2ccccc12)c1nn(-c2ccccc2)c(N)c1C#N	408720807	DNHBVIKROYHDHW-GXDHUFHOSA-N	350.385	3.872	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2cc3ccc(OC)cc3nc2Cl)cc1	408728138	IADPLSHMZRVBGZ-SRZZPIQSSA-N	369.808	3.669	50	40	FHGB	
CC(=O)Oc1cccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)c1	408759563	HDOXCQNIIGKJED-DJKKODMXSA-N	351.189	3.683	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(N3CCCC3)cc2C)cc1C	408959660	CRWDKDPIOFWVAZ-ZVHZXABRSA-N	364.493	3.774	50	40	FHGB	
C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(N2CCCCC2)o1	409001465	WCCKCFPZAMZWBI-NPQOUYBPSA-N	357.479	3.901	50	40	FHGB	
CCOc1cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)ccc1OCC(=O)O	409046156	JDACXCWUEFDFTF-DHDCSXOGSA-N	368.345	3.521	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)NC2CCCCC2)cc1Br	862409	OKEVLHGJVPDWFD-UKTHLTGXSA-N	363.255	3.814	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)NCc2ccc(Cl)cc2)ccc1O	3247353	CGZDJAWZXSVLPR-OQLLNIDSSA-N	356.809	3.668	50	40	FHGB	
O=C(Cc1ccccc1)NNC(=O)c1sc2cc(F)ccc2c1Cl	12745514	UIJRIYYAYXJXRG-UHFFFAOYSA-N	362.813	3.698	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2ccc(OCC)c(OCC)c2)cc1	20763908	AXTABCIRUCGQPO-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
N#C/C(=C\c1cc2cccc3c2n(c1=O)CCC3)c1nc2ccccc2[nH]1	36625730	MFYMINRGZAIRER-SFQUDFHCSA-N	352.397	3.888	50	40	FHGB	
N#C/C(=C1/Nc2ccccc2S1)c1ccnc(NCCc2cccnc2)n1	96032364	AVLYNJZZQYEFEA-XDJHFCHBSA-N	372.457	3.936	50	40	FHGB	in-vivo
C/C(=N\NC(=O)Nc1ccccc1C)c1ccc(N2CCCC2=O)cc1	98054897	HDCUTYSUTCDJCG-PXLXIMEGSA-N	350.422	3.668	50	40	FHGB	
C=CCn1cc(/C=N/NC(=O)COc2c(C)cccc2C)c2ccccc21	408910648	IWCFZGNGALSSRG-YDZHTSKRSA-N	361.445	3.973	50	40	FHGB	
CC(C)Oc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(=O)oc1ccccc21	663570	MFVYQEAPUQYMMS-SFHVURJKSA-N	374.396	3.798	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/c2ccsc2)cc(OCC)c1OCC	695275	KNTYABUYXHUAFM-YBFXNURJSA-N	362.451	3.708	50	40	FHGB	
CC(C)(C)OC(=O)N/N=C/c1cccc(OC(=O)/C=C/c2ccco2)c1	2297514	GWYPAWZQJIFVDB-RUWBGJHDSA-N	356.378	3.757	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C\c2cc(Cl)ccc2O)cc1OCC	6355599	VXZSZRFGLRFOIJ-JAIQZWGSSA-N	362.813	3.607	50	40	FHGB	
O=C(Oc1ccc([N+](=O)[O-])cc1)c1nn(-c2ccc(F)cc2)c2c1CCC2	11326932	UHWATPCFRXRTRQ-UHFFFAOYSA-N	367.336	3.628	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)c2cc3ccccc3o2)cc(Cl)c1O	408852692	VRDHIXYTYKPMHW-JMIUGGIZSA-N	358.781	3.954	50	40	FHGB	
COc1ccc(/C(C)=N\NC(=O)c2cc(-c3ccc(C)s3)n[nH]2)cc1	12462538	QXZBFUYZCMVZNQ-UNOMPAQXSA-N	354.435	3.609	50	40	FHGB	
N#C/C(=C\c1cn(Cc2ccc([N+](=O)[O-])cc2)c2ccccc12)C(N)=S	9235170	WDOQYIFJXOAFGJ-NTEUORMPSA-N	362.414	3.791	50	40	FHGB	
CCOc1ccc(-c2n[nH]c3c2[C@H](c2cccs2)C(C#N)=C(N)O3)cc1	4453080	ORUUXFXKHJBTRQ-HNNXBMFYSA-N	364.430	3.755	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)cc2Cl)o1	4515096	YMPYAFYENVFUTQ-DHZHZOJOSA-N	365.216	3.923	50	40	FHGB	
O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1ccc(-c2ccc(F)cc2)o1	16429464	CJQSYQFYGYNGPF-SSDVNMTOSA-N	366.348	3.507	50	40	FHGB	
CCOc1ccc2ccc(OCC)c(/C=N\NC(=O)c3cccnc3)c2c1	409007936	RZGHPYSUBDDGDB-UCQKPKSFSA-N	363.417	3.796	50	40	FHGB	
N#CC(Nc1ccc(Br)cc1)=C1C(=O)c2ccccc2C1=O	959633	VCADDQQHNYVEFQ-UHFFFAOYSA-N	353.175	3.718	50	40	FHGB	
COC(=O)[C@]1(C)CCC[C@@]2(C)c3cc(OC)ccc3C(=O)[C@@H](Cl)[C@@H]12	5004486	CAQCHCCVWVJUGY-SKWUIDRYSA-N	350.842	3.736	50	40	FHGB	
O=C(N/N=C/c1ccc(OC(F)F)cc1)c1cc2ccccc2cc1O	6566588	WBSNUUQHAWMNSK-SSDVNMTOSA-N	356.328	3.911	50	40	FHGB	
Cc1ccc2[nH]c(=O)c(CN(Cc3ccccc3)C(=O)CCl)cc2c1	13998737	KLMBITNRFKHJIU-UHFFFAOYSA-N	354.837	3.604	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(C(=O)O)c(Cl)c3)o2)o1	14407499	FVYNZUYKBRNYNZ-AWQFTUOYSA-N	372.764	3.964	50	40	FHGB	
CCOC(=O)c1ccc2nc(NC(=O)[C@H](Br)CC)sc2c1	20132434	UTAQNKKEVUKTNC-SECBINFHSA-N	371.256	3.585	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc3ccccc3c2)ccc1OC(C)=O	54883649	JRSPWCVYPXVUFV-LPYMAVHISA-N	362.385	3.538	50	40	FHGB	
C#CCn1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c2ccccc21	408541510	CYDDIGDXYHMEHQ-WJDWOHSUSA-N	369.380	3.518	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)c2ccc(OC)c(OC)c2)cc1C(=O)O	408579521	HHMCZNFDUBJFKI-OQLLNIDSSA-N	353.374	3.865	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc3cc([N+](=O)[O-])ccc3nc2Cl)cc1	408728196	JBVDXLXIOYMWSG-KEBDBYFISA-N	368.780	3.869	50	40	FHGB	
CC(C)(C)c1ccc(C(=O)NNC2=CC(=O)C[C@H](c3ccco3)C2)cc1	408751283	ABXPVUOCJUGIFF-OAHLLOKOSA-N	352.434	3.842	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc(Cl)c1O	2744411	PKEMMCONKUHAAC-KEBDBYFISA-N	367.232	3.791	50	40	FHGB	
C=CCOc1ccc(/C=N\NC(=O)c2ccc(OCCC)c(OC)c2)cc1	409327444	UBXGPOIGRBUGEY-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
CC(C)Oc1ccc2ccccc2c1/C=N/NC(=O)CNC1CCCCC1	409381105	FABYTXURKGFXAZ-ZVHZXABRSA-N	367.493	3.999	50	40	FHGB	
Cc1cc(C)cc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2)c1	409089700	PATLQQBFBYJGJN-RGEXLXHISA-N	361.445	3.686	50	40	FHGB	
C/C(CC(C)(C)c1ccccc1)=N\NC(=O)[C@@H]1COc2ccccc2O1	33601742	RVLKDOCVGNZZMB-OMNSNBSWSA-N	352.434	3.686	50	40	FHGB	
CCc1ccccc1NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C	15423194	YRYGITXFXJFLGF-HNNXBMFYSA-N	369.303	3.503	50	40	FHGB	
CCCc1nc2c(o1)NC(N)=C(C#N)[C@@H]2c1ccc(OC(C)C)c(OC)c1	1070301	ZETPPKYKZKQWBS-KRWDZBQOSA-N	368.437	3.674	50	40	FHGB	
Cn1cc(C(=O)N/N=C/c2cccc(Br)c2)c2ccccc21	1293866	FEUXVPPSUWONJF-VXLYETTFSA-N	356.223	3.705	50	40	FHGB	
Cc1oc(C)c2c(=O)ccc3c(c12)OC(N)=C(C#N)[C@H]3c1cccs1	5427567	VAKAKLFHKPVLAG-KRWDZBQOSA-N	350.399	3.690	50	40	FHGB	
CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccccc1Cl)c1ccccc1	408977622	DYTCAMAFQQVFOD-VYVDHXHBSA-N	373.840	3.668	50	40	FHGB	
CC(C)(C)C(=O)OC(=O)NCc1ccc(C(=O)OCc2ccccc2)cc1	616581120	XEYLOKQMELVWEJ-UHFFFAOYSA-N	369.417	3.843	50	40	FHGB	
Cn1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(-c2ccccc2)n1	253408356	XNQOBEBFKCLQBZ-GOSISDBHSA-N	374.444	3.538	50	40	FHGB	
CCOC(=O)N[C@@H](CC(=O)N/N=C/C=C/c1ccccc1)c1ccccc1	6594962	CPYNRPQIIQNQDH-OSDPEZGMSA-N	365.433	3.679	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(Cl)c1	5381574	DXMYERWFOFUSPH-VXLYETTFSA-N	366.204	3.985	50	40	FHGB	
COc1ccccc1NCC(=O)N/N=C\c1c(Cl)cccc1Cl	4711914	JEOIOIOMLJTWLB-UKWGHVSLSA-N	352.221	3.564	50	40	FHGB	
C/C(=N\NC(=O)COc1cc(Cl)c(Cl)cc1Cl)c1cccnc1	15938755	AKGOEAHQPJTPQT-AWQFTUOYSA-N	372.639	3.961	50	40	FHGB	
CCN(CC)Cc1cc(/C(C)=N/NC(=O)c2ccc(F)cc2)ccc1OC	7894233	SJDHPGZEUUAJIZ-HZHRSRAPSA-N	371.456	3.830	50	40	FHGB	
Cc1ccc(SCCC(=O)N/N=C2\C(O)=Nc3ccc(F)cc32)cc1	8507459	UVGUMPKCUFCUQQ-UHFFFAOYSA-N	357.410	3.738	50	40	FHGB	
Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)CC(C)C)cc2)cc1	20244083	VLBWSCGLKCWKLF-LPYMAVHISA-N	367.449	3.509	50	40	FHGB	
Cc1ccc(C(=O)O)cc1-c1ccc(/C=C(/C#N)C(=O)NC2CCCC2)o1	409188807	APSILXCKYSFHFP-GDNBJRDFSA-N	364.401	3.919	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)c1ccco1	8043668	FFUFCNWMYJIXJH-GIJQJNRQSA-N	359.725	3.865	50	40	FHGB	
N#C[C@]1(c2ccccc2)O[C@H](C(=O)c2ccccc2)C[C@@H]1Br	1670381	RABTWZKKSGXMPG-XYJFISCASA-N	356.219	3.841	50	40	FHGB	
Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=N/NC(=O)c1cccs1	2645431	GUSHJJVGBUVCGT-DJKKODMXSA-N	362.817	3.799	50	40	FHGB	
N#C/C(=C\c1ccc(F)cc1)c1nnc(NC(=O)c2ccccc2)s1	4478128	WIHQSLYNQRRXMF-GXDHUFHOSA-N	350.378	3.994	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(OCCOc2cccc(OC)c2)cc1	4677306	FEHDVYOIVIBLGO-GHRIWEEISA-N	367.401	3.623	50	40	FHGB	
Cc1ccc(/C=N\NC(=O)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-]	408973546	UEKKPPDXIOXXFN-LSCVHKIXSA-N	352.177	3.974	50	40	FHGB	
C#CCOc1ccc(OC)cc1/C=N/NC(=O)c1ccc2ccccc2c1	408598955	LYHAJJAILAZBIV-HZHRSRAPSA-N	358.397	3.624	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)c2c[nH]c3cc(F)ccc23)cc(OC)c1O	40139923	IBKITDHTXOFTEI-LFYBBSHMSA-N	366.348	3.820	50	40	FHGB	
Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)[C@H](C)Cc1ccccc1	655600	CNLKSJNWIMFFAA-LGVXEURYSA-N	360.461	3.818	50	40	FHGB	
N#C/C(=C\c1cccc(C(F)(F)F)c1)C(=O)Nc1ccccc1C(=O)O	4670348	PQBCAENWDWSICB-XYOKQWHBSA-N	360.291	3.949	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)COc2cc(C)c(Cl)c(C)c2)cc1	5593027	HKMOWKGLYLLENP-SRZZPIQSSA-N	360.841	3.885	50	40	FHGB	
CNc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-]	35353009	QAPKUUTXJJKBFX-WQLSENKSSA-N	356.769	3.836	50	40	FHGB	
O=C(Cl)[C@@H]1CC(=O)N(c2ccc3oc(-c4ccc(F)cc4)nc3c2)C1	57327094	FUEKRQMXCQYQCL-LLVKDONJSA-N	358.756	3.752	50	40	FHGB	
CCN(CC)C(=O)/C(C#N)=C\c1cc(C)n(-c2cccc([N+](=O)[O-])c2)c1C	408771313	FTUJZEGUXHJBML-BOPFTXTBSA-N	366.421	3.778	50	40	FHGB	
Cc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc(F)c2)cc1	994549	FSIDBHVQYGMTHD-IBGZPJMESA-N	360.392	3.846	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1cc2c(cc1Cl)OCO2	2270440	FJJHQQFVGWFXRE-MRXNPFEDSA-N	372.808	3.520	50	40	FHGB	
N#CC1=C(SCc2ccc(C#N)cc2)NC(=O)[C@@H](C#N)C12CCCCC2	3418707	PFBCIJMUYCDQNT-MRXNPFEDSA-N	362.458	3.747	50	40	FHGB	
Cc1ccc(C)c(C(=O)COC(=O)/C(C#N)=C/c2ccc(N(C)C)cc2)c1	5229497	OIPPUZFPZTUELE-LDADJPATSA-N	362.429	3.703	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CC[C@H](C)C2)[C@@H]1c1ccccc1	221956029	SPSUTBNAUGSSCK-DVXDUOKCSA-N	361.445	3.710	50	40	FHGB	
CCN(CC)c1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1[N+](=O)[O-]	5322046	QFCNCGFZYAQODK-LJQANCHMSA-N	364.405	3.659	50	40	FHGB	
CCOC(=O)/C(C#N)=C1\C=C(c2ccc(OC)cc2)Oc2ccc(O)cc21	31857588	KAWLPCHQIQAVIQ-FBMGVBCBSA-N	363.369	3.675	50	40	FHGB	
O=C(CNc1ccc(Cl)cc1)N/N=C/c1c(O)ccc2ccccc12	3101152	IBXGFJYGKYTBIR-SSDVNMTOSA-N	353.809	3.761	50	40	FHGB	
O=C(NNC(=S)Nc1cccc(Cl)c1)C12CC3CC(CC(C3)C1)C2	4550624	PCNQKNKPNBZUSO-UHFFFAOYSA-N	363.914	3.874	50	40	FHGB	
N#C/C(=C\c1cccn1-c1cccc(C(=O)O)c1)C(=O)NC1CCCCC1	4675092	FIMBOBONWZNRMO-DTQAZKPQSA-N	363.417	3.531	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(C)cc1)c1ccc(Br)cc1	5341625	DBHLAYWVULNTCW-CPNJWEJPSA-N	361.239	3.677	50	40	FHGB	
N#CC1=C(N)Oc2ccc3ccc(=O)oc3c2[C@H]1c1ccc(Cl)cc1	5945450	CXLATDWSPLCOAR-INIZCTEOSA-N	350.761	3.665	50	40	FHGB	
CCOc1ccc(C=NNC(=O)c2c(C)n(C)c3ccc(OC)cc23)cc1	15985428	FLCFDRASWJPVHY-UHFFFAOYSA-N	365.433	3.658	50	40	FHGB	
Cc1n[nH]c2c1[C@@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2	18136752	ZKTHCAUSYMRRLA-IBGZPJMESA-N	358.401	3.515	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2C)cc1OC	408796914	QJHBNADIEDOMMG-LDADJPATSA-N	360.413	3.870	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccccc2OC(=O)c2ccccc2)cc1	726361	HUBAEXWISQLQPN-HZHRSRAPSA-N	358.397	3.978	50	40	FHGB	
COc1ccccc1/C=C(\C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	2774388	DPEMCSPXRVZGHR-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
CCCCCC[C@@H]1/C(=N\NC(=O)Cc2ccccc2)CC[C@@H]1C(=O)OC	5184957	KQXIKFNFOVCXOR-DZCBIVISSA-N	358.482	3.871	50	40	FHGB	
Cc1csc(/C(C#N)=C/c2ccccc2OCC(=O)N2CCCC2)n1	8753793	QDDQMVCGXNKGAK-MHWRWJLKSA-N	353.447	3.517	50	40	FHGB	
C=CCOc1c(Br)cc(/C=C(\C#N)C(N)=S)cc1OCC	408542549	JOHUZEJICWVJND-IZZDOVSWSA-N	367.268	3.606	50	40	FHGB	
CCOc1cc(C(=O)NN)ccc1OCc1ccc(Cl)c(Cl)c1	226318499	PUUDJPGQXPEBTR-UHFFFAOYSA-N	355.221	3.575	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@]1(C(=O)Nc1ccccc1)[C@H](Br)C2=O	100868221	JLKGVIGPYYRFHH-CSMYWGQOSA-N	350.256	3.784	50	40	FHGB	
Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1	989052	KJEVULZDYBGWIC-IBGZPJMESA-N	360.392	3.846	50	40	FHGB	
COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]1CC[C@@]13OO[C@@H](C[C@H]21)[C@@]1(C(C)C)O[C@H]13	104133759	JXEACGHXWMSLSW-VBNFAEQJSA-N	364.482	3.649	50	40	FHGB	
N#CC1=C2SCN(c3ccccc3)CN2C(=O)C[C@H]1c1cccs1	2346827	MQCAXPORVOCTBZ-CQSZACIVSA-N	353.472	3.968	50	40	FHGB	aggregator
CC(C)COc1ccc(Cl)cc1/C=C(\C#N)C(=O)NC[C@@H]1CCCO1	6827226	WNHJYYFBEPQOKQ-BXUGYJKXSA-N	362.857	3.577	50	40	FHGB	
O=C(NNC(=O)c1cc(C2CC2)nc2ccccc12)c1ccccc1Cl	7913159	HLSWKFFTXFGAQS-UHFFFAOYSA-N	365.820	3.840	50	40	FHGB	
Cc1[nH]c2ccccc2c1/C=N\NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1	408904447	JOVOLDLLEZGFLX-JMIUGGIZSA-N	362.345	3.895	50	40	FHGB	
O=C1Nc2ccccc2C1=NNC(=O)c1cc2c(ccc3ccccc32)o1	409222905	FDFTUDIVPDUTLR-UHFFFAOYSA-N	355.353	3.672	50	40	FHGB	
COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cc2C)cc1	408811948	MFPVVXYKCUWQSG-XNTDXEJSSA-N	354.793	3.981	50	40	FHGB	
O=C(COc1cccc2ccccc12)N/N=C\c1ccc(N2CCCC2)o1	408854050	WJLRHCMQVBIOJY-HMAPJEAMSA-N	363.417	3.562	50	40	FHGB	
O=C(N/N=C\c1cc2ccccc2nc1Cl)c1ccc([N+](=O)[O-])cc1	33151417	XUFATMOLAGTNKU-GRSHGNNSSA-N	354.753	3.560	50	40	FHGB	
CC(C)C1=CC(=O)[C@](C)(Cl)[C@H](Cl)/C1=N/S(=O)(=O)c1ccccc1	5522474	DWZUIUHHYJXENG-AKOCJZKKSA-N	374.289	3.586	50	40	FHGB	
C=CCc1cccc(/C=N/NC(=O)[C@@H](CC)Nc2ccccc2C)c1O	2742828	MTCBXMQGZHVNCP-SDLXJUDFSA-N	351.450	3.770	50	40	FHGB	
O=C(N/N=C\c1cccn1-c1ccc(Br)cc1)c1ccco1	408853629	VLUCOUZIFCLTMR-WQRHYEAKSA-N	358.195	3.597	50	40	FHGB	
Cc1ccc(N(/N=C/c2cccc(C(=O)O)c2)C(=O)C(F)(F)F)c(C)c1	96028441	YPCOBSWQCXGVEZ-LSHDLFTRSA-N	364.323	3.931	50	40	FHGB	
O=P(c1ccccc1)(c1ccccc1)N1CCN(c2ccccc2)CC1	98042779	FIWVDOMYYMRQQE-UHFFFAOYSA-N	362.413	3.738	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@H]2C[C@@H]3C[C@H](CBr)[C@@H]2C3)cc1	100017642	SSOHWXRVPHYKLJ-UXOAXIEHSA-N	359.285	3.510	50	40	FHGB	
Cc1c(/C=N/NC(=O)COc2ccccc2Cl)c2ccccc2n1C	4702589	RUUBSBVULXESDF-SRZZPIQSSA-N	355.825	3.669	50	40	FHGB	
O=C(NNC(=O)c1ccccc1)N[C@@H](c1ccc(F)cc1)c1cccs1	45127879	BXOSYLLQMCRDIC-KRWDZBQOSA-N	369.421	3.621	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)c2cc3ccccc3cc2O)c1O	5725854	XRTPYOGEMXSRLP-LPYMAVHISA-N	362.385	3.580	50	40	FHGB	
C[C@@H](Br)C(Br)(Br)CBr	59796745	KAMLVOUBGNUKHA-GSVOUGTGSA-N	373.708	3.651	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccccc2C(=O)O)c(C)n1-c1ccccc1	3282484	RGTVOPQAKZLUGV-LPYMAVHISA-N	361.401	3.556	50	40	FHGB	
N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3\C[C@@H]4C=CC[C@H]34)cc2)cc1	20791458	HXGHNTSONLLCSQ-LRJFRGPBSA-N	357.413	3.672	50	40	FHGB	
Cc1cccc(/C=N/NC(=O)COc2ccc(C3CCCCC3)cc2)n1	59484702	DDJIEPMQXIAYJC-HYARGMPZSA-N	351.450	3.967	50	40	FHGB	
CCn1c(SCC(=O)N/N=C/C=C/c2ccco2)nc2ccccc21	13496712	PPHVBWSUSWHLMJ-SPJXWURQSA-N	354.435	3.557	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C/c1cc(Cl)cc(Br)c1O	4702544	LZNPZEDTLHAIHP-GIJQJNRQSA-N	367.630	3.501	50	40	FHGB	
CC(C)COC(=O)NCCC(=O)NN(c1ccccc1)c1ccccc1	409000450	WNQHXAXAEISSKD-UHFFFAOYSA-N	355.438	3.628	50	40	FHGB	
Cc1c(C(=O)O)cccc1-n1c(C)cc(/C=C(/C#N)C(=O)NC(C)C)c1C	408785800	CAOMJISDJIXAIX-YVLHZVERSA-N	365.433	3.532	50	40	FHGB	
CCOc1cc(C(=O)NN)cc(Cl)c1OCc1ccccc1Cl	216836775	OMVMXMQQSHEYEK-UHFFFAOYSA-N	355.221	3.575	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/C(Br)=C/c2ccccc2)cc1	2895578	DPRYLGHIRHBNOD-ULQIOQDBSA-N	373.250	3.912	50	40	FHGB	
CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1OC	4168360	APHTTZKUDFBGPD-GOSISDBHSA-N	368.437	3.514	50	40	FHGB	
C[C@]1(Br)C[P@@](=O)(c2ccccc2)C[C@@H]1Br	4777440	WLMNWAODWCNVJT-ZIBATOQPSA-N	352.006	3.606	50	40	FHGB	
Cc1ccc([C@@H](Br)[C@H](Br)C(=O)[C@]2(C)CO2)cc1	4953597	PQHOXCGXAACSQA-MDZLAQPJSA-N	362.061	3.553	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2ccc3c(c2)CN(c2ccccc2)C3)cc1	33913243	CHKUCXKEADSVLL-OYKKKHCWSA-N	371.440	3.979	50	40	FHGB	
CC(C)Oc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1	44023851	YNDXAZWREABFDU-LFIBNONCSA-N	350.374	3.718	50	40	FHGB	
C[C@@]12CO[C@]3(P(c4ccccc4)c4ccccc4)C(=O)[C@]1(C)CC[C@@H]23	100746572	VVUKNXGGDLPMKO-JKLQHZFJSA-N	350.398	3.851	50	40	FHGB	
CCc1c(OC)ccc(/C=N/NC(=O)CSCc2ccccc2)c1OC	408719811	MECATYIAINQPAZ-CIAFOILYSA-N	372.490	3.650	50	40	FHGB	
Cc1ccc(C)c(NC(=O)CCC(=O)N/N=C2\CCCc3ccccc32)c1	671324	HKDLDIRSELQWEH-LYBHJNIJSA-N	363.461	3.879	50	40	FHGB	
COc1cc(/C=C(\C#N)S(=O)(=O)c2ccccc2)ccc1OC(C)C	948070	QWYIZIJSLIMABM-GZTJUZNOSA-N	357.431	3.821	50	40	FHGB	
CCOc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(C)cc2C)cc1	4691405	XSDQTXLSJOAIIQ-HYARGMPZSA-N	367.449	3.571	50	40	FHGB	
O=C(COc1ccc(Br)c2ccccc12)N/N=C\c1ccco1	4724234	GUHXISKYNQSFOG-GRSHGNNSSA-N	373.206	3.724	50	40	FHGB	
CCCCCCC(/C=C/c1ccc(Cl)c(Cl)c1)=N/NC(=O)C(N)=O	5640240	KNMKBQAECHDPAT-ZOYVTTDVSA-N	370.280	3.935	50	40	FHGB	
O=C(Cn1c2ccccc2c2ccccc21)N/N=C/c1ccccc1C(=O)O	5799643	ONSPTGOPFSGZIO-YDZHTSKRSA-N	371.396	3.643	50	40	FHGB	
CC(C)c1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1	102090693	PXKBONKGHLPZQJ-SFHVURJKSA-N	370.408	3.951	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(OC)c([N+](=O)[O-])c2)cc1	171752786	GFOCXXDZHFIQQG-UVTDQMKNSA-N	367.361	3.548	50	40	FHGB	
CN(C)c1cccc(C(=O)N/N=C/c2ccc(N3CCCCC3)cc2)c1	408960550	MRZAZJPEKWNBGO-CJLVFECKSA-N	350.466	3.507	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(N4CCCC4)o3)cc2c1	409187732	UGEREBDRWQIOKF-BKUYFWCQSA-N	367.405	3.789	50	40	FHGB	
C=CCn1cc(/C=N/NC(=O)CNc2ccc(F)cc2)c2ccccc21	409362061	RTBVUCQOINKBQM-FSJBWODESA-N	350.397	3.529	50	40	FHGB	
Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)c2cccs2)o1	12364135	KOPKPKBJCUFIDI-VXLYETTFSA-N	354.387	3.779	50	40	FHGB	
COc1cc(OC)cc(C(=O)N/N=C\c2ccc(Cl)c(Cl)c2)c1	35790795	IGHVTGDLYILDTB-OCKHKDLRSA-N	353.205	3.775	50	40	FHGB	
CCOC(=O)[C@H](C)[PH](c1ccccc1)(c1ccccc1)c1ccccc1	104141043	ANSSRUHZDLNVIJ-IBGZPJMESA-N	364.425	3.664	50	40	FHGB	
CC1(C)COc2ccc(C(=O)N/N=C\c3ccccc3Cl)cc2OC1	225368228	KPGGOHMYLSYDDO-FBHDLOMBSA-N	358.825	3.901	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CSc2ccccc2)cc1OC	408867770	NJNVNHAHZHRYRL-DEDYPNTBSA-N	356.447	3.502	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1Cl	408905255	VZVOPVDHQYFTCM-OCKHKDLRSA-N	373.752	3.767	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)CCc1ccccc1	408957814	WGLFGLYBZXRNMN-JJIBRWJFSA-N	356.425	3.935	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccccc2Br)cc1Cl	4827363	SMANVPFJVAUMGC-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
CC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1	1319298	MOCZMPDFHIOIFO-MQMKENTISA-N	355.394	3.637	50	40	FHGB	
O=C(CSCc1ccccc1Cl)N/N=C/c1cccc([N+](=O)[O-])c1	20248860	HRDGOISAZVDLAX-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
O=C(NN(c1ccccc1)c1ccccc1)[C@@H]1CC(=O)N(C2CCCC2)C1	58391181	ARHVKGGETVGWMW-QGZVFWFLSA-N	363.461	3.647	50	40	FHGB	
CCN(CC)c1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)cc1	2776489	SPUWWNADMNGQSJ-DTQAZKPQSA-N	363.417	3.777	50	40	FHGB	
COc1cc(/C=C(\C#N)Sc2nc3ccccc3[nH]2)cc([N+](=O)[O-])c1O	408598687	IJZVLQZEVSLUJP-IZZDOVSWSA-N	368.374	3.842	50	40	FHGB	
COc1cc(N2CCCCC2)ccc1/C=N/NC(=O)c1ccccc1F	409230800	GSOQTQATXQRHFQ-HYARGMPZSA-N	355.413	3.589	50	40	FHGB	
NNC(=O)c1cc(Cl)c(OCc2ccc(F)cc2Cl)c(Cl)c1	226322147	WMEKDCPFRZQRFR-UHFFFAOYSA-N	363.603	3.968	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)COc2ccc([C@@H](C)CC)cc2)ccc1O	1319670	OKNDKMYAEXFGMN-NSMHLIOHSA-N	370.449	3.834	50	40	FHGB	
O=C(N/N=C/c1cc([N+](=O)[O-])ccc1Cl)c1ccc(N2CCCC2)cc1	7384084	SGSRPYKHACRGBW-UDWIEESQSA-N	372.812	3.612	50	40	FHGB	
COc1cccc(OC)c1/C=N/NC(=O)c1ccc(Cl)cc1Cl	6583709	UTSOEUPRUAWTDG-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc3ccccc3c2)cc(Cl)c1O	52410930	JVPAHDSHHZFWAG-SRZZPIQSSA-N	354.793	3.971	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)ccc1OC	409220883	HHGHWGPDOVWCEK-RGEXLXHISA-N	364.445	3.750	50	40	FHGB	
N#C/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)c1n[nH]c(=O)c2ccccc12	5269008	CJJGREXOMMYKIM-YRNVUSSQSA-N	352.737	3.549	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2c(Cl)cccc2Cl)sc(N)c1C#N	5921392	FKGUQRNUMTZRKQ-KPSZGOFPSA-N	353.234	3.581	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C(/c1ccccc1)c1ccncc1	18192283	HJVAUPVAMDQBDB-FLFQWRMESA-N	361.470	3.884	50	40	FHGB	
Cc1ccc(SCC(=O)NNc2c(F)c(F)c(F)c(F)c2F)cc1	15975361	FADBBIVOVBAMAE-UHFFFAOYSA-N	362.323	3.926	50	40	FHGB	
COc1cc(OC)cc(C(=O)N/N=C/c2c(Cl)cccc2Cl)c1	5512179	KFEBFKGICDHJOD-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)cc1[N+](=O)[O-]	17074116	DGXSHMSRISYRIG-OGIZRACOSA-N	359.426	3.660	50	40	FHGB	
O=C(N/N=C1/C[C@@H]2CC=C[C@@H]12)c1cc(-c2ccccn2)nc2ccccc12	32706034	XWJIEOOWGPKFTR-GLUQBRFBSA-N	354.413	3.979	50	40	FHGB	
COc1c(Cl)cc(Cl)cc1[C@H]1C(C#N)=C(N)Oc2cc(O)ccc21	409128930	LIHUNJLJPPTHKH-HNNXBMFYSA-N	363.200	3.926	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N/NC(=O)CNc1ccc(Cl)cc1	409366360	UPLMAOBZWPWLHJ-UFFVCSGVSA-N	366.248	3.954	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)cc1[N+](=O)[O-]	409389892	AWMXUIVLHRWCMX-WSDLNYQXSA-N	362.389	3.619	50	40	FHGB	
CC(C)(C)c1ccc(C(=O)NNC(=O)CNc2cccc(Cl)c2)cc1	858868	FFVLFJWKLGJACJ-UHFFFAOYSA-N	359.857	3.511	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc(Cl)cc1	951448	WOUNVJOVAYEFTG-XYOKQWHBSA-N	357.753	3.802	50	40	FHGB	
C[C@@H]1CCCC[C@@H]1NC(=O)/C(C#N)=C/c1ccc(O)c(Br)c1	23723802	LPBYOLKRVIVKAH-XLFIVMGGSA-N	363.255	3.757	50	40	FHGB	
COc1ccc(Br)cc1/C=N\NC(=O)c1ccccc1Cl	13940256	DBQFIUPPFYVKMH-NVMNQCDNSA-N	367.630	3.875	50	40	FHGB	
COc1ccc(C(=O)N/N=C(\C)c2cc3cc(Cl)ccc3oc2=O)cc1	4551610	IFDBVCGCICFBQP-SRZZPIQSSA-N	370.792	3.609	50	40	FHGB	
CCOc1ccc2oc(C(=O)NNc3ccccc3[N+](=O)[O-])c(C)c2c1	15423201	WWDSYYARVHWZNQ-UHFFFAOYSA-N	355.350	3.805	50	40	FHGB	
Cc1ccccc1C(=O)NNC(=S)Nc1cccc(C(F)(F)F)c1	8691535	MJXLCHJSIIPVBV-UHFFFAOYSA-N	353.369	3.645	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2cccc(OCCC)c2)cc1OC	409321525	IDACKJFHEQWUAD-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NC2CC2)ccc1OCc1ccc(F)cc1	7065710	HPMIVOFATJQNCF-MHWRWJLKSA-N	366.392	3.599	50	40	FHGB	
Cc1ccc([C@H](Br)[C@H](Br)C(=O)[C@@]2(C)CO2)cc1	102700599	PQHOXCGXAACSQA-GMXVVIOVSA-N	362.061	3.553	50	40	FHGB	
COC(=O)[C@H]1C(O)=NC(SC)=C(C#N)[C@@H]1c1ccc(Cl)cc1Cl	9089066	JXZUVPQUDLTWGP-NWDGAFQWSA-N	371.245	3.934	50	40	FHGB	
COc1ccc(NC(=O)[C@@H](Br)CCCCCl)cc1OC	2322731	QWHVWTDPJYTUNP-NSHDSACASA-N	364.667	3.815	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1sccc1-n1cccc1	12808609	MUQXXPLBTTYXEG-UHFFFAOYSA-N	369.490	3.516	50	40	FHGB	
Cc1cc(/C=N/NC(=O)COc2ccccc2)c(C)n1-c1ccccc1F	28216254	MNTXCXYCMGSQAX-YDZHTSKRSA-N	365.408	3.762	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2cc(Cl)ccc2OCC(=O)O)cc1	409054909	HFCWXJAAEHXCNH-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
Cc1ccc2cc(/C=N/NC(=O)COc3ccccc3)c(Cl)nc2c1	408728868	VUIRMWPLWLRELN-SRZZPIQSSA-N	353.809	3.726	50	40	FHGB	
Cc1ccc(S(=O)(=O)N=[S@@](CCCl)CCc2ccccc2)cc1	5328423	MFZUURLQTGIEQW-QFIPXVFZSA-N	369.939	3.967	50	40	FHGB	
C[C@H](C(=O)NNc1ccc(Cl)c(Cl)c1)n1c(=O)oc2ccccc21	32901564	OJTVDRVPSJTRSN-SECBINFHSA-N	366.204	3.606	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Nc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1	662757	XJTPOFJXVZHWFQ-ZICWZVMQSA-N	360.801	3.589	50	40	FHGB	
CCCCc1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])s2)cc1	3174819	PHJFHLDBRIKOJM-WOJGMQOQSA-N	361.423	3.528	50	40	FHGB	
COc1cc([C@H]2C(C#N)=C(C)NC3=C2C(=O)CC(C)(C)C3)cc(OC)c1O	3297658	POTVRDCWQZDICL-SFHVURJKSA-N	368.433	3.537	50	40	FHGB	
CCOc1cc(Cl)c(Cl)c(/C=N/NC(=O)Cc2ccccc2)c1O	4681433	IXYWPZGMKRHHDN-KEBDBYFISA-N	367.232	3.791	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(N3CCCCC3)o2)cc1	9324092	CDCARXPTPMDMKH-GHRIWEEISA-N	365.433	3.502	50	40	FHGB	
CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C\c1cccc(Cl)c1)CO2	28616216	DUPDWHNSDQHQSM-JGVLGKFESA-N	372.852	3.928	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccccc1C)c1ccc2c(c1)OCCO2	408862187	GCOOKAKOYQPOTJ-RCCKNPSSSA-N	370.474	3.540	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	59473742	VQOKHENGULTBMR-VDCVXVNISA-N	363.826	3.879	50	40	FHGB	
Cc1ccc(C)c(OCC(=O)N/N=C/c2c(O)ccc3ccccc23)c1C	12843996	HGZCDRLOHABQRF-FSJBWODESA-N	362.429	4.000	50	40	FHGB	
C/C(=N/NC(=O)c1ccco1)c1ccc(NC(=O)C2CCCCC2)cc1	6691602	TYKBJNDKGITDFO-HMAPJEAMSA-N	353.422	3.952	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC1CCCCC1	409383011	QMLZNRXMZQCMJR-OEAKJJBVSA-N	353.466	3.611	50	40	FHGB	
COC(=O)CC[C@H](CO[Si](C)(C)C(C)(C)C)NC(=O)OC(C)(C)C	196247456	BTKLPINUUIACIA-CYBMUJFWSA-N	361.555	3.855	50	40	FHGB	
Cc1ccccc1N1C(S)=C(C#N)C(=O)N[C@@H]1c1ccccc1Cl	645032	HCEPHGWCQRCDEQ-INIZCTEOSA-N	355.850	3.948	50	40	FHGB	
N#CC1=C(SCc2ccccc2)NC(=O)C[C@H]1c1ccc2c(c1)OCO2	4170824	GFIXWTMTZREHDP-HNNXBMFYSA-N	364.426	3.687	50	40	FHGB	
O=C(NCCCl)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	4933000	HGAYPRWJEWAFPJ-UHFFFAOYSA-N	352.221	3.953	50	40	FHGB	
CC(C)Oc1ccc(C(=O)NNC(=O)c2[nH]c3ccccc3c2Cl)cc1	40143911	KZGVGOMNLVWMJF-UHFFFAOYSA-N	371.824	3.683	50	40	FHGB	
COc1ccc2cc(OCC(=O)N/N=C/c3ccc(F)s3)ccc2c1	252483564	FFCFUTPRXDRLSG-KEBDBYFISA-N	358.394	3.578	50	40	FHGB	
COc1ccc(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-]	409271838	NVLPUBHJAHEUNW-FYJGNVAPSA-N	369.421	3.594	50	40	FHGB	
C/C(N)=C(/C#N)C(=O)CSc1ncnc2scc(-c3ccccc3)c12	7735196	GRAWNLZVBLZYBR-ACCUITESSA-N	366.471	3.776	50	40	FHGB	
CC[C@H](C)c1ccc(OCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1	1319302	MOCZMPDFHIOIFO-PVGUKEHMSA-N	355.394	3.637	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C\c1cn(CC#N)c2ccccc12)c1ccccc1	409245800	ZGHRTHFBLCJQGA-CQUHBBLWSA-N	354.413	3.949	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C(\CC)c2ccc(OC)cc2OC)cc1	20765108	UFPPEFVBWMLARD-DYTRJAOYSA-N	356.422	3.647	50	40	FHGB	
N#CC(C#N)=Cc1ccc(OCC(=O)Nc2ccccc2F)c(Cl)c1	409369704	FBHMMPGAHRNZTJ-UHFFFAOYSA-N	355.756	3.927	50	40	FHGB	
CC(C)C[C@@H](NC(=O)c1ccccc1)C(=O)N/N=C/C=C/c1ccccc1	5003114	PDDDDYPEJDNCMW-DTBNTZCISA-N	363.461	3.647	50	40	FHGB	
N#CC1=C(N)n2c(nc3ccccc32)N[C@H]1c1ccccc1Br	20086173	DFZVCFMQYJQWHW-HNNXBMFYSA-N	366.222	3.616	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1	1437659	FQQJFIWEJMODQA-CIAFOILYSA-N	369.421	3.730	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1	1864519	XEHPXFMFKUTASA-YBFXNURJSA-N	368.418	3.639	50	40	FHGB	
N#C/C(=C\c1ccc2c(c1)OCO2)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	2773393	UTEDAWBUUYJKRT-VZUCSPMQSA-N	371.736	3.523	50	40	FHGB	
CN1C2=C(C#N)[C@](c3ccccc3)(C(F)(F)F)NC(=O)N2c2ccccc21	3227167	QSXSNZHAFQYIML-GOSISDBHSA-N	370.334	3.859	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Cl)cc1)=N\NC(=O)CCc1ccccc1	4549171	RVKGCLVMGATYDX-HYARGMPZSA-N	357.841	3.794	50	40	FHGB	
Cc1ccc(-n2nc(C)c(/C=N/NC(=O)c3ccccc3)c2Cl)cc1	6942591	IBVIXJMZDJSXIM-CIAFOILYSA-N	352.825	3.906	50	40	FHGB	
Cc1cc(C)nc(NNC(=O)c2ccc3noc(-c4ccccc4)c3c2)n1	14513539	BYRKUGDQPBWOHY-UHFFFAOYSA-N	359.389	3.659	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C)n1C	107890112	LZYDOYXOTCSHEN-GIJQJNRQSA-N	356.407	3.529	50	40	FHGB	
Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1ccc(Cl)cc1Cl	226366757	HYZCDSFABXHYIK-UHFFFAOYSA-N	362.216	3.549	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2ccccn2)c(C)n1-c1cccc(Cl)c1	12364068	JBYUJBDJPGYBIU-UUYOSTAYSA-N	352.825	3.906	50	40	FHGB	
N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)Nc1cccc(Cl)c1	6646882	JBAWDBLPKVWTKX-NYYWCZLTSA-N	371.736	3.523	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1C(C)C	59151428	KLIDZAADLQWIOF-RGVLZGJSSA-N	355.394	3.799	50	40	FHGB	
CCSC1=C(C#N)[C@H](c2ccc(Cl)cc2)[C@H](C(=O)OC)C(O)=N1	9089483	WKEUIGQOEPOIBX-STQMWFEESA-N	350.827	3.671	50	40	FHGB	
Cc1ccc(Cc2sc(Br)nc2NC(=O)CCl)cc1	5016869	WDWVPHFVSPBXBA-UHFFFAOYSA-N	359.676	3.982	50	40	FHGB	
CCCC/C(=N\NC(=O)CNC(=O)c1ccc(Cl)cc1)c1ccccc1	4458584	AYFLAPZLNFBZTM-PTGBLXJZSA-N	371.868	3.781	50	40	FHGB	
CCCOc1ccc2ccccc2c1/C=C(\C#N)C(=O)NC[C@@H]1CCCO1	408735491	SSRPZWVASZVIQA-KJCUYJGMSA-N	364.445	3.831	50	40	FHGB	
COc1cc(OC)c(OC)cc1/C=C(\C#N)c1ccc([N+](=O)[O-])c(OC)c1	98053269	ZLBBYEHFJIHQFV-VGOFMYFVSA-N	370.361	3.693	50	40	FHGB	
Cc1ccc(C)c(NC(=O)/C(C#N)=C/c2cc([N+](=O)[O-])ccc2N(C)C)c1	408995877	BURMEHMRNOFGOX-MHWRWJLKSA-N	364.405	3.823	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)c([N+](=O)[O-])c1	408866220	GORGISUEETYKJW-VCHYOVAHSA-N	355.375	3.989	50	40	FHGB	
C/C(CC(=O)NCc1ccccc1)=N\NC(=O)c1cccc2ccccc12	100571749	FLAWWOLNFRNIPZ-LFVJCYFKSA-N	359.429	3.652	50	40	FHGB	
N#CC1=C(NC(=O)NC[C@H]2CCCO2)c2ccccc2CC12CCCCC2	27534310	ABZLDCLHNDHVLP-QGZVFWFLSA-N	365.477	3.906	50	40	FHGB	
C/C(CC(=O)Nc1ccccc1C(C)C)=N\NC(=O)Cc1ccccc1	4690431	HXUKEYWEEIGRBQ-XQNSMLJCSA-N	351.450	3.873	50	40	FHGB	
Cc1ccc([C@@H](NC(=O)N2C[C@H](C)O[C@H](C)C2)C(Cl)Cl)cc1F	17576749	HVZZCOGLJCDBBM-UHIISALHSA-N	363.260	3.798	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1ccc2c3c(cccc13)CC2	21439092	UHIUNUZUAFXYJP-UHFFFAOYSA-N	364.832	3.596	50	40	FHGB	
Cc1ccccc1CSCC(=O)N/N=C/c1ccc(C)c([N+](=O)[O-])c1	1424859	WJVGDIOICDMRJC-VXLYETTFSA-N	357.435	3.595	50	40	FHGB	
O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1cccnc1)c1ccccc1	3164825	KRTLYRDUPCFLIN-BUVRLJJBSA-N	367.412	3.698	50	40	FHGB	
C/C(=N\NC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(-n2ccnc2)cc1	57623320	WHSBHHANCYGYPV-BUVRLJJBSA-N	362.477	3.929	50	40	FHGB	
Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(Sc3ccccn3)o2)n1	408988457	DMZVZZVHCHVGHQ-GXDHUFHOSA-N	350.403	3.887	50	40	FHGB	
N#C/C(=C\c1ccncc1)C(=O)Nc1c(Cl)cc([N+](=O)[O-])cc1Cl	408880139	FZVXSIZVPFPHHK-BJMVGYQFSA-N	363.160	3.842	50	40	FHGB	
O=c1nc2n(nc1-c1ccccc1)[C@@H](C(Cl)Cl)Nc1ccccc1-2	1775971525	RZRSDWMPVAEHCP-INIZCTEOSA-N	359.216	3.700	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@@H]2C[C@H]3C[C@H](CBr)[C@H]2C3)cc1	256575739	SSOHWXRVPHYKLJ-CTHBEMJXSA-N	359.285	3.510	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(Cl)cc1	59459580	NFFQYUFPXABGHN-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
O=C(N/N=C/c1ccncc1)c1cc(-c2ccc(Cl)c(Cl)c2)[nH]n1	9109364	JHBSEMUXKALPFV-AWQFTUOYSA-N	360.204	3.542	50	40	FHGB	
Cc1ccc(SCCC(=O)N/N=C2\C(O)=Nc3c(C)cccc32)cc1	7779392	OTYUYECYMJXQNG-UHFFFAOYSA-N	353.447	3.908	50	40	FHGB	
N#C/C(=C/c1cccn1-c1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1	409233393	VSJFBALRGXLIAE-SSZFMOIBSA-N	357.369	3.721	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Br)c2)c1C	409063525	MEKOQTCNOYYTID-RIYZIHGNSA-N	358.239	3.510	50	40	FHGB	
O=C(N/N=C/c1ccccc1F)C1CCN(Cc2ccc(Cl)cc2)CC1	5636509	VSEUPRLCHXLLMM-YDZHTSKRSA-N	373.859	3.841	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2ccc(Br)s2)cc1	1054376	FSAFWQWNARQNQA-CXUHLZMHSA-N	353.241	3.673	50	40	FHGB	
O=C(NNC(=O)c1ccc(Cl)cc1)Nc1cccc(C(F)(F)F)c1	3226645	XGVOHKIMGYVYMC-UHFFFAOYSA-N	357.719	3.825	50	40	FHGB	
O=C(CSSCC(=O)Nc1ccc(F)cc1)Nc1ccc(F)cc1	1806515	WSMWWROKENXZBD-UHFFFAOYSA-N	368.430	3.923	50	40	FHGB	
COc1cc(OC)c(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)c(OC)c1	2783271	GOBNWZZHZQJZBQ-NTEUORMPSA-N	352.390	3.567	50	40	FHGB	
Nc1cccc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)c1	100047336	TYPHQVFJXUCYNU-UHFFFAOYSA-N	354.413	3.888	50	40	FHGB	
COc1ccc2nc(NNC(=O)c3nc4ccccc4s3)sc2c1	4121394	SUMXMRXVTZOCQM-UHFFFAOYSA-N	356.432	3.672	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(-c3ccc([N+](=O)[O-])cc3C)o2)cn1	5740201	XQRYGKILLUPMPC-SRZZPIQSSA-N	364.361	3.631	50	40	FHGB	
N#CC1=C(N)n2c(nc3ccccc32)N[C@H]1c1cccc(Br)c1	20086165	ZLVINMQBJUUHHA-HNNXBMFYSA-N	366.222	3.616	50	40	FHGB	
N#Cc1ccccc1Cn1cc(/C=N/NC(=O)c2ccco2)c2ccccc21	6971881	QBJUFTLQVPDUTB-ZMOGYAJESA-N	368.396	3.918	50	40	FHGB	
O=C(O)[C@@H](Br)C12C[C@@H]3C[C@H](CC(Br)(C3)C1)C2	100434447	PKGVWUJFDWNKFJ-JQIAMPCJSA-N	352.066	3.568	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1cc([N+](=O)[O-])ccc1Cl	59148595	ZOPZZCZHOFFWDU-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
O=C(COc1cccc2cccnc12)N/N=C/c1c(F)cccc1Cl	4321032	CQBFTUYLBJWODQ-LSHDLFTRSA-N	357.772	3.556	50	40	FHGB	
C=CCOc1cccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)OC)cc2)c1	408937789	OUVITRKMMJQNHY-ATVHPVEESA-N	362.385	3.584	50	40	FHGB	
O=C(N/N=C/C=C/c1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1	9668339	FQYXDVUTXYCEKE-MKBOCBPUSA-N	374.194	3.786	50	40	FHGB	
O=C(COc1ccc(C2SCCS2)cc1)N/N=C/c1cccs1	408567888	GQUXELRACDCSLH-LICLKQGHSA-N	364.517	3.756	50	40	FHGB	
N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1ccccc1C(=O)O	13345013	PQWJRZDNBBUMTP-FMIVXFBMSA-N	371.190	3.693	50	40	FHGB	
NC(=O)N/N=C/c1cccc(OC(=O)c2sc3ccccc3c2Cl)c1	5604840	BYPFNVTZFVGTBV-AWQFTUOYSA-N	373.821	3.776	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=N/NC(=O)Cc3cccs3)c2c1	1105149	SAMGPXFQYDVBGW-UDWIEESQSA-N	354.431	3.611	50	40	FHGB	
CCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)OC)cc1	1773098	PBUYAJOGQJAHCM-DTQAZKPQSA-N	364.401	3.808	50	40	FHGB	
Br[C@H]1C=CC=CN1C/C=C/CN1C=CC=C[C@@H]1Br	5004527	SSAJWEKHEUXTEL-QAMKJQMISA-N	372.104	3.756	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(C)c([N+](=O)[O-])c3)o2)o1	4524197	KWFFZGKMDBQQIG-VXLYETTFSA-N	353.334	3.829	50	40	FHGB	
CCOc1ccccc1/C=C(\C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1C	408925978	VKYMKOICWAXAHY-XNTDXEJSSA-N	351.362	3.848	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1OCC	409139441	AVJSJQPTVAWDTN-CJLVFECKSA-N	352.434	3.733	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)/C(C#N)=C/c1ccc(O)c([N+](=O)[O-])c1	36137585	ZPOZGYKKUGZVHV-KPKJPENVSA-N	357.753	3.808	50	40	FHGB	
N#Cc1ccccc1COc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1	14134891	VBFDDTJQAWNOHZ-PCLIKHOPSA-N	369.424	3.830	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)C2c3ccccc3Oc3ccccc32)o1	2768532	OTYXAOGDSAVOGM-LPYMAVHISA-N	361.401	3.734	50	40	FHGB	
O=C(COc1ccc(Cl)cc1Br)N/N=C/c1ccccc1	3153316	ZLTLEKXKAQDNBG-GIJQJNRQSA-N	367.630	3.632	50	40	FHGB	
CCCc1ccc(OCC(=O)N/N=C(\C)c2ccc(OCC)cc2)cc1	5247066	QAZLEVNFUQNMTI-CJLVFECKSA-N	354.450	3.957	50	40	FHGB	
COc1cc(C(=O)N/N=C(/C)c2ccc(Cl)cc2)cc(OC)c1OC	6753836	JRCXNRLTMSRMJV-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)C[C@H]2C[C@H]3CC[C@@H]2C3)c(C)n1-c1ccccc1	8027252	LGPWCQUNYSZTDF-RCCFBDPRSA-N	365.477	3.681	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2cc([N+](=O)[O-])ccc2Cl)cc1	59133377	TWNOBYROSIJSKF-WQLSENKSSA-N	357.753	3.802	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)cc1[N+](=O)[O-]	408871679	ZXYQYYGIXQVCHP-RGVLZGJSSA-N	355.394	3.702	50	40	FHGB	
CN(C)CCC(C(=O)CBr)(c1ccccc1)c1ccccc1	1593562	OVEUBOQKMVBPAA-UHFFFAOYSA-N	360.295	3.888	50	40	FHGB	
Cc1cc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)c(C)n1-c1ccc(F)cc1	6961673	VSCXTCFSFAJAHF-NFCNUSAFSA-N	374.419	3.991	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1	8129442	NXOKQDHMNIJPRV-UHFFFAOYSA-N	365.408	3.616	50	40	FHGB	
Cc1ccc(NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C)c(C)c1	8733173	VSZIQXUVNQEYGJ-OAHLLOKOSA-N	369.303	3.558	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc(Br)ccc2O)c(Cl)c1	9190571	DNKFQLMWHSGPDB-QGMBQPNBSA-N	367.630	3.880	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)c2ccoc2C)c(Br)cc1O	98055429	KVLJYXHELCVOEY-VZUCSPMQSA-N	362.179	3.855	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc(C(=O)O)c(Cl)c2)o1)C(=O)N1CCCC1	409368261	QPPFHTMKCMCCRB-UKTHLTGXSA-N	370.792	3.828	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C\c2cc(Cl)ccc2OCC)cc1	408711738	IFLPMVMMBVWQTE-BKUYFWCQSA-N	360.841	3.830	50	40	FHGB	
CCOc1ccc(NC(=O)N/N=C\c2ccc(N3CCCC3)cc2)cc1	408959716	DQKJMDAZUKEFEC-QNGOZBTKSA-N	352.438	3.841	50	40	FHGB	
O=C(N/N=C\c1ccc(Sc2nc3ccccc3[nH]2)o1)c1ccco1	33295351	IKWQPXRONLNOPH-ZDLGFXPLSA-N	352.375	3.664	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccc2c(c1)OCCO2)c1cccc2ccccc12	409366302	UDLLIKBNNDZVJA-HZHRSRAPSA-N	360.413	3.694	50	40	FHGB	
Cc1ccc([C@H](NC(=O)N2C[C@H](C)O[C@H](C)C2)C(Cl)Cl)cc1F	18067182	HVZZCOGLJCDBBM-WDMOLILDSA-N	363.260	3.798	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)c2cc(C(C)C)nc3ccccc23)c(C)o1	15664319	WZNFFWFNMYSMJL-UHFFFAOYSA-N	351.406	3.643	50	40	FHGB	
COc1ccccc1NCC(=O)N/N=C\c1ccc(Cl)cc1Cl	30802576	WCHBBNACAOBINM-UKWGHVSLSA-N	352.221	3.564	50	40	FHGB	
CC(C)N(C(=O)CCl)[C@@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1	79392733	ZCWLYRNUEUDMNZ-DLBZAZTESA-N	366.889	3.700	50	40	FHGB	
CC(C)(C)OC(=O)N1CCC(CCCI)CC1	95083694	NLHWDDDFOOUXKD-UHFFFAOYSA-N	353.244	3.849	50	40	FHGB	
CN(C)C(=O)[C@@H](c1ccccc1)P(=O)(c1ccccc1)c1ccccc1	104117866	JAXORYJLLZFBDB-OAQYLSRUSA-N	363.397	3.830	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc1	408760955	BEMYXRXLPSZWPQ-UDWIEESQSA-N	367.430	3.635	50	40	FHGB	
O=C(CSCc1c(Cl)cccc1Cl)N/N=C/c1cccnc1	409123127	DZDSRQNOMSEYHB-UFWORHAWSA-N	354.262	3.772	50	40	FHGB	
COc1cccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)c1OC	7993679	LLWVMSFNSYFWRZ-VXLYETTFSA-N	364.854	3.600	50	40	FHGB	
CCSC1=C(C#N)[C@@H](c2ccc3c(c2)OCO3)C2=C(CCCC2=O)N1	2309713	PBSILTQTRGSCDE-QGZVFWFLSA-N	354.431	3.597	50	40	FHGB	
Cc1ccccc1NC(=O)/C(C#N)=C1\SCC(=O)N1c1ccccc1C	13749637	UMYRGRRZOIVPPW-HKWRFOASSA-N	363.442	3.757	50	40	FHGB	
Cc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(Br)cc2)o1	14135182	XZMYYLBPHFNNGW-RIYZIHGNSA-N	352.209	3.689	50	40	FHGB	
COC(=O)c1ccc(/C=C(\C#N)C(=O)c2c[nH]c3cc(Cl)ccc23)o1	96180184	PDFRMILKSBMHCX-UXBLZVDNSA-N	354.749	3.991	50	40	FHGB	
CCC(CC)C(=O)Nc1ccc(/C(C)=N\NC(=O)c2ccncc2)cc1	5792008	OPOAAHVXGDHNIU-UCQKPKSFSA-N	352.438	3.610	50	40	FHGB	
COc1cc(Cl)c(/C=N/NC(=O)c2ccc(Cl)cc2)cc1OC	66202159	FTXVWVAUXVWJAH-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
Cc1cccc(C)c1-n1c(C)cc(/C=N/NC(=O)CN2CCCCC2)c1C	28216582	NDDFSXZBNMPGEE-OEAKJJBVSA-N	366.509	3.647	50	40	FHGB	
O=C(CNC(=O)Oc1ccccc1)NN(c1ccccc1)c1ccccc1	409004687	YCANACSCQSCOSG-UHFFFAOYSA-N	361.401	3.645	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(OC)c(C)c3)cc2c1	409186452	CEUFAWWYBKYCTH-MTJSOVHGSA-N	352.390	3.912	50	40	FHGB	
CC(=O)Nc1cccc(C(=O)N/N=C/c2ccc(-c3ccccc3C#N)o2)c1	33794995	FNQJYOGVISYHMB-YDZHTSKRSA-N	372.384	3.541	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1cccs1)c1cccs1	5771606	PJQGNHQOQDJVEC-WOJGMQOQSA-N	355.444	3.826	50	40	FHGB	
O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1	208299799	LRSYBSGMBJZCPC-MTJSOVHGSA-N	367.336	3.687	50	40	FHGB	
Cc1ccc(NC(=S)NNC(=O)c2ccc(Cl)cc2Cl)cc1	1438688	UUVSHWQBJYWYCJ-UHFFFAOYSA-N	354.262	3.933	50	40	FHGB	
Cc1ccc(C(=O)N/N=C2\CC(=O)CC(C)(C)C2)cc1Br	100013822	LOKNLKIHDYHAMS-LDADJPATSA-N	351.244	3.623	50	40	FHGB	
O=C(N/N=C\c1ccccc1)/C(=C/c1ccccc1)NC(=O)c1ccccc1	28615454	DLMPMANAKRHMHZ-XFYMNWLTSA-N	369.424	3.608	50	40	FHGB	
O=C(NNC(=O)c1ccc(Br)cc1)Nc1cccc(Cl)c1	6331167	FELXJSIGKGSTCY-UHFFFAOYSA-N	368.618	3.569	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C\c2cc(OC)ccc2OC)c1	408745753	OVNNJWJPNINBGL-GDNBJRDFSA-N	352.390	3.648	50	40	FHGB	
Cc1c(Cl)cccc1NC(=O)CCCC(=O)N/N=C\c1cccs1	5532624	UBPCQLXETJKONK-ODLFYWEKSA-N	363.870	3.969	50	40	FHGB	
CCOC(=O)C1=C(C)OC(n2cccc2)=C(C#N)[C@@H]1c1ccc(F)cc1	4744771	AOEIYMJUMUWBEP-SFHVURJKSA-N	352.365	3.970	50	40	FHGB	
O=C(O)[C@H](Br)C12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2	5185697	PKGVWUJFDWNKFJ-AOLKXXINSA-N	352.066	3.568	50	40	FHGB	
O=C(CCCc1c[nH]c2ccccc12)NNC(=O)c1ccc(Cl)cc1	6083100	AEMKSGUOVIYDIG-UHFFFAOYSA-N	355.825	3.605	50	40	FHGB	
N#C/C(=C\NC(=S)NCc1ccccc1)c1nc2ccccc2s1	8665272	UANFNSTZUFFIIV-WYMLVPIESA-N	350.472	3.825	50	40	FHGB	
CCSC1=C(C#N)[C@@H](c2ccc(O)c(OC)c2)C2=C(CCCC2=O)N1	13284580	PCQFJVWEHKIOTJ-QGZVFWFLSA-N	356.447	3.583	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C\c2cc(Cl)c(OC)c(OC)c2)cc1	33476434	FGGNYELFMQKLOX-JYRVWZFOSA-N	372.808	3.911	50	40	FHGB	
COc1cc(Cl)c(C)cc1N1C=C(C#N)S(=O)(=O)c2ccccc21	67245521	HWIZGVMTLBSAEN-UHFFFAOYSA-N	360.822	3.947	50	40	FHGB	
COC(=O)Cn1cc(/C=C(/C#N)C(=O)Nc2ccccc2C)c2ccccc21	408746006	WMANZKUYNVSDHH-WJDWOHSUSA-N	373.412	3.668	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)[C@@H](C)SCc2ccccc2)o1	408999364	KPCBQJQKJGGPNL-OOWUWCJESA-N	359.495	3.898	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc(OC(F)F)cc1	706801	IMYWEALSTHDPMS-OAHLLOKOSA-N	360.360	3.739	50	40	FHGB	
O=C(N/N=C/c1cccc(OC(=O)c2cccs2)c1)c1cccs1	989501	JSUHFKSMRAEPSF-WOJGMQOQSA-N	356.428	3.793	50	40	FHGB	
Br[C@H]1C=CC=CN1C/C=C\CN1C=CC=C[C@@H]1Br	104092765	SSAJWEKHEUXTEL-HLMASZERSA-N	372.104	3.756	50	40	FHGB	
O=C(COc1ccc(Cl)cc1Cl)N/N=C/c1cc(Cl)ccc1O	1497278	YKIGSCVJOSJTGQ-FBCYGCLPSA-N	373.623	3.882	50	40	FHGB	
O=C(NNc1nnc2c(n1)[nH]c1ccccc12)Nc1cccc2ccccc12	6886089	CMKLYYZOFOHRQC-UHFFFAOYSA-N	369.388	3.808	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(Cl)cc1Cl)c1ccc2c(c1)OCO2	17072829	LKXKHBQAWQXGFT-DJKKODMXSA-N	351.189	3.876	50	40	FHGB	
CN(C)/C(=N/[C@@H](NC(=O)c1ccccc1)C(Cl)Cl)c1ccccc1	3124285	JXZYFJPHAPENAS-HGSNWSKYSA-N	364.276	3.555	50	40	FHGB	
O=C(CCl)Nc1ccccc1CNC(=O)Nc1ccc(Cl)cc1	16449595	RNCVJCGFZLUECO-UHFFFAOYSA-N	352.221	3.839	50	40	FHGB	
COc1ccc(CC(=O)N/N=C(\C)c2cccc3ccccc23)cc1OC	5480023	QSNLEMROOSWTKJ-HZHRSRAPSA-N	362.429	3.940	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)CNc2cccc3ccccc23)c1O	3212238	HCAUVEVWLSRGIM-YDZHTSKRSA-N	363.417	3.506	50	40	FHGB	
C=CCSC1=C(C#N)[C@H](c2cccc([N+](=O)[O-])c2)C(C(C)=O)=C(C)N1	4473261	NCFQRTPYPMFYEF-KRWDZBQOSA-N	355.419	3.799	50	40	FHGB	
CC1(C)[C@@H](C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)[C@@H]1C=C(Cl)Cl	4940419	HROKMTWSVSFHHI-YJEOITOXSA-N	356.209	3.636	50	40	FHGB	
Cc1c(Cl)cccc1N1C[C@H](C(=O)Oc2ccc([N+](=O)[O-])cc2)CC1=O	7929279	HIUBMJZHDKBABN-GFCCVEGCSA-N	374.780	3.515	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)Cc2ccc(Br)cc2)c1	9203675	ZINRDRFRTVCXBK-DEDYPNTBSA-N	373.250	3.707	50	40	FHGB	
C[C@H](NC(=O)CCCC[C@H]1CCSS1)c1nnc2ccccn12	52971998	HVAWQCMGQSSHOC-STQMWFEESA-N	350.513	3.621	50	40	FHGB	biogenic
CC1=NN(c2ccccc2)C(=O)[C@@H]1/C=N/NC(=O)c1ccc2ccccc2c1	408739854	GDZOCUWOPDVXDK-RXULLKCLSA-N	370.412	3.594	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc(OCC#N)cc1	408805776	HNMWOSHCTBPDTA-GXDHUFHOSA-N	367.792	3.797	50	40	FHGB	
COc1ccc(-n2cccc2/C=N\NC(=O)Nc2ccc(F)cc2)cc1	408844015	ATOKENMIJARADA-BKUYFWCQSA-N	352.369	3.781	50	40	FHGB	
CC1(C)[C@@]2(C)CC[C@@]1(C(=O)Nc1ccccc1F)[C@H](Br)C2=O	100924381	SFCDVEAYTLQJKX-DQYPLSBCSA-N	368.246	3.923	50	40	FHGB	
O=C(NNC1=C(C(=O)C(F)(F)F)CCCCC1)c1ccc(Cl)cc1	59488996	NMJFQPXSCFUAFF-UHFFFAOYSA-N	360.763	3.924	50	40	FHGB	
COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)OC(C)(C)C)o1	2298892	DVVOUJGOZUTTGK-VCHYOVAHSA-N	361.354	3.722	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccccc1F)[C@H](Br)C2=O	7011114	SFCDVEAYTLQJKX-JLZZUVOBSA-N	368.246	3.923	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)c(C)n1C[C@@H]1CCCO1	8334292	BPEQIBVDTCYRBA-RLGUWMIQSA-N	367.424	3.969	50	40	FHGB	
CCOc1ccc(/C(C)=N/NC(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-]	409353460	LJWJGBMRVQFXGX-YBFXNURJSA-N	361.785	3.801	50	40	FHGB	
N#C/C(=C\c1ccc(Sc2ncccn2)o1)C(=O)NC1CCCCC1	409103216	FXWXVBRCWJNXBD-ACCUITESSA-N	354.435	3.577	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2)cc1Br	33961078	HPJRUOZULJWZKS-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(F)(F)F)c2)cc1O	48237817	LGSBRCOVJGTNAN-GHXNOFRVSA-N	362.307	3.965	50	40	FHGB	
O=C(N/N=C\c1cccc(O)c1)c1ccc2c(c1)CN(c1ccccc1)C2	83331595	KUWRNZRRPPHQGS-QRVIBDJDSA-N	357.413	3.676	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1Cl	3085469	KYJQMCMKDLBQCU-DJKKODMXSA-N	353.205	3.531	50	40	FHGB	
CCOc1cc(/C=N/NC(N)=O)ccc1OCc1cccc2ccccc12	5953510	STDJFJJBZMSHHU-YDZHTSKRSA-N	363.417	3.820	50	40	FHGB	
COc1ccccc1-c1cc(C(=O)N/N=C/c2c(C)[nH]c3ccccc23)[nH]n1	945796	BOCRCMWUABGKSC-WSDLNYQXSA-N	373.416	3.639	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2	1079231	BGVODGCKCYHIDL-GOSISDBHSA-N	364.355	3.677	50	40	FHGB	
O=C(N/N=C/c1ccc2c(c1)OCO2)c1ccc(NCc2ccccc2)cc1	1513432	BGRJLNKYBQLMGL-ZVHZXABRSA-N	373.412	3.791	50	40	FHGB	
O=C(COc1cccc(Br)c1)N/N=C/c1cccc(Cl)c1	3152994	BXQIIBMUPAVBRB-GIJQJNRQSA-N	367.630	3.632	50	40	FHGB	
O=C(N/N=C/c1ccccc1OCc1ccccc1)c1cc(C2CC2)n[nH]1	4135894	ZLVSIPGLNONFKD-LPYMAVHISA-N	360.417	3.630	50	40	FHGB	
COC(=O)N/N=C/c1cccc(OCCCOc2ccccc2Cl)c1	4545185	DHMLPBQTNIMVON-DEDYPNTBSA-N	362.813	3.878	50	40	FHGB	
Cc1ccccc1OCCC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	6046853	UBJZZVRQEAWZKS-UHFFFAOYSA-N	370.493	3.518	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)SCc1ccccc1)c1ccc([N+](=O)[O-])cc1	20248644	GMLMLVXGKYJPJI-NFECSFHCSA-N	357.435	3.757	50	40	FHGB	
CC[C@H](C)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	22411447	YSYYNNIUZCAKNH-ZDUSSCGKSA-N	360.841	3.726	50	40	FHGB	
CC(C)(C)C1CCC(=NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1	59435585	KDAJYAJCSFRGLC-UHFFFAOYSA-N	363.889	3.665	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)CSCc2ccc(OC)cc2)c1	59473706	XCFRAGMQMOAIJV-FYJGNVAPSA-N	370.474	3.644	50	40	FHGB	
C/C(=N\NC(=O)Nc1ccccc1C)c1ccc(N2CCOCC2)c(F)c1	96297944	JEQSDEAAMVSKPV-HZHRSRAPSA-N	370.428	3.516	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)CSCc2ccccc2C)o1	408996268	CSVGJKGFBDPYEK-UDWIEESQSA-N	359.495	3.818	50	40	FHGB	
Cc1cc(N2CCOCC2)ccc1/C=C(/C#N)C(=O)Nc1ccccc1C	409099422	SHIAGIAFAUXLTO-RGEXLXHISA-N	361.445	3.686	50	40	FHGB	
O=C(CCl)Nc1ccc(Br)cc1C(=O)c1ccccc1F	2556763	HOQSGKIDIDLTAG-UHFFFAOYSA-N	370.605	3.997	50	40	FHGB	
C/C(CC(=O)Nc1cc(C)ccn1)=N\NC(=O)c1ccc2ccccc2c1	4697909	TZCDQAOGCMRGHS-BUVRLJJBSA-N	360.417	3.678	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)OC(=O)COc1ccc(Cl)cc1	104189173	KXXFHARWKGDIMP-UHFFFAOYSA-N	355.173	3.521	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)c(C)n1-c1ccccc1	105872896	LGPWCQUNYSZTDF-BZSNNMDCSA-N	365.477	3.681	50	40	FHGB	
N#CC1=C(NC(=O)NC[C@@H]2CCCO2)c2ccccc2CC12CCCCC2	27534307	ABZLDCLHNDHVLP-KRWDZBQOSA-N	365.477	3.906	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)N/N=C/c1ccc(-n2ccnc2)cc1	7900197	RWPLTJWWJBGIRO-ZVHZXABRSA-N	362.477	3.929	50	40	FHGB	
C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2cc(C)ccc2C)cc1OC	408794590	JOOAKSDUOBRNPF-LDADJPATSA-N	360.413	3.870	50	40	FHGB	
COc1cccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)c1	5514620	ZNHVXJPKNLYCCH-HZHRSRAPSA-N	373.412	3.711	50	40	FHGB	
CO[C@@H]1C[C@@H]2C(=O)C(c3ccccc3)(c3ccccc3)[C@@H]2[C@H]1Br	4285736	PODFRQAFLRTTRZ-MHORFTMASA-N	371.274	3.970	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(C(C)(C)C)cc1)c1ccc2c(c1)OCCO2	6592357	MUPLDAYHJYMZTM-HYARGMPZSA-N	352.434	3.909	50	40	FHGB	
COc1ccc(C(=O)NNC2c3ccccc3-c3ccccc32)cc1OC	15472092	HXTKYFZLHURSFT-UHFFFAOYSA-N	360.413	3.708	50	40	FHGB	
CCc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)(C)C)cc2)cc1	408996952	KROHGKLENHUBJU-HYARGMPZSA-N	351.450	3.635	50	40	FHGB	
Cc1ccc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)cc1	3322014	RKLFPOLZBSBQDU-UHFFFAOYSA-N	372.424	3.721	50	40	FHGB	
CCC(=O)N/N=C(\C)CC(=O)Nc1cc2oc3ccccc3c2cc1OC	4713290	PDUIJMJISOYPAV-WSDLNYQXSA-N	367.405	3.825	50	40	FHGB	
COC(=O)Cn1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)c2ccccc21	4738529	ZYOCJZLGLJWHJC-UVTDQMKNSA-N	356.385	3.755	50	40	FHGB	
COc1ccc2cc(/C(C)=N/NC(=O)CNc3ccccc3F)ccc2c1	4933746	GAUZNSBMKPBOKL-ZVHZXABRSA-N	365.408	3.940	50	40	FHGB	
COc1cccc(-c2n[nH]c3c2[C@@H](c2ccc(C)s2)C(C#N)=C(N)O3)c1	5164199	BMSSLNYNESMEPX-OAHLLOKOSA-N	364.430	3.673	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)[C@H](C)SCc2ccccc2)cc1	5362312	YPAKURFFQDZEHO-WXUSHSQQSA-N	369.490	3.807	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)c2ccc(Oc3ccccc3)cc2)c(C)o1	6436509	DDCFHLDMNCIBRP-UHFFFAOYSA-N	350.374	3.764	50	40	FHGB	
C[C@@](CC(=O)Nc1ccc(SC#N)cc1F)(C(=O)O)c1ccccc1	8735036	FAYWVYTVHQNANK-SFHVURJKSA-N	358.394	3.770	50	40	FHGB	
COC(=O)c1ccc(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)cc1	59515947	VUNIRXNDKQDHAQ-JLPGSUDCSA-N	372.424	3.755	50	40	FHGB	
CC(=O)Nc1cccc([P@@](=O)(Oc2ccccc2)c2ccccc2)c1	97951080	DHMGLYNQHOTVQI-VWLOTQADSA-N	351.342	3.953	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCCC3)o2)cc1	408849857	ZYKRAJMCHWUHDI-SQFISAMPSA-N	351.406	3.824	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=N/NC(=O)c2ccccc2Cl)cc1	408955636	XYDDKHRZRPHHBO-HYARGMPZSA-N	366.852	3.961	50	40	FHGB	
COc1ccc(CC(=O)N/N=C\c2ccc(-c3ccc(C#N)cc3)o2)cc1	409021844	BSIWFUVWYJTXNH-UCQKPKSFSA-N	359.385	3.520	50	40	FHGB	
COc1ccc(C(=O)NN(C(C)=O)c2nc(-c3ccccc3)cs2)cc1	5274499	QRHHVQCJOQQUBN-UHFFFAOYSA-N	367.430	3.517	50	40	FHGB	
COc1ccc(/C=N/NC(=O)COc2ccccc2C(C)(C)C)c(OC)c1	4724398	YCLVUWRNVRXMRN-LPYMAVHISA-N	370.449	3.530	50	40	FHGB	
N#CC1=C(SCc2cccc([N+](=O)[O-])c2)NC(=O)C[C@@H]1c1cccs1	409125933	NHLHZQOHAFBIKA-ZDUSSCGKSA-N	371.443	3.928	50	40	FHGB	
O=C(N/N=C\c1cccn1-c1cccc([N+](=O)[O-])c1)c1cc2ccccc2o1	408956870	ZYWXPZVFMHFTFW-BKUYFWCQSA-N	374.356	3.896	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2cc3cc(Br)ccc3o2)c(C)n1C	408950593	TZIBGUQVVOCXRY-OCKHKDLRSA-N	374.238	3.915	50	40	FHGB	
N#CCn1cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)c2ccccc21	1102980	WVNICCDYUPNVEF-BHGWPJFGSA-N	370.334	3.948	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(F)cc1)c1ccc(Br)cc1	5479971	JBJBELZVLWZZBD-YBFXNURJSA-N	365.202	3.507	50	40	FHGB	
CO[C@H](c1cc2c(cc1Br)OCO2)[C@H](C)Br	1602875	CXJZDLJNUKOMEA-KGFZYKRKSA-N	352.022	3.649	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1	5712870	UNMZETVKAHHUSM-GXDHUFHOSA-N	367.361	3.548	50	40	FHGB	
C#CCOc1ccc(Cl)cc1/C=C(\C#N)C(=O)Nc1ccc(O)cc1	5827652	LNQICPGMNHTPLQ-GXDHUFHOSA-N	352.777	3.603	50	40	FHGB	
CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)NC(C)(C)C)o2)cc1	31829085	ICXMYQCRCKTNES-VBKFSLOCSA-N	366.417	3.945	50	40	FHGB	
N#C/C(=C/c1cccn1-c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(O)cc1	33827624	PMYROYWHMYMJHC-OWBHPGMISA-N	374.356	3.637	50	40	FHGB	
O=C(N/N=C/c1ccc(N2Cc3ccccc3C2)cc1)c1ccc(O)cc1	59503588	MGMDERUJZFYMMO-YDZHTSKRSA-N	357.413	3.676	50	40	FHGB	
O=C(COc1cccc2ccccc12)N/N=C\c1ccc(N2CCCC2)cc1	408959998	HWKBOFXQPDWERJ-JLPGSUDCSA-N	373.456	3.969	50	40	FHGB	
COc1cc(O)ccc1/C=N/NC(=O)C1c2ccccc2-c2ccccc21	1433665	GWXMXVRXVPJKMQ-YDZHTSKRSA-N	358.397	3.663	50	40	FHGB	
COc1ccc(C(=O)NNc2nc3c(C)c(C)ccc3s2)cc1OC	4121428	RJIITTGHDYDUNF-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)CCC(=O)Nc2cccc(Cl)c2)cc1	4646812	NFIZPIQJBXZCBM-LPYMAVHISA-N	373.840	3.608	50	40	FHGB	
C/C(=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1)c1cc(C)ccc1C	4714624	WTJHCFJHYRUQMX-HMMYKYKNSA-N	371.462	3.985	50	40	FHGB	
COc1ccc(/C=C(\C#N)c2nnc3n2CCCCC3)cc1OC(F)F	7159097	HVHXRFYVSCSOIV-UKTHLTGXSA-N	360.364	3.679	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1ccccc1)c1ccc(N2CCCC2)cc1	7386176	ZTQSXXYCWTXAEJ-HAVVHWLPSA-N	358.445	3.841	50	40	FHGB	
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccccc1OC(F)F	8855174	ZIQLOHILHQGFPY-UHFFFAOYSA-N	371.796	3.573	50	40	FHGB	
CSc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1	20086702	SUOIJIDQTSNXLW-MRXNPFEDSA-N	374.421	3.549	50	40	FHGB	
COc1ccc2cc(-c3cc(C(=O)NN)nn3-c3cccc(C)c3)ccc2c1	59472511	PWIHSOCEHQYHPJ-UHFFFAOYSA-N	372.428	3.613	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)cc1C	59720862	OKIGRXGEWRBYJG-ODCIPOBUSA-N	366.248	3.878	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/[C@H]2C[C@H]3C=C[C@H]2C3)cc(OCC)c1OCC	102123939	ZNEHIIAWOIPSAR-LHAKLGSHSA-N	372.465	3.811	50	40	FHGB	
CC(=O)Oc1ccc(C)cc1C[C@H](Br)CBr	103697566	IRLWFLREWFIRGZ-NSHDSACASA-N	350.050	3.621	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)COc2ccc([C@@H](C)CC)cc2)c(O)c1	1320226	CGPHWSUNWCMSOT-NSMHLIOHSA-N	370.449	3.834	50	40	FHGB	
O=C(NNC(=O)C1CCCC1)c1ccc(COc2ccc(Cl)cc2)cc1	3429121	CLPXQFGQTUTRDG-UHFFFAOYSA-N	372.852	3.870	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc2c(c1)OCO2	5515463	LTWRHFDREYKFSA-LOMXTUQMSA-N	362.838	3.700	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C/c1cc(Cl)cc([N+](=O)[O-])c1O)c1ccccc1	15980924	KUQLXLLTNAYQOM-LLUUXILJSA-N	371.780	3.738	50	40	FHGB	
CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1c2ccccc2nc2ccccc12	16693860	UOVDAJVRAOVFKL-ATVHPVEESA-N	368.396	3.522	50	40	FHGB	
C[C@@H]1CCCC[C@H]1NC(=O)/C(C#N)=C/c1ccc(O)c(Br)c1	23723806	LPBYOLKRVIVKAH-YFVDUCKESA-N	363.255	3.757	50	40	FHGB	
COc1cc(/C=N/NC(=O)COc2c(C)cccc2C)ccc1OC(C)C	40911467	XMKYIFQZTFEFFV-WSDLNYQXSA-N	370.449	3.628	50	40	FHGB	
O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NNc1cccc(C(F)(F)F)c1	102925774	WKNLCCOPKYFYBR-LGBHXNNWSA-N	368.399	3.870	50	40	FHGB	
Cc1ccc2cc([C@@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)c(Cl)nc2c1C	899070	RWLIHVVVAUJXNP-OAHLLOKOSA-N	365.824	3.755	50	40	FHGB	
COC(=O)N/N=C/c1sc(N2CCCCC2)nc1-c1cccs1	3251936	AHMXJQJRAOUDND-MHWRWJLKSA-N	350.469	3.552	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)cc(Cl)c1OC	409231904	LTUCRXOOUYHVGW-NHDPSOOVSA-N	364.804	3.579	50	40	FHGB	
N#C[C@H](C(=O)N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1	409204046	CAUPHKDFHKNGSD-ZFJBLLOBSA-N	374.356	3.612	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/c2cc(Cl)ccc2O)ccc1Cl	32581089	MQBBDKNBDMZBIA-UFWORHAWSA-N	353.205	3.537	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)NC1CCCC1	258433	FPBPNWVGVVHEMU-RVDMUPIBSA-N	350.374	3.611	50	40	FHGB	
CCCc1cc([C@H]2C(C#N)=C(N)Nc3oc(OC)nc32)ccc1OC(C)C	1073906	CWFLBJFLROKJBH-INIZCTEOSA-N	368.437	3.674	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(Br)cc1	4578466	YZXOPYBFJBMNGG-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
COc1cc2ccccc2cc1C(=O)NNC(=O)c1ccc(Cl)cc1	6453915	FRIUAONIHSCOLL-UHFFFAOYSA-N	354.793	3.577	50	40	FHGB	
C#CCOc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2OC)cc1	6735992	FKWKJDQWOVPHFT-HZHRSRAPSA-N	358.397	3.624	50	40	FHGB	
Cn1/c(=N/NC(=O)c2cccc(Cl)c2Cl)sc2ccccc21	12589709	FZNVHKVMBPNMCI-CYVLTUHYSA-N	352.246	3.792	50	40	FHGB	
N#C/C(=C/c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)NCc1ccccc1	16479940	YMVKTSGSPWFUQM-PDGQHHTCSA-N	372.380	3.868	50	40	FHGB	
CCOc1cc(Cl)c(Cl)c(/C=N/NC(=O)c2ccoc2C)c1O	67197048	CJZRXJIWADLXRO-CNHKJKLMSA-N	357.193	3.763	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C/c2cc(Br)ccc2O)c1	408762501	LCUATYQJCSVWDH-KPKJPENVSA-N	373.206	3.709	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2ccccc2)c(C)n1-c1ccccc1C(=O)O	408992568	ANTLSLKOTWUZDT-XKZIYDEJSA-N	361.401	3.556	50	40	FHGB	
O=C(CNC1CCCCC1)N/N=C/c1cccc(OCc2ccccc2)c1	409374977	CLSRAXJGXRXVJR-BUVRLJJBSA-N	365.477	3.638	50	40	FHGB	
O=C(CCCl)Nc1cccc(C(=O)Nc2nnc(-c3ccccc3)o2)c1	9062118	JGTTVTULCYTCGJ-UHFFFAOYSA-N	370.796	3.556	50	40	FHGB	
O=C(NN(c1ccccc1)c1ccccc1)[C@H]1CC(=O)N(C2CCCC2)C1	58391184	ARHVKGGETVGWMW-KRWDZBQOSA-N	363.461	3.647	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2ccc(Br)cc2)cc1	59471516	AKWMJZRDLQRXBQ-XDHOZWIPSA-N	359.223	3.778	50	40	FHGB	
CCOC(=O)/C(C#N)=C(\NCc1ccc(Cl)nc1)SCC(C)C	101654364	UUSFBADZHVSRDP-FYWRMAATSA-N	353.875	3.512	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C(\CC(=O)c1cccs1)C(F)(F)F	103764739	SIQHNBWUUBXCPJ-XSFVSMFZSA-N	354.353	3.598	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CCCc2ccc(OC)cc2C)ccc1O	4544710	ZPLVEHJKUKFZHH-HYARGMPZSA-N	370.449	3.581	50	40	FHGB	
NNC(=O)/C=C/c1ccc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)o1	216909862	DTZNZVXCZGTWCC-DUXPYHPUSA-N	364.245	3.987	50	40	FHGB	
O=C(CCCNc1ncccn1)NNc1c(Cl)cc(Cl)cc1Cl	40128289	AREKYAVYFHLFHE-UHFFFAOYSA-N	374.659	3.772	50	40	FHGB	
CCCCCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C)cc2)cc1	3178037	REWKYSJTGKHKHB-PXLXIMEGSA-N	367.449	3.653	50	40	FHGB	
C=CCOc1ccccc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	4503821	BVKUGHOFSKUFEQ-SFHVURJKSA-N	350.418	3.702	50	40	FHGB	
C/C(CC(=O)Nc1cc(Cl)ccc1Cl)=N\NC(=O)c1ccco1	100527388	KWXHAMPTZJOYQQ-DJKKODMXSA-N	354.193	3.721	50	40	FHGB	
O=C(N/N=C/c1ccccc1O)c1cccc(N2Cc3ccccc3C2)c1	59503617	LYNGGCAFZXMKFI-YDZHTSKRSA-N	357.413	3.676	50	40	FHGB	
C/C(=N\NC(=O)COc1cc(Cl)ccc1Cl)c1ccccc1O	15938476	RZMSLVOMFOEIDZ-VXLYETTFSA-N	353.205	3.618	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)cc1C(=O)O	409169037	PGDXHHBQCPYQRX-MDWZMJQESA-N	370.792	3.983	50	40	FHGB	
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CI)CC1	306366356	FLAQQESCYCGJGK-XYPYZODXSA-N	353.244	3.753	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)CCc2ccccc2)cc1Br	408870034	ROKMEVYGNIJTFT-DEDYPNTBSA-N	374.282	3.598	50	40	FHGB	
CCC[C@H](Br)C(=O)Nc1nc2ccc(NC(C)=O)cc2s1	20132813	YEACUIGMKQJLQW-JTQLQIEISA-N	370.272	3.757	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)COc2ccc(F)cc2F)Sc2ccccc21	102731478	COZFBRSJAUNWLW-PDGQHHTCSA-N	358.369	3.890	50	40	FHGB	
CCOC(=O)c1ccccc1N(Cc1ccccc1C#N)C(=O)CCl	5324496	PPIMWZXOVFLCFF-UHFFFAOYSA-N	356.809	3.507	50	40	FHGB	
C=C(C)C(=O)Nc1ccc(/C(C)=N/NC(=O)c2cc(Cl)ccc2O)cc1	5517833	RRQFAIYZLIUDRU-WSDLNYQXSA-N	371.824	3.714	50	40	FHGB	
COc1cccc(NC(=O)/C(C#N)=C/c2cccn2-c2ccc(O)cc2)c1	5880459	VNLLPMGKVSOLAT-NTCAYCPXSA-N	359.385	3.737	50	40	FHGB	
COC(=O)[C@H]1C(O)=NC(SC)=C(C#N)[C@H]1c1ccc(Cl)cc1Cl	9089065	JXZUVPQUDLTWGP-VXGBXAGGSA-N	371.245	3.934	50	40	FHGB	
C/C(=N/NC(=O)c1ccc(Cl)nc1)c1cc(C)ccc1OC(F)F	84131061	LPZRRSLYLRETKA-FBHDLOMBSA-N	353.756	3.799	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C)c2)cc(SC#N)c1O	409047083	MUPGNTACXDUGJS-AUWJEWJLSA-N	365.414	3.828	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)[C@@H](C)Oc2ccc(C)cc2)cc1	943281	SEVMINYPAMYNSN-HRKXOBMBSA-N	353.466	3.759	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3ccc(F)cc3)c2[C@@H]1c1ccc(F)cc1	1068188	OZDIDZUEUZLQPQ-OAHLLOKOSA-N	350.328	3.573	50	40	FHGB	
CC(C)c1ccc(OCC(=O)N/N=C/c2ccco2)c(Br)c1	1298610	DUAFMYQIBDGGRT-GIJQJNRQSA-N	365.227	3.695	50	40	FHGB	
CC(C)(C)c1cc(/C=C(\C#N)C(=O)N2CCOCC2)cc(C(C)(C)C)c1O	408756460	SAEPSVWKFMGCHQ-LFIBNONCSA-N	370.493	3.753	50	40	FHGB	
CC(C)Oc1cccc(NC(=O)/C(C#N)=C\c2ccc([N+](=O)[O-])cc2)c1	408776246	VWCBNBXIRKKAAG-GDNBJRDFSA-N	351.362	3.928	50	40	FHGB	
N#C/C(=C\c1cccc(OCc2cccc(C#N)c2)c1)C(=O)N1CCCC1	44023299	IFMAUAOUMPJWSV-UDWIEESQSA-N	357.413	3.667	50	40	FHGB	
Cc1ccc(Sc2ccc([N+](=O)[O-])cc2/C=N/C(C#N)=C(\N)C#N)cc1	100143809	ZZGWKXICIOVTER-BHFKZTDGSA-N	363.402	3.691	50	40	FHGB	
COc1ccc(C(=O)N/N=C2/C(=O)c3c(C)cc(C)cc3CC2(C)C)cc1	100134978	JLXKWJGTZIPHBG-ATJXCDBQSA-N	364.445	3.863	50	40	FHGB	in-vitro
COc1ccc(C2=NN(C(=O)CCl)[C@@H](c3ccc(OC)cc3)C2)cc1	4524898	AWMYBOYJFDAHDG-GOSISDBHSA-N	358.825	3.620	50	40	FHGB	
COc1ccc(C2=NN(C(=O)CCl)[C@H](c3ccc(OC)cc3)C2)cc1	4524896	AWMYBOYJFDAHDG-SFHVURJKSA-N	358.825	3.620	50	40	FHGB	
C#CCOc1ccc(Br)cc1/C=N\NC(=O)c1ccc(C)cc1	33347995	AZICWQTZPBHFEV-NDENLUEZSA-N	371.234	3.533	50	40	FHGB	
COc1ccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccccc3)cc2)cc1	408842392	JSRCXYLDKKNCLI-HZHRSRAPSA-N	373.412	3.711	50	40	FHGB	
N#C/C(=C/c1ccc(Br)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	408726505	SGLSZZLGIBUMMD-WQLSENKSSA-N	372.178	3.903	50	40	FHGB	
Cc1cccc(C)c1NC(=O)C(=O)N/N=C/c1ccc(Cl)cc1Cl	3072709	GARWODNARSDBIV-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
COc1cccc([C@@H]2CC(=O)N3CN(C4CCCC4)CSC3=C2C#N)c1	20348142	ZOACPYVPNKAXIA-KRWDZBQOSA-N	369.490	3.653	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Br)cc2)c1C	1209596	MMEQBOIOYLDVFJ-NTEUORMPSA-N	358.239	3.510	50	40	FHGB	
C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OC2CSC2)cc1	2308937	GCDMSRBWADEPLU-XLTHYULKSA-N	372.515	3.812	50	40	FHGB	
COc1cc(/C=C(/C#N)C(N)=O)cc(Cl)c1OCc1ccc(C)cc1	33410118	IRUXXXKFRSXPDA-CHHVJCJISA-N	356.809	3.628	50	40	FHGB	
N#C/C(=C\c1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1ccc2ccccc2c1	36137571	OAVUQWVCSYFQJG-CXUHLZMHSA-N	359.341	3.999	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2cccc(Br)c2)cc1C	1085516	AVPRHDWYNMUPKW-VXLYETTFSA-N	361.239	3.595	50	40	FHGB	
CCc1ccccc1NC(=S)NNC(=O)c1csc2c1CCCC2	6568469	HSTATKNSAKFTPO-UHFFFAOYSA-N	359.520	3.821	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)cc1[N+](=O)[O-]	7993644	ROLUDTQWURBWLT-GIJQJNRQSA-N	363.826	3.799	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc1Br	40867779	USQFEYLYDTYPFD-NTUHNPAUSA-N	360.211	3.518	50	40	FHGB	
Cc1oc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1Br	59401552	DGSBMHORUCPBFA-REZTVBANSA-N	371.618	3.533	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/c2cc(Br)cs2)cc1C	2393341	LLQSPVSHGUNHOX-REZTVBANSA-N	367.268	3.657	50	40	FHGB	
O=C(CCl)n1ccc(/C=C/c2ncc(C(F)(F)F)cc2Cl)n1	6244368	JLFQCVRVNKCART-OWOJBTEDSA-N	350.127	4.000	50	40	FHGB	
CC/C(=N\NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc(O)cc1	16102259	HBBGKCMXNAUIJF-DARPEHSRSA-N	374.440	3.559	50	40	FHGB	
Cc1oc(/C=N/NC(=O)CCSc2ccccc2)cc1Br	408862591	GSCCCTKHFVSCFT-LICLKQGHSA-N	367.268	3.983	50	40	FHGB	
Cc1ccc(NCC(=O)N/N=C/c2ccc(Br)s2)cc1C	408994536	HYPQBCBMXCNLIN-QGMBQPNBSA-N	366.284	3.690	50	40	FHGB	
COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)c1nc2ccc(C)cc2[nH]1	33654861	LCDRTPPNTNXIFW-QPEQYQDCSA-N	364.361	3.861	50	40	FHGB	
N#CCC(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2Cl)cc1	5944519	NFFYDBUFUJFIQB-UFFVCSGVSA-N	362.216	3.936	50	40	FHGB	
O=C(Cc1ccc(F)cc1)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1	4950620	GBFQKZNEHXFSPD-CIAFOILYSA-N	367.336	3.687	50	40	FHGB	
CCOC(=O)Cn1cc(/C=C(/C#N)C(=O)Nc2ccccc2)c2ccccc21	13389577	HNIGVCSCQKVLKV-VBKFSLOCSA-N	373.412	3.750	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(C(C)(C)C)cc1)c1cnn(C(C)C)c1	58462372	RZUVNCGOURWFRI-PXLXIMEGSA-N	356.470	3.681	50	40	FHGB	
CO[C@@](C)(CC(C)C)C(=O)Nc1ccc(OCCBr)cc1	225606147	PMMSUKQEGDHLHK-INIZCTEOSA-N	358.276	3.850	50	40	FHGB	
C[C@@H](Sc1ccccc1)C(=O)NN=C1CCN(Cc2ccccc2)CC1	409339074	DTVUBEXHNREOQH-QGZVFWFLSA-N	367.518	3.935	50	40	FHGB	
Cc1ccc2cc([C@@H]3C(C#N)=C(N)Oc4cc(N)ccc43)c(Cl)nc2c1	876400	GBFKNMXZDGVPSY-GOSISDBHSA-N	362.820	3.997	50	40	FHGB	
C=CCc1cccc(/C=N/NC(=O)[C@H](CC)Nc2ccccc2C)c1O	2742826	MTCBXMQGZHVNCP-OVBDPADQSA-N	351.450	3.770	50	40	FHGB	
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCCO2	3218524	IXFQHXAJPIUWPU-UHFFFAOYSA-N	354.369	3.741	50	40	FHGB	
CC[C@H](C)c1ccc(OCC(=O)N/N=C\c2ccc(OC)cc2OC)cc1	4815581	OYVWTRCIOHCTBR-PXNCGERRSA-N	370.449	3.746	50	40	FHGB	
COc1ccc(OC)c(NC(=O)/C(C#N)=C/c2c[nH]nc2-c2ccccc2)c1	6627869	JXXXNYDKRBSOGL-XNTDXEJSSA-N	374.400	3.640	50	40	FHGB	
CCCc1n[nH]c2c1[C@H](c1ccc(OC)c3ccccc13)C(C#N)=C(N)O2	8568289	JTRXVLKSCHXFNC-GOSISDBHSA-N	360.417	3.742	50	40	FHGB	
C=CCSC1=C(C#N)[C@@H](c2ccc(Cl)cc2)[C@H](C(=O)OC)C(O)=N1	9089197	QZNHHLLQAANDLC-KGLIPLIRSA-N	362.838	3.837	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1Cl	408542444	LQLWOWAORHOEQE-QPEQYQDCSA-N	356.765	3.592	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3cccc([N+](=O)[O-])c3)cc2c1	409186425	BWPYLKALFOGPKL-ODLFYWEKSA-N	353.334	3.504	50	40	FHGB	
COc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1OCc1ccc(C)c(C)c1	408868937	QATSDMRJPHSOOT-FRKPEAEDSA-N	370.836	3.937	50	40	FHGB	
CC[C@@H](C)Oc1c(Cl)cc(/C=N\NC(=O)c2ccco2)cc1OC	33693912	BMPODROIZPYWGB-XEQXHXIFSA-N	350.802	3.883	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c(C)n1C1CCCCC1	8205760	DINUZBITGZYTCG-YWFITGJYSA-N	355.482	3.812	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)c2cc(-c3cccnc3)nc3ccccc23)o1	12591524	VCUURZVXRJAFOA-YDZHTSKRSA-N	356.385	3.962	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(Cl)c(Cl)c1	4852637	YADASVSVHOUKJM-UHFFFAOYSA-N	367.276	3.971	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)CSCc2cc(C)cc(C)c2)c1	59503559	HZNHZXNVNJJCRK-SRZZPIQSSA-N	372.490	3.704	50	40	FHGB	
Cc1ccc(C(=O)OCC(=O)/C(C#N)=C2/Nc3ccccc3S2)s1	6405953	MRBONYZICHWBJW-WJDWOHSUSA-N	356.428	3.735	50	40	FHGB	
COc1ccc2[nH]cc(C(=O)/C(C#N)=C/c3cccc(OC)c3OC)c2c1	44026972	NBXCMUYIASUIKB-NTEUORMPSA-N	362.385	3.984	50	40	FHGB	
CC(C)=C(CO)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C	195752867	VYSYDYMAIVXXFU-UHFFFAOYSA-N	354.566	3.892	50	40	FHGB	
CCCn1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(C2CC2)n1	253397964	GIFIDTSFDVPVAJ-KRWDZBQOSA-N	366.465	3.621	50	40	FHGB	
N#C/C(=C\c1ccc(OC(F)F)cc1)C(=O)Nc1ccc2c(c1)OCO2	3179648	KPKCMHSIKHKURD-KPKJPENVSA-N	358.300	3.562	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2ccccc2OC(F)F)cc1OC	3329122	UTHIYOQOGDHTRR-UKTHLTGXSA-N	374.343	3.851	50	40	FHGB	
O=Cc1[nH]c2ccccc2c1N(C(=O)CCl)c1ccc([N+](=O)[O-])cc1	5100206	QNXUBZBAFFMAAE-UHFFFAOYSA-N	357.753	3.792	50	40	FHGB	
C/C(=N\NC(=O)c1cc2ccccc2cc1O)c1cc2ccccc2oc1=O	13511190	YWECIXGZLCYRMQ-YDZHTSKRSA-N	372.380	3.806	50	40	FHGB	
N#CC1=C(N)n2c(nc3ccccc32)N[C@@H]1c1ccc(OC(F)(F)F)cc1	20086179	FRZCYOVQGRVVAI-OAHLLOKOSA-N	371.322	3.753	50	40	FHGB	
CN(C)c1ccc(/C=C(\C#N)C(=O)OCCCOc2ccccc2)cc1	25402235	YMFIBYVFVUPXSQ-OBGWFSINSA-N	350.418	3.672	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2ccc(OCCC)cc2)cc1OC	409310439	UUMKOMAOQNQCGF-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2c(OC)ccc3ccccc23)c(OC)c1	6646216	XIQIIVAINBKUNR-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
CC(=O)C1=NN(c2ccc(Cl)cc2)C(N)=C(C#N)[C@H]1c1ccccc1	35244690	YPLHAPLMYPBRKA-QGZVFWFLSA-N	350.809	3.583	50	40	FHGB	
COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]1CC[C@@]13OO[C@H](C[C@H]21)[C@@]1(C(C)C)O[C@H]13	104133764	JXEACGHXWMSLSW-VLICXQJASA-N	364.482	3.649	50	40	FHGB	
N#C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	2773948	SUEFMNYTWBCSIL-YRNVUSSQSA-N	372.724	3.702	50	40	FHGB	
C/C(=N\NC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(C(C)(C)C)cc1	4705034	RDYYXORJGGWKDK-KGENOOAVSA-N	369.421	3.812	50	40	FHGB	
C=CCOc1ccc(/C=N\NC(=O)c2ccc(OCC)c(OCC)c2)cc1	409303615	NSKMCYVEWGMQEQ-JCMHNJIXSA-N	368.433	3.813	50	40	FHGB	
COc1cc(Cl)c(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC	408798919	JIKCKFMQGUVFTF-CLFNKMITSA-N	362.857	3.959	50	40	FHGB	
CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccc(Cl)cc1)c1ccccc1	408977029	CFMFVCRJHCVBJV-RSZPVBOMSA-N	373.840	3.668	50	40	FHGB	
N#C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(Br)c1	1211120	HWFZBIBAXUVTNV-XYOKQWHBSA-N	372.178	3.903	50	40	FHGB	
COc1cccc(C(=O)N/N=C/C(Br)=C/c2ccccc2)c1	3183839	HGEXSWSRHAAZGE-FLZPNWGKSA-N	359.223	3.847	50	40	FHGB	
Nc1sc(-c2ccccc2)cc1C(=O)NNC(=S)Nc1ccccc1	642568	VISXYXZEYBAXFT-UHFFFAOYSA-N	368.487	3.629	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(OCCOc2ccc(C)cc2)cc1	15011821	SPINKGUBKWYNHE-JXAWBTAJSA-N	351.402	3.923	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2ccc(Cl)cc2Cl)cc1OC	31729707	RHULAHFIJYZNJU-OCKHKDLRSA-N	353.205	3.775	50	40	FHGB	
N#C/C(=C\c1ccc(OCC(=O)O)cc1)Sc1nc2ccccc2[nH]1	408599557	WJKODZDASGTQOA-NTEUORMPSA-N	351.387	3.683	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1)OCO2	409087790	HQWXBFQKTSFTGO-OVCLIPMQSA-N	350.374	3.668	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CCC(=O)Nc2cccc(Cl)c2C)cc1	3068012	PKJUKYOTRMLUSA-CIAFOILYSA-N	373.840	3.526	50	40	FHGB	
CCOC(=O)c1c(CCl)n(C)c2cc(Br)c(OC)cc12	977822	GDWZNCAZAACFBQ-UHFFFAOYSA-N	360.635	3.865	50	40	FHGB	
Cc1cc(Cl)ccc1O[C@H](C)C(=O)N/N=C/c1ccc(N(C)C)cc1	1458035	DYPLQNPFLFZIDU-STCDJXRXSA-N	359.857	3.632	50	40	FHGB	
C[C@](CC(=O)Nc1ccc(SC#N)cc1F)(C(=O)O)c1ccccc1	8735035	FAYWVYTVHQNANK-GOSISDBHSA-N	358.394	3.770	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2ccc(C#N)cc2F)c(C)n1-c1ccccc1	408966677	MXVZFRYMRDREIY-CFRMEGHHSA-N	360.392	3.869	50	40	FHGB	
COc1ccc(OC)c([C@@H](O)P(=O)(c2ccccc2)c2ccccc2)c1	1766782	RSMCNCDZDWNBLF-NRFANRHFSA-N	368.369	3.709	50	40	FHGB	
CCCOc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1OCC	1837031	HMWDDSCUVNZYFI-LJQANCHMSA-N	368.433	3.689	50	40	FHGB	
COc1cccc(/C=N/NC(=O)COc2cc(C)ccc2C(C)C)c1OC	3167178	BEHRDBBKXAFUIU-WSDLNYQXSA-N	370.449	3.665	50	40	FHGB	
CCOC(=O)N/N=C/c1cn(CCOc2ccccc2)c2ccccc12	4117480	XTTDQRXDEGFGOL-KGENOOAVSA-N	351.406	3.800	50	40	FHGB	
O=C(CCCOc1ccc(Cl)cc1Cl)N/N=C/c1cccnc1	6242722	QGPVYLMLTCOJHC-RGVLZGJSSA-N	352.221	3.698	50	40	FHGB	
Cc1cccc(NC(=S)NNC(=O)c2ccc(Cl)cc2Cl)c1	15887702	JWITVECIUYZSLY-UHFFFAOYSA-N	354.262	3.933	50	40	FHGB	
O=C1OC(=O)[C@H]2[C@H]1[C@@]1(c3ccccc3)O[C@@]2(c2ccccc2)c2ccccc21	100494309	LXGWNCJNLUFEQL-CHOVIJNXSA-N	368.388	3.533	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)cc1OC	408972684	UNRKLARPNITGMP-CIAFOILYSA-N	368.389	3.613	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)ccc1O	409136049	WFTFNZDKGZRHOO-PVGUKEHMSA-N	358.463	3.730	50	40	FHGB	
C/C(CCc1ccccc1)=N/NC(=O)C(=O)Nc1ccc(Cl)cc1C	59515758	HVROKNKERJIQGJ-HMAPJEAMSA-N	357.841	3.712	50	40	FHGB	
C/C(CC(=O)Nc1cc(Cl)ccc1Cl)=N\NC(=O)c1ccccn1	100927699	BANPZXDOAUXQMB-UFFVCSGVSA-N	365.220	3.523	50	40	FHGB	
O=C(CNC1CCCCC1)N/N=C/c1ccc(-c2ccc(Cl)cc2)o1	409369745	FTMMTXFDDPPZDB-WSDLNYQXSA-N	359.857	3.972	50	40	FHGB	
CCN(CC)c1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1[N+](=O)[O-]	5322078	QFCNCGFZYAQODK-IBGZPJMESA-N	364.405	3.659	50	40	FHGB	
C/C(=N\NC(=O)c1ccco1)c1cccc(NC(=O)c2ccc(F)cc2)c1	5621219	WLLNFGVUKCOUCY-YDZHTSKRSA-N	365.364	3.825	50	40	FHGB	
N#CCn1cc(/C=N/NC(=O)c2ccccc2-n2cccc2)c2ccccc21	107618342	HOGXERWHQSTZRF-BUVRLJJBSA-N	367.412	3.719	50	40	FHGB	
COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(Cl)cc(OC)c2)cc1	408882542	OXXWMWYXNFNVIQ-VGOFMYFVSA-N	370.792	3.681	50	40	FHGB	
C#CCn1cc(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2)c2ccccc21	1462492	BIGBYVVGQDVWAQ-QGOAFFKASA-N	369.424	3.506	50	40	FHGB	
CCOC(=O)/C(C#N)=C/c1ccc(SCc2ccco2)c([N+](=O)[O-])c1	1856538	ZEPUUVIRGHGCLB-MDWZMJQESA-N	358.375	3.950	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c(C)n1-c1ccccc1	38153439	SEYAPTRPGUOMQI-FYJGNVAPSA-N	362.389	3.766	50	40	FHGB	
Cc1cccc(NC(=O)N/N=C\c2cc(Br)c(N(C)C)o2)c1	408854216	ZWODCAZGVCWJCR-MFOYZWKCSA-N	365.231	3.572	50	40	FHGB	
O=C(N/N=C/c1ccc2ccccc2c1)c1cccc(Cn2cccn2)c1	1081936	SEQFKWFHXDNQEO-HZHRSRAPSA-N	354.413	3.849	50	40	FHGB	
C[C@@H]1CN(c2ccc(/C=C(\C#N)c3nc4ccccc4n3C)o2)C[C@@H](C)O1	4134670	QPLPZBAEMBDUPW-BAQSSVPWSA-N	362.433	3.844	50	40	FHGB	
CC/C(Cc1ccccc1)=N\NC(=O)CCC(=O)Nc1ccc(OC)cc1	5633727	PBNUOZNYYQDHNG-HAVVHWLPSA-N	367.449	3.539	50	40	FHGB	
CC(=O)OC1=C(C)C2=C3OC(=O)C(C)=C3CC[C@@]2(C)[C@H](Cl)[C@@H]1Cl	6050440	YVGHSBLNSIYVSA-SRCQZFHVSA-N	357.233	3.979	50	40	FHGB	
CCOC(=O)c1cn(CCCCl)c2ccc(C(F)(F)F)cc2c1=O	199731472	GRRGTMPKOLVSGM-UHFFFAOYSA-N	361.747	3.826	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc3c(c1)OCO3)C(C#N)=C(O)O2	408729779	CTOWBBJRDQJDAL-IBGZPJMESA-N	373.368	3.727	50	40	FHGB	
CC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	408806635	FYEOLKGZGZZNNG-OQZOHAQUSA-N	369.377	3.685	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3cc(OC)ccc3OC)cc2c1	409186355	AVDXQUISNOMTMN-MTJSOVHGSA-N	368.389	3.613	50	40	FHGB	
COC(=O)[C@H](c1ccccc1)[C@@](CBr)(OC)c1ccccc1	1593548	MRFSAIICLWMCNZ-WMZOPIPTSA-N	363.251	3.880	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccc2)c(C)n1-c1cccc([N+](=O)[O-])c1	59427220	VDQKBVRSRMZMIF-FYJGNVAPSA-N	362.389	3.766	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(Cl)c1	9190617	BKONSGQIGXORAG-FBCYGCLPSA-N	351.189	3.794	50	40	FHGB	
C[C@]12CC[C@@H]3[C@@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@H]1CC[C@@]2(O)C#N	70669780	VRSHJJXUDZAQKD-COXXTLHVSA-N	357.494	3.947	50	40	FHGB	biogenic
C#CCn1c(C)c(/C=N/NC(=O)Cc2ccc(CC)cc2)c2ccccc21	409365068	SKJHYGOVMMUMER-LFVJCYFKSA-N	357.457	3.838	50	40	FHGB	
COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)c(Cl)c2)cc1	408794094	HLSBZVHLXPVVHJ-NTEUORMPSA-N	370.792	3.681	50	40	FHGB	
COc1ccc(Br)cc1[C@H]1NC(=O)NC(C(C)(C)C)=C1C#N	409371222	GDNLNUWRQFOKCR-CYBMUJFWSA-N	364.243	3.635	50	40	FHGB	
C/C(=N\NC(=O)Cc1cc(Cl)ccc1Cl)c1nc2ccccc2[nH]1	95116820	JTFPTFVAPAHEGI-LSHDLFTRSA-N	361.232	3.953	50	40	FHGB	
COc1ccc2c(Cl)c(C(=O)NNC(=O)c3ccccc3C)sc2c1	674952	IJFXODQDQBZLGS-UHFFFAOYSA-N	374.849	3.947	50	40	FHGB	
COC(=O)c1c(C)[nH]c(C(=O)/C(C#N)=C/c2ccc(OC(F)F)cc2)c1C	4278944	OLLQRBOOSAWEJK-MDWZMJQESA-N	374.343	3.809	50	40	FHGB	
C/C(=N/NC(=O)c1ccc(C)cc1)c1ccc(NC(=O)C(F)(F)F)cc1	4647041	QEAIWGJYJGIHLQ-FMCGGJTJSA-N	363.339	3.650	50	40	FHGB	
CCCCSC1=C(C#N)[C@@H](c2ccc(OCC)c(OC)c2)CC(=O)N1	12276365	GBZWJCOHXNPFGA-CQSZACIVSA-N	360.479	3.966	50	40	FHGB	
N#C/C(=C\c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccccc1F	33796861	SGTMGBVYZQELGE-RVDMUPIBSA-N	353.353	3.635	50	40	FHGB	
N#CC1=C(SCC(=O)c2ccccc2)NC(=O)C[C@@H]1c1ccccc1F	2366940	YNSQYYULZLNCMG-OAHLLOKOSA-N	366.417	3.780	50	40	FHGB	
O=C(CCC1CCCC1)NNC(=O)CSc1nc2ccccc2s1	2661090	DZFHOJIVHQMPGE-UHFFFAOYSA-N	363.508	3.506	50	40	FHGB	
O=C(N/N=C/c1ccc(O)c(O)c1)[C@H]1CC1(c1ccccc1)c1ccccc1	5602570	PYAJTUMHESZCMR-IERINAHZSA-N	372.424	3.554	50	40	FHGB	
N#CC1=C(N)OC2=C(CNC/C2=C/c2cccs2)[C@@H]1c1cccs1	8783244	JTRAECBFPAEOIY-MRDWYFFCSA-N	353.472	3.558	50	40	FHGB	
CCN(CC)c1ccc(/C=N\NC(=O)COc2cccc(Cl)c2)cc1	30802343	AUUOHBULODOHHT-BKUYFWCQSA-N	359.857	3.715	50	40	FHGB	
CCc1ccc(OCC(=O)N/N=C\c2cccc(Br)c2)cc1	33387043	PRLIPTQWGRXDCF-ODLFYWEKSA-N	361.239	3.541	50	40	FHGB	
CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(C[C@@H](C)CC2)[C@H]1c1ccccc1	35193552	AQSFJZCHQMDSTI-BPSNYSSFSA-N	361.445	3.710	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccc(Cl)cc2Br)o1)C(N)=O	252492453	MMTLMGKBARAGSU-YVMONPNESA-N	351.587	3.755	50	40	FHGB	
O=[N+]([O-])c1ccc([P@](=O)(Cc2ccccc2)c2ccccc2O)cc1	2248776	XOZATYLLJKPRJJ-RUZDIDTESA-N	353.314	3.815	50	40	FHGB	
Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)n1	408980466	WSYBTQCRIBUIMC-XNTDXEJSSA-N	362.345	3.916	50	40	FHGB	
Cc1ccc(SCC(=O)NN=C2CCN(Cc3ccccc3)CC2)cc1	409339888	MMZVQRMSKYJDEP-UHFFFAOYSA-N	367.518	3.855	50	40	FHGB	
CC(C)(Br)C(=O)Nc1ccc(OCCBr)cc1	225594113	GLXHOELVEFQXGT-UHFFFAOYSA-N	365.065	3.572	50	40	FHGB	
CCCn1nc(C2CC2)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	253394116	AGMOAZTWHACRDG-SFHVURJKSA-N	366.465	3.621	50	40	FHGB	
C=CCc1ccccc1OCC(=O)N/N=C/c1ccccc1OCCC	2165987	ZDCOBPOECVRPPG-PXLXIMEGSA-N	352.434	3.733	50	40	FHGB	
CCCCc1ccc(OCC(=O)N/N=C/c2ccc(OC)c(OC)c2)cc1	3050659	QZMRKCLNVFLVHA-HYARGMPZSA-N	370.449	3.576	50	40	FHGB	
CCc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(Cl)cc2)cc1	3101345	RXYTXQCADHWYRY-FYJGNVAPSA-N	357.841	3.771	50	40	FHGB	
Cc1cc(N(CCCl)CCCl)ccc1/C=N/NC(=O)c1ccco1	704276	YUSOZANRPRLVOT-UDWIEESQSA-N	368.264	3.636	50	40	FHGB	
O=C(COc1ccccc1)N/N=C(/CC(=O)c1ccccc1)c1ccccc1	100006537	TWDIONGSGCADRW-FLFQWRMESA-N	372.424	3.859	50	40	FHGB	
O=C(N/N=C/c1ccc(N2CCCC2)o1)c1ccc(Cl)cc1Cl	59138200	CGXMXDNMVDLJQD-VXLYETTFSA-N	352.221	3.951	50	40	FHGB	
N#C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	2773777	BJMXYYQRVBPSFU-YRNVUSSQSA-N	372.724	3.702	50	40	FHGB	
N#C/C(C(=O)c1c[nH]c2ccccc12)=C1\SCC(=O)N1c1ccccc1	4483159	XEMHIVMKNZBIQK-HMMYKYKNSA-N	359.410	3.866	50	40	FHGB	
CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1OCC	8916582	RHYYPNRBEGUGOT-HXUWFJFHSA-N	366.417	3.798	50	40	FHGB	
CCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1[N+](=O)[O-]	408925246	QRVUQGLJAPMBBO-RVDMUPIBSA-N	351.362	3.848	50	40	FHGB	
Cc1ccc(OCCSC2=C(C#N)[C@H](c3ccco3)CC(=O)N2)cc1	409140351	RLIBUGFAVVRHIV-OAHLLOKOSA-N	354.431	3.739	50	40	FHGB	
C/C(=N/NC(=O)c1c[nH]c2ccccc12)c1cccc(NC(=O)C2CC2)c1	695312	ULYTYPWIAMDNPC-CFRMEGHHSA-N	360.417	3.670	50	40	FHGB	
Cc1ccc(C(C)C)cc1OCC(=O)N/N=C/c1ccc(N(C)C)cc1	710846	DYCVDVCTFZKJHF-LPYMAVHISA-N	353.466	3.714	50	40	FHGB	
C[C@@H]1C[C@@H]2[C@H]3CCC4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@@H](O)C[C@]2(C)/C1=C(\O)C=O	256967652	TYYMPHSFTLTHRI-RQICIPTCSA-N	374.452	3.614	50	40	FHGB	
CN(C)c1ccc(/C=C(/C#N)C(=O)Nc2cccc(Br)c2)o1	408756186	OGUSLDUGVGVWQU-FLIBITNWSA-N	360.211	3.654	50	40	FHGB	
Cc1oc(/C=N/NC(=O)CSCc2ccccc2)cc1Br	408843871	UMBIPKJKYRTWFA-CAOOACKPSA-N	367.268	3.734	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N\NC(=O)Cc3ccc(F)cc3)c2C)nc1	409250750	SAJVPDDJEVFRSL-CFRMEGHHSA-N	364.424	3.629	50	40	FHGB	
CC(=O)N/N=C/c1cc(Br)ccc1OCc1ccc(F)cc1	1095381	QJAIQTNNNFCOCA-DJKKODMXSA-N	365.202	3.637	50	40	FHGB	
N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3\C[C@H]4C=CC[C@H]34)cc2)cc1	20791461	HXGHNTSONLLCSQ-GTMBIQOBSA-N	357.413	3.672	50	40	FHGB	
N#C/C(=C/c1ccc([N+](=O)[O-])o1)c1ccc(I)cc1	409372529	DVXUBBWWKUMTKG-YFHOEESVSA-N	366.114	3.857	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl)c1ccncc1	6259848	MCCZOYYJMWRCOM-KKBVUKDESA-N	352.221	3.696	50	40	FHGB	
O=C(COc1ccc(-c2ccccc2)cc1)N/N=C\c1ccc2c(c1)OCO2	30840548	GMCJJIFICYWEFJ-QRVIBDJDSA-N	374.396	3.611	50	40	FHGB	
O=C(N/N=C/c1ccco1)c1cccc(NC(=O)c2ccc(Cl)cc2)c1	704616	NMMYCZGZEXOOII-CIAFOILYSA-N	367.792	3.949	50	40	FHGB	
COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3c2sc2ccccc32)cc1	3229999	VWQFDTIVJRSAQZ-INIZCTEOSA-N	362.410	3.906	50	40	FHGB	
Cc1cc(NC(=O)/C(C#N)=C/c2cccc([N+](=O)[O-])c2)n(-c2ccccc2)n1	3305714	NQRGAHIURMLQHI-LFIBNONCSA-N	373.372	3.635	50	40	FHGB	
CCOc1ccc(-c2n[nH]c3c2[C@@H](c2cccs2)C(C#N)=C(N)O3)cc1	4453079	ORUUXFXKHJBTRQ-OAHLLOKOSA-N	364.430	3.755	50	40	FHGB	
Cc1cc(Br)cc(/C=N\NC(=O)c2ccc(Cl)cc2)c1O	4814104	GUHRWIQALUNWFK-LSCVHKIXSA-N	367.630	3.880	50	40	FHGB	
N#C/C(=C\c1ccccc1)C(=O)Nc1ccccc1I	5772035	XRNNYWKRLLXUFV-JLHYYAGUSA-N	374.181	3.837	50	40	FHGB	
O=C(Cc1ccc(Br)cc1)N/N=C/c1cccc(Cl)c1	5816393	WLYRFHCXQUUOLO-VCHYOVAHSA-N	351.631	3.795	50	40	FHGB	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccccc1Cl	7649847	UPIVOKVPRLOZGY-CYBMUJFWSA-N	368.820	3.722	50	40	FHGB	
N#C/C(=C\c1cc(Cl)c2c(c1)OCCCO2)C(=O)Nc1nccs1	8221012	GGNPBUFHNWQCMZ-IZZDOVSWSA-N	361.810	3.503	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(C(C)(C)C)cc1	14407920	YVARFFBAWNCKIR-KGENOOAVSA-N	353.422	3.975	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1cccc(C)c1C	408815367	WLLGRDSYFYOQNP-LDADJPATSA-N	360.413	3.870	50	40	FHGB	
CC(C)Oc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1	803902	ZXNQTBDYPSWINW-GOSISDBHSA-N	374.396	3.798	50	40	FHGB	
CCN(CC)C(=O)[C@@H](Br)[C@H](Br)c1ccccc1	1690345	ZNLSNPVEZHLCGQ-NEPJUHHUSA-N	363.093	3.755	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc(F)c(F)c1)C(C#N)=C(N)O2	968900	AIVSLNGPGJYHMR-GOSISDBHSA-N	364.355	3.677	50	40	FHGB	
O=N[C@@H]1[C@H]2C[C@H]([C@@H]3[C@H]2C[C@H](Br)[C@@H]3Br)[C@@H]1Cl	4934503	GKAXFKDNWWJFFR-OAJIBOLCSA-N	357.473	3.542	50	40	FHGB	
C=CCc1cc(/C=N/NC(=O)c2ccccc2Cl)cc(OCC)c1O	59249311	HFVFJGVZCATATK-CIAFOILYSA-N	358.825	3.937	50	40	FHGB	
O=C(NN(c1ccccc1)c1ccccc1)[C@H]1CCCN(c2cnccn2)C1	45262730	GIJZLBJXHXIWCS-SFHVURJKSA-N	373.460	3.563	50	40	FHGB	
COc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)cc1	63278726	GUCGAURKYKGEPJ-OVCLIPMQSA-N	373.368	3.604	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=N/NC(=O)OC(C)(C)C)cc1OCC	408808853	GVMNQSHOQOITIE-YBFXNURJSA-N	352.818	3.609	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(NC(=O)[C@@]2(C)CC2(Cl)Cl)cc1	98002316	YOTHTVWHFJHBEZ-IYCSXQJISA-N	367.232	3.679	50	40	FHGB	
C/C(=N\NC(=O)NC[C@H]1CCCO1)c1cc2c(ccc3ccccc32)o1	98055369	WXZYJGRWLBWCSD-IKMPRTQCSA-N	351.406	3.788	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(I)cc1)c1cccs1	408711723	HRDGBVKIOGBQSQ-OQLLNIDSSA-N	370.215	3.507	50	40	FHGB	
Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(-c3ccccc3C(=O)O)o2)n1	408976015	DPPHEZRXSWITBA-GXDHUFHOSA-N	361.357	3.706	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)Sc1ccc(C)cc1)c1ccc([N+](=O)[O-])cc1	409129668	VURGBCOPZYXDAY-ITRAFESCSA-N	357.435	3.924	50	40	FHGB	
CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)c3ccncc3)c2C)cc1	3324378	ZZDHFPWTVBVXQP-OEAKJJBVSA-N	362.433	3.652	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2Cl)ccc1OCC#N	3616042	VMNMAIRBJDCNKV-GXDHUFHOSA-N	367.792	3.797	50	40	FHGB	
O=C(N/N=C/c1cccc(Br)c1)c1cc(-c2ccccc2)n[nH]1	9007888	UEOMKBAEGWIHQU-YBFXNURJSA-N	369.222	3.603	50	40	FHGB	
Cc1oc(C)c2c(=O)ccc3c(c12)OC(N)=C(C#N)[C@H]3c1ccccc1F	807681	GSRBRZNWQJFKME-IBGZPJMESA-N	362.360	3.767	50	40	FHGB	
COc1ccc(-c2nc3cc(N4C[C@@H](C(=O)Cl)CC4=O)ccc3o2)cc1	57327069	HKYGKAKULQGCSE-LBPRGKRZSA-N	370.792	3.622	50	40	FHGB	
COc1cc(/C(O)=C(\C#N)c2nc3ccccc3[nH]2)cc(OC)c1OC	100572675	FBJGRQIMSDTOLC-ATVHPVEESA-N	351.362	3.539	50	40	FHGB	
Cc1cc(C)c(C#N)c(SCC(=O)C(C#N)=C2Nc3ccccc3N2)n1	4371863	ASDRGXHFPCWENR-UHFFFAOYSA-N	361.430	3.504	50	40	FHGB	
C[S@@](=O)c1ccc(C(=O)NN=C(c2ccccc2)c2ccccc2)cc1	65492468	XPOYJZQKKLMFQS-SANMLTNESA-N	362.454	3.606	50	40	FHGB	
COc1ccc(NC(=O)N/N=C/c2ccc(N3CCCC3)c(C)c2)cc1	408846929	KRILWTASLNHVLW-KGENOOAVSA-N	352.438	3.759	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)CNc2c(C)cccc2C)cc1OCC	30738373	MQQBHIZYZHNYAU-QRVIBDJDSA-N	369.465	3.663	50	40	FHGB	
CCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC)cc2)cc1	40868286	OWVPJSKTZMKMGQ-GHRIWEEISA-N	364.401	3.808	50	40	FHGB	
Cc1ccc(SCCC(=O)N/N=C/c2ccc(OCC#N)cc2)cc1	17420006	ZZNQGDKXAWSIAR-KGENOOAVSA-N	353.447	3.530	50	40	FHGB	
Cc1ccc(-c2cc(C(=O)NN)c3cc(Br)ccc3n2)cc1	6277518	BFNXDXOLDLQAJJ-UHFFFAOYSA-N	356.223	3.576	50	40	FHGB	
O=C(NCCc1ccccc1)c1ccc(N(CCCl)CCCl)cc1	1736830	SBGRGQIIVPEBQP-UHFFFAOYSA-N	365.304	3.943	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2cc(C(C)C)c(OC)cc2C)cc1	4544369	QSGJNCWLZFUVPN-LPYMAVHISA-N	354.450	3.828	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2cc3ccccc3o2)c(C)n1-c1ccccn1	15229686	PDXYTCAQLVAPHI-QRVIBDJDSA-N	358.401	3.999	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2cc3cc(C)ccc3nc2Cl)cc1	19862591	TXRGRZMKBJBHNR-SRZZPIQSSA-N	353.809	3.969	50	40	FHGB	
COc1cc(OC)c(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)c(OC)c1	408568312	IWUNLKWJWBWDDZ-WDZFZDKYSA-N	353.353	3.792	50	40	FHGB	
CCCOc1cccc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)c1	408935125	GVKAWOLRBNOXDO-GDNBJRDFSA-N	351.362	3.929	50	40	FHGB	
CCOC(=O)[C@H](CC)/C(C)=N\NC(=O)COc1cc(C)ccc1C(C)C	408950089	GIYWFAGYLNTSJS-KQRQPNSISA-N	362.470	3.579	50	40	FHGB	
Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)n1	408978497	MMIYSTQIWPIZBW-MHWRWJLKSA-N	361.357	3.706	50	40	FHGB	
N#C[C@]1(c2ccccc2)O[C@@H](C(=O)c2ccccc2)C[C@H]1Br	4783370	RABTWZKKSGXMPG-JFIYKMOQSA-N	356.219	3.841	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(O[C@@H](C)C(=O)O)cc2)cc1C	59249694	VJXISLOGQBTYRT-ZCQLHAAUSA-N	364.401	3.701	50	40	FHGB	
Cc1cccc(OCC(=O)NNC(=O)c2sc3ccccc3c2Cl)c1	4589246	CZYXYYWNRAKSEE-UHFFFAOYSA-N	374.849	3.703	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)[C@@H](C)Oc2ccccc2Br)cc1	994251	IGQQNPFAPDYVIC-OTGIAGGSSA-N	361.239	3.675	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C/c2ccc(OC(C)C)c(OC)c2)cc1	10475968	UTHYWGZBHCRQKU-HYARGMPZSA-N	370.449	3.574	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)c(C)n1-c1ccccc1	9311047	SEYAPTRPGUOMQI-BKUYFWCQSA-N	362.389	3.766	50	40	FHGB	
CCN(NC(=O)Cc1csc(Cc2ccccn2)n1)c1ccc(C)cc1	45007609	IWEBNXUJCMACPT-UHFFFAOYSA-N	366.490	3.538	50	40	FHGB	
N#CC1=C(SCCOc2ccccc2)NC(=O)C[C@H]1c1cccs1	409132053	KUBVSLZUJQMBIL-CQSZACIVSA-N	356.472	3.899	50	40	FHGB	
COc1cccc(/C=N/NC(=O)[C@@H](C)Nc2ccc3ccccc3c2)c1O	1095719	FSVAFLXQOBQMOR-CYGNYLSHSA-N	363.417	3.505	50	40	FHGB	
CCC[C@H](Br)C(=O)NCCC(=O)Nc1ccc(C(C)C)cc1	15423134	DQQSKDGMOOKZAA-HNNXBMFYSA-N	369.303	3.818	50	40	FHGB	
C/C(=N\NC(=O)c1cc(-c2ccc(Cl)cc2)n[nH]1)c1cccc(O)c1	13618268	VIZFIOWQPKIHPQ-RGVLZGJSSA-N	354.797	3.590	50	40	FHGB	
O=C(c1ccccc1)c1cc(CN(CCCl)CCCl)c(O)cc1O	1701300	DKYDKGFPOXJBJZ-UHFFFAOYSA-N	368.260	3.608	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(Br)cc2)cc1O	408762874	LNJXSACMSDQVRV-WQLSENKSSA-N	373.206	3.709	50	40	FHGB	
CCCc1[nH]nc2c1[C@H](c1c(OC)ccc3ccccc13)C(C#N)=C(N)O2	6664705	VGIQRIQAQIEBJT-SFHVURJKSA-N	360.417	3.742	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)[C@@H]2[C@H](C=C(Cl)Cl)C2(C)C)ccc1O	4811689	HXJAIYPOVGPKRG-JUEUBRAISA-N	371.264	3.832	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)CCSc2ccc(C)cc2)cc1	409131003	JDBIJRCVRPKUCL-PXLXIMEGSA-N	369.490	3.976	50	40	FHGB	
CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)/C1=C\Nc1ccc(F)cc1	16693900	FPEJKYFJMNXWDQ-UNOMPAQXSA-N	361.376	3.531	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@H](c1c(F)cccc1F)C(C#N)=C(N)O2	659941	ZCYOFWNOLTXMBC-QGZVFWFLSA-N	364.355	3.677	50	40	FHGB	
N#CC1=C(SCCOc2ccccc2)NC(=O)C[C@@H]1c1cccs1	409132052	KUBVSLZUJQMBIL-AWEZNQCLSA-N	356.472	3.899	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1cccc(C)c1	408837194	ZTWZBMPVMVYAQB-LFIBNONCSA-N	350.374	3.638	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C)c2)cc(OC)c1OC	215873211	MZVOVAPYKRDLMB-DHDCSXOGSA-N	352.390	3.567	50	40	FHGB	
CC(=O)Nc1cccc(C(=O)N/N=C\c2cc(Cl)ccc2OC(C)C)c1	107566810	PUFGSUREFMKCLN-NHDPSOOVSA-N	373.840	3.850	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)COc2ccc(Cl)cc2)cc1Cl	409141434	NVAOFSQXGHPXPJ-JMIUGGIZSA-N	367.232	3.921	50	40	FHGB	
CCOc1c(Cl)cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1Cl	5408504	WHBCBCFCHIAADM-ZDUSSCGKSA-N	365.220	3.642	50	40	FHGB	
CCc1ccc(CC(=O)N/N=C\c2cc(Cl)c(OC)cc2OC)cc1	409364528	PZHGUOAVYRTJMN-MTJSOVHGSA-N	360.841	3.612	50	40	FHGB	
C#CCOc1ccc(OC)cc1/C=N\NC(=O)c1cccc2ccccc12	408567286	LJRSWUAFXFWYMN-HAHDFKILSA-N	358.397	3.624	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)c(OC)c1	5358150	OTGXXZTYZRNRJY-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
CC(C)Oc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1	107751771	DCERJHIUOBZNLI-YBEGLDIGSA-N	350.374	3.718	50	40	FHGB	
COC(=O)N/N=C/c1c(C)n(Cc2ccc([N+](=O)[O-])cc2)c2ccccc12	4091861	HECXWALRTJHJOQ-RGVLZGJSSA-N	366.377	3.596	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(O)c(OCC)c3)cc2c1	409187201	NIGYSIUAGMOVHK-MTJSOVHGSA-N	368.389	3.700	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3ccc(N(C)C)cc3)cc2c1	409186517	DEBPDPVSYXAYNS-BKUYFWCQSA-N	351.406	3.661	50	40	FHGB	
COc1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)CCl)cc1OC	72413342	GZBIFDCOYSBXDA-MRXNPFEDSA-N	358.825	3.620	50	40	FHGB	
C=CCc1ccccc1OCC(=O)N/N=C/c1ccc(N(CC)CC)cc1	3174441	RZNLODWZEQUMAL-XQNSMLJCSA-N	365.477	3.790	50	40	FHGB	
CC(=C/c1ccccc1)/C=N/NC(=O)CSc1nc2ccccc2[nH]1	1791116	KJSVTCUSILHPSB-BHFKYQIGSA-N	350.447	3.861	50	40	FHGB	
ClCCN(CCCl)c1ccc(-n2cnc3c(Cl)ncnc32)cc1	1718768	QRPGGRCHUPLCMK-UHFFFAOYSA-N	370.671	3.753	50	40	FHGB	
O=C(Cc1cccs1)NNC(=O)c1sc2ccccc2c1Cl	2651360	HAHKWTFZFAWFTR-UHFFFAOYSA-N	350.852	3.620	50	40	FHGB	
CCOc1ccccc1OCC(=O)N/N=C/c1c(Cl)cccc1Cl	3266728	UGNJBTMPPCWASW-KEBDBYFISA-N	367.232	3.921	50	40	FHGB	
C/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1	4587732	GYOUDIGGYXNWBZ-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
C/C(=N\NC(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc([N+](=O)[O-])cc1	5725304	NVAAIRCICNJFKY-CIAFOILYSA-N	356.426	3.587	50	40	FHGB	
Cc1cccc(N2C(=O)CS/C2=N\NC(=O)c2ccc(Cl)cc2)c1C	12708495	MWOLUYVLSMEKSM-UZYVYHOESA-N	373.865	3.738	50	40	FHGB	
O=C(CNc1cccc(C(F)(F)F)c1)N/N=C1/CCCc2ccccc21	33737377	IBXQHYJGWBWJKS-ULJHMMPZSA-N	361.367	3.974	50	40	FHGB	
N#C/C(=C\Nc1ccc(F)c(F)c1)S(=O)(=O)c1ccc(Cl)cc1	102673285	TYJJMGQZVHTXMJ-UKTHLTGXSA-N	354.765	3.869	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@H]1c1ccccc1F	705921	BQGKWIVFWMSVIV-KRWDZBQOSA-N	364.376	3.608	50	40	FHGB	
CCOC(=O)c1c(C)[nH]c(C(=O)/C(C#N)=C/c2ccccc2OCC)c1C	5155577	UOVYDNDVODESTA-LFIBNONCSA-N	366.417	3.997	50	40	FHGB	
CC(C)(C)c1ccc([C@@H]2C[C@@H]2C(=O)N/N=C\c2ccc(C(=O)O)cc2)cc1	30802726	XYIDJLMIMJSDJT-HNGNLUIFSA-N	364.445	3.936	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccc2N)c(C)n1-c1ccc(F)cc1	408590569	PRNFCJCHPVCPRF-FSJBWODESA-N	350.397	3.579	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)Cc2cccc(C(F)(F)F)c2)ccc1O	408756568	ZXXZUIFVJOLTIM-SSDVNMTOSA-N	366.339	3.503	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cccc(Cl)c1C)OCO2	409103696	BFRZHYOJLPIEEP-AWNIVKPZSA-N	370.792	3.931	50	40	FHGB	
COc1cc(/C=C(/C#N)c2ccc3c(c2)OCO3)cc(Br)c1O	409366750	XXZDNUSFODXZRN-QCDXTXTGSA-N	374.190	3.956	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1cccnc1	809055	IZTIHJRYWASDRG-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
COc1ccc(O)c(/C=N/NC(=O)[C@@H](C)Nc2ccc3ccccc3c2)c1	1092183	SFKQBJDXQDFAKS-CYGNYLSHSA-N	363.417	3.505	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C/c1ccccc1C(F)(F)F	3173323	UWPCPTZXVXHSGX-ZVBGSRNCSA-N	356.731	3.888	50	40	FHGB	
Cc1cc(C)c2nc(NNC(=O)c3cc(=O)c4ccccc4o3)sc2c1	4121452	ZLJGCTZTGNZTKK-UHFFFAOYSA-N	365.414	3.776	50	40	FHGB	
COc1cc(/C=N/NC(=O)Cc2ccc(C)cc2C)ccc1OC(C)C	20195102	LTUVCXKVQYPTJK-LPYMAVHISA-N	354.450	3.792	50	40	FHGB	
Nc1c(C(=O)N/N=C\c2ccccc2)sc(=S)n1-c1ccccc1	31851273	RYVNVHBCCXWZPT-ODLFYWEKSA-N	354.460	3.614	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@H]2C[C@H]3C[C@H]2[C@H](CBr)C3)cc1	169807542	SSOHWXRVPHYKLJ-DHMWGJHJSA-N	359.285	3.510	50	40	FHGB	
CCCC[C@@](C)(OC)C(=O)Nc1ccc(OCCBr)cc1	225618169	NFKORKKKYWWZSL-MRXNPFEDSA-N	358.276	3.994	50	40	FHGB	
CCOC1(C(=O)Nc2ccc(OCCBr)cc2)CCCC1	225706479	UBJBKCKKNHQAQG-UHFFFAOYSA-N	356.260	3.748	50	40	FHGB	
N#C/C(=C/c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1	254971311	YFZQIYFKWUAKKK-WQLSENKSSA-N	372.178	3.903	50	40	FHGB	
COc1ccc(Cl)cc1/C=C(/C#N)C(=O)Nc1cccc(C(=O)O)c1	408543179	MZMQAZUDZFKXBZ-QPEQYQDCSA-N	356.765	3.592	50	40	FHGB	
CC(C)Oc1cccc(NC(=O)/C(C#N)=C\c2cccc([N+](=O)[O-])c2)c1	408771757	IOYVUJBZNGOHGC-DHDCSXOGSA-N	351.362	3.928	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(-c3cccc(C(=O)O)c3)o2)cc1	409361015	OOEPWULSRIGMFY-LPYMAVHISA-N	362.385	3.646	50	40	FHGB	
C=C1C(C)(C)[C@H]2CC[C@]1(C(=O)NNC(=O)[C@@]13CC[C@@H](C1)C(C)(C)C3=C)C2	1448424	HFZJKRKZPFNURH-QDGJQWLKSA-N	356.510	3.899	50	40	FHGB	
CN1CCC(=NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)CC1	55075748	MHICWCQJBUDOGB-UHFFFAOYSA-N	358.445	3.713	50	40	FHGB	
Cc1cccc(-c2nc3cc(N4C[C@@H](C(=O)Cl)CC4=O)ccc3o2)c1	57327048	CYRNBSWLDPWXJX-ZDUSSCGKSA-N	354.793	3.922	50	40	FHGB	
CCc1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)s1	2271921	YSMPISNWJTYXRC-PXLXIMEGSA-N	364.470	3.697	50	40	FHGB	
CN(C)c1ccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1	408888630	YCYQXTOGDXPVJT-UKTHLTGXSA-N	370.796	3.860	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)c1O	409111117	AYLKBMYAVDHXRP-MQMKENTISA-N	358.463	3.730	50	40	FHGB	
CC(C)(C)OC(=O)N1C(=O)OC(=O)C[C@@H]1c1ccc(Br)cc1	32098801	ZQUSGUSNRXGGEI-LLVKDONJSA-N	370.199	3.794	50	40	FHGB	
CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C\c1ccccc1Cl)CO2	5642981	KKJNTPBEJZGNBM-DSDJNCIMSA-N	372.852	3.928	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(OCc3ccccc3C#N)cc2)o1	14407563	YQRFGAPBTUXXFK-YDZHTSKRSA-N	359.385	3.803	50	40	FHGB	
CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2Cl)cc1	5383837	XYHCPVPMQGRNIS-CIAFOILYSA-N	357.841	3.726	50	40	FHGB	
CC[C@@H](C)Oc1c(Cl)cc(/C=N/NC(=O)c2cccnc2)cc1OC	9973978	IGOGIASXUBPAGG-FZTAQKCPSA-N	361.829	3.685	50	40	FHGB	
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=N/NC(=O)c1cccnc1	3335210	BSRURRIUGUXMBG-UFFVCSGVSA-N	374.231	3.646	50	40	FHGB	
CCN(CC)C(=O)/C(C#N)=C\c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1	408783847	RSPVQOXSYSOELW-PTNGSMBKSA-N	366.377	3.557	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C)c(C)c2)c(OC)c1OC	223166786	WKBHBVCFGUKULQ-WJDWOHSUSA-N	366.417	3.875	50	40	FHGB	
O=C(N/N=C/c1cccc(O)c1)c1cccc(N2Cc3ccccc3C2)c1	1059618	JGZKWYMCEHCINO-YDZHTSKRSA-N	357.413	3.676	50	40	FHGB	
O=C(CNc1ccccc1)N/N=C/c1cccc(OCc2ccccc2)c1	1106557	RDDNOZIAMXVWJW-BUVRLJJBSA-N	359.429	3.828	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccn2)cc1OCC	5130121	LDOXHTDIAVGFMD-HADWXUJASA-N	373.478	3.510	50	40	FHGB	
Cc1ccc(C(=O)N/N=C(\CC(=O)c2cccs2)C(F)(F)F)cc1	13140300	GQOKUNOAZLYGSC-XSFVSMFZSA-N	354.353	3.978	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Br)cc1)=N\NC(=O)c1ccccc1	4459927	KCAKVSJRKCAEEK-UDWIEESQSA-N	374.238	3.584	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C/c2ccc(O)c(OCC)c2)cc1	1086650	IHKPEHANUJQEPT-RVDMUPIBSA-N	352.390	3.735	50	40	FHGB	
CCc1ccc(/C(C)=N/NC(=O)CSc2nc3ccccc3[nH]2)cc1	59417060	KVYMEDVKPALRFS-LPYMAVHISA-N	352.463	3.758	50	40	FHGB	
Cc1c(C(=O)NNC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)oc2ccccc12	8727962	VGGARVOSCHHKSS-LSDHHAIUSA-N	368.820	3.959	50	40	FHGB	
Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1ccc(-c2ccccc2)cc1	226365985	QJNWADSJUUNHNX-UHFFFAOYSA-N	369.424	3.909	50	40	FHGB	
CCC(=O)N(/N=C1\Sc2ccccc2C1=O)c1ccc(C(=O)OC)cc1	31932577	BHYHDTIAGUFNJD-ZZEZOPTASA-N	368.414	3.518	50	40	FHGB	
CCN(C(C)=O)c1nc(/C=C(\C#N)C(=O)Nc2c(C)cccc2C)cs1	45615438	NPXLZKPSCNXDGL-OQLLNIDSSA-N	368.462	3.678	50	40	FHGB	
Cc1cc(C)cc(CSCC(=O)N/N=C/c2ccc(OCC#N)cc2)c1	4502551	HTGDEEVMYUPLHB-WSDLNYQXSA-N	367.474	3.589	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc(Cl)c1O	4827551	HVLYRBOEWCLSQB-UFWORHAWSA-N	353.205	3.780	50	40	FHGB	
CN(C)c1oc(/C=N/NC(=O)c2cccc(Cl)c2)cc1Br	408857135	LBFOWFWZUSLFGT-CAOOACKPSA-N	370.634	3.525	50	40	FHGB	
COC(=O)c1cc(C(=O)CBr)ccc1OCc1ccccc1	36463715	AKWQRVIQUREMOK-UHFFFAOYSA-N	363.207	3.630	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Cl)cc1Cl)=N\NC(=O)c1ccncc1	100797823	XUHWFHUIKUQMOV-UFFVCSGVSA-N	365.220	3.523	50	40	FHGB	
CCc1n[nH]c2c1[C@@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2	987537	NEUWCJOAWCJQJC-IBGZPJMESA-N	372.428	3.769	50	40	FHGB	
Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2c(Cl)cccc2Cl)c1	3127156	QBLMJVFWXZSYFX-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
C/C(=N\NC(=O)c1cccc(Br)c1)c1cccc([N+](=O)[O-])c1	5222628	RVJXSHANHYEXNX-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
Cc1[nH]c2ccccc2c1/C=N/NC(=O)COc1cccc2cccnc12	5536620	CIICWINFOUPYCL-FSJBWODESA-N	358.401	3.554	50	40	FHGB	
N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3\C[C@@H]4C=CC[C@@H]34)cc2)cc1	20791464	HXGHNTSONLLCSQ-IAIQQTHMSA-N	357.413	3.672	50	40	FHGB	
CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NC(C)C)cc1Br	408778339	DWGLRWVMLNROPP-WZUFQYTHSA-N	371.662	3.933	50	40	FHGB	
CC/C(=N\NC(=O)CSc1ccccc1)c1ccc(OC)c(OC)c1	408861769	CXVIOJJRRPEMQQ-CAPFRKAQSA-N	358.463	3.726	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2cccc3ccccc23)ccc1OCC#N	409378683	RNDLYMVVXMPUEK-OEAKJJBVSA-N	359.385	3.515	50	40	FHGB	
COc1ccc(C(=O)N/N=C(\C)c2ccc(N3CCCCC3)cc2)cc1	1009033	GBBKSHAUKIKCKI-CJLVFECKSA-N	351.450	3.840	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)Cc2ccc(C)cc2C)cc1OCC	20195200	SNKWWNPKRYDRHW-HZHRSRAPSA-N	366.461	3.960	50	40	FHGB	
Cc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc(O)c([N+](=O)[O-])c1	36104485	HDXRXQBTSWPTPU-WUXMJOGZSA-N	357.753	3.808	50	40	FHGB	
CCn1cc(/C(C)=N/NC(=O)c2ccc(-c3ccc(F)cc3)s2)cn1	65997701	XMDAINIRACGKFJ-CIAFOILYSA-N	356.426	3.925	50	40	FHGB	
N#C/C(=C\c1ccc(Cc2ccccc2F)c(Br)c1)C(N)=O	408865779	FNKSOLJYKMKXPK-VGOFMYFVSA-N	359.198	3.571	50	40	FHGB	
COc1cccc2cc(C(=O)N/N=C/c3ccc(Br)cc3)oc12	408972952	XFQOJVOESKLFCQ-VXLYETTFSA-N	373.206	3.968	50	40	FHGB	
CCCOc1ccc(/C=C(\C#N)S(=O)(=O)c2ccccc2)cc1OC	1780902	IRMPNIISHNQLDN-SFQUDFHCSA-N	357.431	3.822	50	40	FHGB	
O=C(N/N=C\c1cc(Cl)nc(Cl)c1)c1cc(Cl)nc(Cl)c1	33376843	LQQVUTUNYVJADY-ZWSORDCHSA-N	364.019	3.854	50	40	FHGB	
COc1ccc(C(=O)Oc2ccccc2/C=N/NC(=O)c2ccccc2)cc1	1429092	PEVINYBPNINNRC-HZHRSRAPSA-N	374.396	3.678	50	40	FHGB	biogenic
O=C(ON1C(=O)c2ccccc2O[C@H]1CCCl)c1ccc(Cl)cc1	3079438	YQNBZPKMXWLIFZ-HNNXBMFYSA-N	366.200	3.902	50	40	FHGB	
N#CC1=C(Nc2ccccc2Cl)S[C@@H](c2ccccc2O)NC1=O	5662861	QWPLHAQEFMZNBK-INIZCTEOSA-N	357.822	3.754	50	40	FHGB	
Cc1ccc(C(C)C)c(OCCOc2ccc(/C=N/NC(N)=O)cc2)c1	6189902	FDOQBQAVQXZFSO-LPYMAVHISA-N	355.438	3.578	50	40	FHGB	
O=C(CN(Cc1ccco1)C(=O)CCl)Nc1ccccc1C(F)(F)F	8075035	CWUXECGDZKNEKT-UHFFFAOYSA-N	374.746	3.505	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(C)c1O	10129628	GLTLMZVDFALRPI-WQRHYEAKSA-N	359.429	3.756	50	40	FHGB	
N#C/C(=C\c1ccc(-n2cncn2)c(F)c1)c1nc(-c2ccncc2)cs1	63412663	OFHVDKVCHZKUCK-VIZOYTHASA-N	374.404	3.989	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccc(C(C)(C)C)cc1)c1ccc2c(c1)OCCO2	408589803	MXFIDGGAWDWGKL-HZHRSRAPSA-N	366.461	3.838	50	40	FHGB	
CCOP(=O)(OCC)[C@@H](NC(=O)c1ccccc1)C(Cl)Cl	3122148	LUZVMIALUQAZEI-CYBMUJFWSA-N	354.170	3.812	50	40	FHGB	
COc1ccccc1OCC(=O)N/N=C/c1c(Cl)cccc1Cl	3167311	MGULPIBCCCQYOG-DJKKODMXSA-N	353.205	3.531	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)[C@@H](C)SCc2ccccc2)cc1	5370438	YPAKURFFQDZEHO-QQHUYRGFSA-N	369.490	3.807	50	40	FHGB	
CCOc1cc2ccccc2cc1C(=O)NNc1ccccc1[N+](=O)[O-]	32899397	FXXOTBPONMRVKH-UHFFFAOYSA-N	351.362	3.904	50	40	FHGB	
N#C/C(=C/c1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1)C(N)=O	98054041	ZZSUJDCQRPEJFZ-YVLHZVERSA-N	368.396	3.737	50	40	FHGB	
CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2ccc(F)cc2)c(C(=O)OC)c1	101459807	IYKUBGQVTQQVJG-ZCXUNETKSA-N	368.364	3.963	50	40	FHGB	in-vitro
O=C(N/N=C/c1ccccc1O)[C@H]1Cc2ccccc2[C@H]1C(Cl)Cl	104215924	HUGRKRXTSNUAFA-NLNSYVINSA-N	363.244	3.602	50	40	FHGB	
C/C(=N\NC(=O)CCSc1ccc(Cl)cc1)c1cc(O)ccc1O	408719234	AIFYEXORYLGITC-YBFXNURJSA-N	364.854	3.774	50	40	FHGB	
COC(=O)c1sc(NC(=O)CCCC[C@@H]2CCSS2)nc1C	79189098	KZNSQZFKQXWMTP-SNVBAGLBSA-N	360.526	3.891	50	40	FHGB	biogenic
Cc1cc(OCC(=O)NNC(=O)c2ccccc2)c(C(C)C)cc1Cl	972585	KWAJGIMETWLFPI-UHFFFAOYSA-N	360.841	3.612	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Br)ccc1O)c1cc(C)ccc1C	59922470	JVMQMXYOVZAOJD-XDHOZWIPSA-N	361.239	3.926	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2O)cc1OCC	2296714	HTUXMCRGLLDKHL-RGVLZGJSSA-N	362.813	3.607	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)COc1cc(C)cc(C)c1	6825686	HWPBRRSDGXRMGW-YDZHTSKRSA-N	362.429	3.994	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3cccc(OCC)c3O)cc2c1	409186504	CXSIWABEULASQP-MTJSOVHGSA-N	368.389	3.700	50	40	FHGB	
COc1cccc(OC)c1C(=O)NNc1nc2cc(C)cc(C)c2s1	4121464	YJNZRFHFMBWSAG-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
C/C(=N/NC(=O)c1ccncc1)c1ccc(NC(=O)C2CCCCC2)cc1	654547	QDOWJTGOUYGVHQ-IWIPYMOSSA-N	364.449	3.754	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/C=C/c2cccc([N+](=O)[O-])c2)ccc1Cl	3034249	WCKVSSLJPBBUNY-DZDNCDRKSA-N	373.796	3.751	50	40	FHGB	
Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2cccc(Cl)c2Cl)c1	3072701	BIEGXKIHSJXSCY-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
COc1cccc([C@H]2CC(c3cccs3)=NN2C(=O)CCl)c1OC	4862958	FAGXVTWEZQAPIG-CYBMUJFWSA-N	364.854	3.682	50	40	FHGB	
CSc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(Cl)cn23)cc1	409013893	OGMHDWCYHCNZJZ-DJKKODMXSA-N	358.854	3.782	50	40	FHGB	
O=N[C@@H]1[C@H](Cl)[C@H]2C[C@@H]1[C@H]1[C@@H](Br)[C@@H](Br)C[C@H]21	4726389	RTOAGUKGFNBCKI-NQBIOGOQSA-N	357.473	3.542	50	40	FHGB	
Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c1C	3430415	LIJQHSZILWQQSS-RQRMZWKBSA-N	363.461	3.605	50	40	FHGB	
CC(C)N1CCC(=NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1	5384386	MUWDLNLXHPITMR-LBPRGKRZSA-N	372.296	3.737	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(Cl)cc1Br)c1ccco1	4526466	WACUWTSBGPTRAH-RQZCQDPDSA-N	371.618	3.615	50	40	FHGB	
Cc1ccc(OCCSC2=C(C#N)[C@@H](c3ccco3)CC(=O)N2)cc1	409140347	RLIBUGFAVVRHIV-HNNXBMFYSA-N	354.431	3.739	50	40	FHGB	
CC/C(=N\NC(=O)CSCc1ccccc1)c1ccc(OC)c(OC)c1	408719252	OKMXPQLNUQROIU-HEHNFIMWSA-N	372.490	3.868	50	40	FHGB	
COc1cc(C(=O)NNc2ccc(F)cc2)ccc1OCc1cscn1	40068192	QPGUCEKTWHPDSV-UHFFFAOYSA-N	373.409	3.627	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)cc(Cl)c1OC	657522	DQICDWFSCLNXOC-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1c1ccnc2ccccc12	659937	NDSBVIWBVFEZTQ-GOSISDBHSA-N	367.364	3.559	50	40	FHGB	
COc1ccc(CCNC(=O)/C(C#N)=C/c2c(C)[nH]c3ccccc23)cc1	1456716	VFEGZQVILGQXKR-GHRIWEEISA-N	359.429	3.751	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)c2ccc(OCC)cc2)cc1OC	8082327	SSBWBCJNGGLAHA-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
N#C/C(=C\c1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Br)c1	16386222	MZUZBZGRDYZGEU-MDWZMJQESA-N	371.190	3.693	50	40	FHGB	
Cc1ccccc1NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)c(Cl)c1	408793119	DDEQJGXHTKAPCM-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)[C@H](C)Oc1ccc(Cl)cc1C	4144948	QGCBCISXSIKNQW-OMBDHMDGSA-N	360.841	3.965	50	40	FHGB	
CCCc1[nH]nc2c1[C@@H](c1cccc(OC3CCCC3)c1)C(C#N)=C(N)O2	8382682	GSPKOJSKHSKDPM-SFHVURJKSA-N	364.449	3.902	50	40	FHGB	
O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(N2CCCCC2)cc1F	409244377	BPZUBSYJHNILMQ-UCQKPKSFSA-N	357.404	3.648	50	40	FHGB	
Cc1ccc(C)n1-c1cccc(C(=O)N/N=C/c2ccc(N(C)C)o2)c1	408998952	JNZQTUJZZBJWOE-FYJGNVAPSA-N	350.422	3.517	50	40	FHGB	
O=C(Nc1ccc(OCCBr)cc1)C(Cl)(Cl)Cl	225589663	DOVOGDOTRZPPJT-UHFFFAOYSA-N	361.450	3.769	50	40	FHGB	
O=C(NNC(=O)[C@H]1CC1(c1ccccc1)c1ccccc1)C1[C@H]2CCCC[C@H]12	103116864	AZKGMFBPXAUNBU-SLFFLAALSA-N	374.484	3.576	50	40	FHGB	
C[C@H](CNC(=O)c1ccccc1)[C@](C)(Br)CBr	3124302	IGCDMOGIHHXANY-ZWNOBZJWSA-N	363.093	3.601	50	40	FHGB	
O=C(N/N=C\c1c(F)cccc1Cl)C(=O)Nc1cccc2ccccc12	4905590	PWEOSPIKIOZCPS-JJFYIABZSA-N	369.783	3.721	50	40	FHGB	
N#CC1=C(SCc2ccc([N+](=O)[O-])cc2)NC(=O)C[C@@H]1c1ccccc1	6496154	NESCUDAAVRAKPT-MRXNPFEDSA-N	365.414	3.867	50	40	FHGB	
CC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2ccc(C(=O)OC)cc2)cc1	1319777	FQOMIYWKTCNDSJ-IKMPRTQCSA-N	368.433	3.516	50	40	FHGB	
N#C/C(=C\c1ccc(F)cc1)C(=O)Nc1nc2ccccc2nc1Cl	3296874	DPTIFNBPHVWDMF-FMIVXFBMSA-N	352.756	3.968	50	40	FHGB	
COc1ccc(Cl)cc1/C=C(\C#N)C(=O)Nc1cccc([N+](=O)[O-])c1	59133376	PDRNXQNQAPQCLG-KPKJPENVSA-N	357.753	3.802	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)ccc1OC(C)=O	408763167	NXGKPBWKXPJNSL-RIYZIHGNSA-N	370.792	3.820	50	40	FHGB	
N#C/C(=C\c1ccc(N2CCCCC2)o1)C(=O)Nc1cccc([N+](=O)[O-])c1	408790633	XKIHUDCTQTYJLH-SDNWHVSQSA-N	366.377	3.724	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc(C)cc1	16678650	NWBHJICJHVAJNE-DEDYPNTBSA-N	354.410	3.513	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc(OC)cc1C	16728797	DQYXYKPFNIPBLZ-FOWTUZBSSA-N	372.428	3.509	50	40	FHGB	
N#CC1=CN(c2ccccc2Br)c2ccccc2S1(=O)=O	38487988	FMGLYHLCRJRWIY-UHFFFAOYSA-N	361.220	3.739	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)COC(=O)CC2CCCC2)Sc2ccccc21	4957927	IIDDLMXWNKTZOZ-RGEXLXHISA-N	356.447	3.656	50	40	FHGB	
O=C(N/N=C/c1c(F)c(F)c(F)c(F)c1F)c1c[nH]c2ccccc12	3238607	IFIJBOHESQCLRW-TXNBCWFRSA-N	353.250	3.627	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@@H]2C[C@@H]3C[C@H](CBr)[C@@H]2C3)cc1	100017641	SSOHWXRVPHYKLJ-RJZRQDKASA-N	359.285	3.510	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)c2cc(Cl)ccc2OC)cc1OC	5381714	YIWNPXTZYPNWPK-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C\c2ccc(OCC)c(OCC)c2)cc1	408711771	JSSZQAWUQKHAGQ-JCMHNJIXSA-N	370.449	3.576	50	40	FHGB	
N#C/C(=C\c1ccc([N+](=O)[O-])o1)C(=O)Nc1sc2c(c1C#N)CCCC2	14151896	ZSSKZLAVGXETKK-JXMROGBWSA-N	368.374	3.545	50	40	FHGB	
Cc1ccc(C(=O)Oc2ccc(/C=N/NC(=O)c3cccc(O)c3)cc2)cc1	3112565	QJQXRNDYKHEOPT-OEAKJJBVSA-N	374.396	3.684	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2cccc(OCc3ccccc3)c2)cc1	5526927	ARDPZZYZBARBHI-LFVJCYFKSA-N	374.440	3.967	50	40	FHGB	
CCC(C)(C)[C@@H]1CCc2n[nH]c(C(=O)N/N=C/c3ccc(F)cc3)c2C1	9108816	YOQYZTXXADEVBO-LVCXCXRVSA-N	356.445	3.854	50	40	FHGB	
O=C(N/N=C/[C@H]1CCOC1)c1cc(-c2ccc(F)cc2)nc2ccccc12	54279435	GBHRBBUDBLEZHP-CHOFVFFHSA-N	363.392	3.793	50	40	FHGB	
Cc1ccc(S[C@@H](C)C(=O)N/N=C/c2ccc(OCC#N)cc2)cc1	409141203	JAXWWCSKZSMUFU-PCXKXAPESA-N	353.447	3.528	50	40	FHGB	
CC[C@@H]1CCC/C1=N\NC(=O)c1ccccc1I	955307	CXVLOKWSDYUBNO-OIRDJALBSA-N	356.207	3.587	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc(Br)ccc2O)cc1Cl	6033616	YCOBEJJZVAQLOC-QGMBQPNBSA-N	367.630	3.880	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)CSc2ccc(C)cc2)cc1OC	8515735	SXRCCXRLQJMAIA-XSFVSMFZSA-N	358.463	3.645	50	40	FHGB	
CN1CC2=C(OC(N)=C(C#N)[C@@H]2c2ccccc2)/C(=C/c2ccccc2)C1	20528755	YDNZYUCDIMZCCF-QFTJCQGQSA-N	355.441	3.777	50	40	FHGB	
Cn1cc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)c2ccccc21	408527174	FHAZCATXMFKSKV-YSURURNPSA-N	374.366	3.759	50	40	FHGB	
COc1ccccc1/C=N/NC(=O)c1cccc(N2Cc3ccccc3C2)c1	408730927	WIAGEVMEUVGQDM-ZVHZXABRSA-N	371.440	3.979	50	40	FHGB	
CCOc1ccccc1/C=N/NC(=O)[C@@H](C)Oc1ccc(Cl)cc1C	4144946	QGCBCISXSIKNQW-STCDJXRXSA-N	360.841	3.965	50	40	FHGB	
COC(=O)c1ccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)cc1	5719965	ROQUGJGEORQQFY-DJKKODMXSA-N	351.189	3.544	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N/NC(=O)CN3CCCCC3)c2C)c(C)c1	28216575	XALNBLURLXFLQG-OEAKJJBVSA-N	366.509	3.647	50	40	FHGB	
O=C(CCl)Nc1cccc(C(=O)Nc2nnc(-c3ccccc3)s2)c1	39753062	IOASBOGSDZSZEV-UHFFFAOYSA-N	372.837	3.635	50	40	FHGB	
O=C(CCl)Nc1ccccc1C(=O)Nc1nnc(-c2ccccc2)s1	39765713	MGTIGUGBLOYQQU-UHFFFAOYSA-N	372.837	3.635	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)cc1OC	408720332	ZDDKODUSYRKJFO-HBBMIWKISA-N	370.474	3.891	50	40	FHGB	
Cc1ccccc1NC(=O)/C(C#N)=C/c1cc(Cl)ccc1OCC(=O)O	409046306	JYAZBOQRUNWKLD-RIYZIHGNSA-N	370.792	3.658	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cccc(N3Cc4ccccc4C3)c2)cc1	59503624	HAQNYZKPAYHEMG-ZVHZXABRSA-N	371.440	3.979	50	40	FHGB	
Cc1cn2c(/C=C(\C#N)C(=O)Nc3ccc(F)cc3F)c(C)nc2s1	96405166	GXHPMIIAHZNPDX-VZUCSPMQSA-N	358.373	3.837	50	40	FHGB	
Cc1nc(N)sc1C(=O)N/N=C\c1cccc(Oc2ccccc2)c1	31854410	PMMNVHCKYSYVNQ-JAIQZWGSSA-N	352.419	3.590	50	40	FHGB	
N#C/C(=C\C1=Cc2ccccc2OC1)S(=O)(=O)c1ccc(Cl)cc1	4193234	UPBKKCWTGJMZAA-LICLKQGHSA-N	357.818	3.997	50	40	FHGB	
N#C/C(=C/c1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(=O)NC1CC1	33527691	ANLHMHPPVKANNV-LCYFTJDESA-N	367.336	3.712	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2c(C)n(C)c3ccc(OC)cc23)cc1	2223949	FLCFDRASWJPVHY-LPYMAVHISA-N	365.433	3.658	50	40	FHGB	
N#CS[C@H](CNS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1	3201179	SUPFUWVTWNBJEG-OAHLLOKOSA-N	352.868	3.574	50	40	FHGB	
N#C/C(=C\c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Br	4040794	SODAPZAQQNXKTK-XYOKQWHBSA-N	372.178	3.903	50	40	FHGB	
COc1ccc(C(=O)NNc2nc3ccc(Cl)cc3s2)cc1OC	4121418	CNYCKGXPAPHORF-UHFFFAOYSA-N	363.826	3.724	50	40	FHGB	
O=C(NN(Cc1ccccc1)Cc1ccccc1)c1ccccc1[N+](=O)[O-]	4783661	WOXSXOWYPFNEHD-UHFFFAOYSA-N	361.401	3.942	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C/c1ccc(O)c(Br)c1)c1ccccc1	22344742	SXYVRMOFZHJYDQ-DGGAMASNSA-N	371.234	3.939	50	40	FHGB	
COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1ccc2ccccc2c1	54883508	JURSVYJIFUZBBG-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
CCOC(=O)c1c(NC(=O)CCBr)sc2c1CCCC2	3156648	UVZVMRJOYZRFIO-UHFFFAOYSA-N	360.273	3.527	50	40	FHGB	
CNc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-]	5659540	QAPKUUTXJJKBFX-XYOKQWHBSA-N	356.769	3.836	50	40	FHGB	
C/C(=N/NC(=O)C1CCCCC1)c1cccc(NC(=O)C(F)(F)F)c1	5826634	AGRMLFXIQZPAON-JJFYIABZSA-N	355.360	3.608	50	40	FHGB	
Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3c[nH]c4ccccc34)cc2)n1	6189194	ALSVDXPHUQFTDA-ZMOGYAJESA-N	371.444	3.793	50	40	FHGB	
N#CC1=C(SCC(=O)c2ccccc2)NC(=O)[C@@H](C#N)C12CCCCC2	8996119	JQJFXUAQVJYCIW-OAHLLOKOSA-N	365.458	3.558	50	40	FHGB	
COc1ccc(OC)c(/C=C2/C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)c1	101675812	ODFLYPQEPWQGEL-NVNXTCNLSA-N	358.401	3.712	50	40	FHGB	
Cc1ccc(-n2cccc2/C=N/NC(=O)c2ccc(C#N)cc2F)cc1C	408967242	PKWMDZYWRCUGBJ-ZMOGYAJESA-N	360.392	3.869	50	40	FHGB	
CCN(CC)c1ccc(C(=O)[C@@H](Br)CBr)cc1	575358143	LOTJOQDOYILIRV-LBPRGKRZSA-N	363.093	3.874	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)[C@@H](C)Sc2ccccc2)cc1OC	831093	GKVFGKKAXQNUNX-GNUZOCDUSA-N	358.463	3.725	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2OC)ccc1OC	6945295	HGAAFPINFDAEAK-RVDMUPIBSA-N	352.390	3.648	50	40	FHGB	
Cc1nn(C)c(C)c1[C@H](C)C(=O)NN(Cc1ccccc1)c1ccccc1	60213084	CGGXQDNXUUCHPB-INIZCTEOSA-N	362.477	3.878	50	40	FHGB	
COc1cc(C(C)=O)ccc1COc1ccc(C=C(C#N)C#N)cc1OC	13141546	UMKRXPIGIVPHDS-UHFFFAOYSA-N	362.385	3.916	50	40	FHGB	
C[C@H](NC(=S)NNC(=O)c1cccc(Cl)c1)c1ccc(Cl)cc1	670419704	GKUZKJWRIPOMGC-JTQLQIEISA-N	368.289	3.864	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)Cc2ccc(Br)cc2)cc1	5638642	VTBFWOAWAQZDBA-XDHOZWIPSA-N	361.239	3.541	50	40	FHGB	
O=[N+]([O-])c1ccc(SC[C@@H](Cl)CS(=O)(=O)c2ccccc2)cc1	4704597	NRQIGAAJQATSJC-GFCCVEGCSA-N	371.867	3.768	50	40	FHGB	
O=C(N/N=C/c1ccc(OC(=O)c2ccco2)cc1)c1ccc(Cl)cc1	13151724	UNJFNYFDXAQKAA-CIAFOILYSA-N	368.776	3.916	50	40	FHGB	
COc1cc(C(=O)NN)cc(Cl)c1OCc1cccc2ccccc12	226325487	CSARRRFFORFRFN-UHFFFAOYSA-N	356.809	3.684	50	40	FHGB	
CC(C)Oc1ccc2ccccc2c1/C=N/NC(=O)[C@@H](O)c1ccccc1	409268003	XQTVHDZAEWZGMR-VSIOZEBNSA-N	362.429	3.811	50	40	FHGB	
COc1cc(C(=O)N/N=C/c2ccc(C(C)C)cc2)cc(OC)c1OC	1497148	YJGPNGZJGMPDEL-CIAFOILYSA-N	356.422	3.600	50	40	FHGB	
CCSC1=C(C#N)[C@H](c2ccc3c(c2)OCO3)C2=C(CCCC2=O)N1	2309714	PBSILTQTRGSCDE-KRWDZBQOSA-N	354.431	3.597	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)cc(OC)c1O	28449820	PBSBSKOSOXGRQA-WUXMJOGZSA-N	358.781	3.608	50	40	FHGB	
Nc1ccccc1[P+](c1ccccc1)(c1ccccc1)c1ccccc1	102915051	XOXNUJZNJDLQPD-UHFFFAOYSA-N	354.413	3.888	50	40	FHGB	
C[C@]12CCCC[C@H]1[C@H]2C(=O)N/N=C\c1ccc(-c2cccc(C(=O)O)c2)o1	408718725	BUZLFKLDRLRPRL-ZYPGCMDHSA-N	366.417	3.921	50	40	FHGB	
N#C[C@@H](C(=O)N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1	409204045	CAUPHKDFHKNGSD-MNOULKQQSA-N	374.356	3.612	50	40	FHGB	
Cc1cc(C)n(CC(=O)N/N=C/c2c3ccccc3cc3ccccc23)n1	5100924	YDOKTONZOGWQKR-YDZHTSKRSA-N	356.429	3.957	50	40	FHGB	
CC(=O)N/N=C/c1cc(Cl)ccc1OCCCOc1ccccc1C	4551267	LOUGPWMMJOMNSA-FYJGNVAPSA-N	360.841	3.966	50	40	FHGB	
O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(-c2ccc(F)cc2)o1	33618967	VFTAWIQEBRQPAG-MTJSOVHGSA-N	367.336	3.687	50	40	FHGB	
N#Cc1ccccc1COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1	14134717	CIASXHKEIWDXKY-ZVHZXABRSA-N	371.396	3.607	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/c2ccc(N(C)C)cc2)cc(C)c1Cl	5277028	SOUQHVJRSFGNSI-SRZZPIQSSA-N	359.857	3.552	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=N/NC(=O)c2ccc(F)cc2)cc1OCC	8812133	OXSHEEGHMGDAIT-WSDLNYQXSA-N	374.799	3.654	50	40	FHGB	
C[C@@H](NC(=O)CCCC[C@@H]1CCSS1)c1nnc2ccccn12	52971993	HVAWQCMGQSSHOC-CHWSQXEVSA-N	350.513	3.621	50	40	FHGB	biogenic
Cc1ccc(NC(=O)CN2C(=O)c3ccccc3S/C2=C/C#N)cc1C	34863671	UABHZJOANMBQBE-DJKKODMXSA-N	363.442	3.855	50	40	FHGB	
COc1cccc2cc(C(=O)N/N=C/c3ccccc3OC(C)C)oc12	408971514	HHGQNUWKRNTUNE-CIAFOILYSA-N	352.390	3.993	50	40	FHGB	
C=C(C)[C@H]1CC=C(C)/C(=N/NC(=O)c2cc(OC)c(OC)c(OC)c2)C1	672478	KGCNHFPDEHZEAH-IKBYJFNHSA-N	358.438	3.731	50	40	FHGB	
CCOc1ccccc1OCC(=O)N/N=C/c1ccc(Cl)cc1Cl	910299	GNHCQIQJWFXDHU-KEBDBYFISA-N	367.232	3.921	50	40	FHGB	
O=C(N/N=C/c1cccc(OC(=O)c2cccs2)c1)c1ccccc1	4784704	XWAIFLWZDZLZIN-DEDYPNTBSA-N	350.399	3.731	50	40	FHGB	
CC1(C)[C@H](C=C(Cl)Cl)[C@@H]1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	4940415	HROKMTWSVSFHHI-KYIKQNNASA-N	356.209	3.636	50	40	FHGB	
CO[C@H]1CC[C@H](/C=C(/C#N)C2CCC([N+](=O)[O-])CC2)C[C@@H]1Br	5328147	OKDIJYAIKUNQCW-SFANWWKSSA-N	371.275	3.850	50	40	FHGB	
COc1ccc2cc(/C=N/NC(=O)Cc3ccccc3)c(Cl)nc2c1	59401474	UAHNHPSBBOWLKH-CIAFOILYSA-N	353.809	3.590	50	40	FHGB	
Cc1ccc(N2Cc3ccc(C(=O)N/N=C\c4ccccc4O)cc3C2)cc1	83318403	DXHQQAZPUYLQEP-CFRMEGHHSA-N	371.440	3.985	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)c1	409118845	OQAZLVSUMYFERX-MQMKENTISA-N	358.463	3.643	50	40	FHGB	
CCc1n[nH]c2c1[C@@H](c1ccc(OCc3ccccc3)cc1)C(C#N)=C(N)O2	987539	IPWGJESHUYTYHQ-IBGZPJMESA-N	372.428	3.769	50	40	FHGB	
CCCOC(=O)c1cccc(NC(C#N)=C2C(=O)c3ccccc3C2=O)c1	1781954	NDPMMNPOZCOZKV-UHFFFAOYSA-N	360.369	3.522	50	40	FHGB	
Cc1cc(C)nc(SCc2ccc(C(=O)N/N=C/c3ccco3)cc2)n1	3362572	OPIROVBATLFXMB-RGVLZGJSSA-N	366.446	3.743	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(N(C)C)cc1)c1ccc(Br)s1	17075184	BHDHNELZZFSRAY-LICLKQGHSA-N	366.284	3.731	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)c2cc3ccccc3cc2O)cc1	408865607	DECCKFGAPLAHTG-YDZHTSKRSA-N	361.401	3.658	50	40	FHGB	
Cc1ccc(COc2cccc(/C=N/NC(=O)[C@@H](O)c3ccccc3)c2)cc1	409357774	RGYRHQQMPWKFLQ-NMWDDECMSA-N	374.440	3.758	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1Cl	2744244	ARZDSAGUFBFPTF-FYJGNVAPSA-N	353.809	3.903	50	40	FHGB	
CCC(=O)N1c2ccc(-c3csc(NC(=O)CCl)n3)cc2C[C@@H]1C	1366594	NUAQKIOUWQXANE-JTQLQIEISA-N	363.870	3.675	50	40	FHGB	
O=C(CCCCl)Nc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1	3178883	WHFGNFSJNFJNDJ-UHFFFAOYSA-N	363.685	3.956	50	40	FHGB	
O=C(O)c1cccc(-n2cccc2/C=N/NC(=O)c2cc3ccccc3o2)c1	4675599	GVMARXTXYAUFHS-LPYMAVHISA-N	373.368	3.686	50	40	FHGB	
C/C(=N\NC(=O)c1cc(-c2ccc(Cl)c(Cl)c2)[nH]n1)c1ccncc1	9014980	KGHGFTJEMBILNO-UFFVCSGVSA-N	374.231	3.933	50	40	FHGB	
O=C(CCCCCCBr)N1C(=O)OC[C@@H]1Cc1ccccc1	138615688	AGXJJIVRIVXVKX-HNNXBMFYSA-N	368.271	3.922	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)ccc1OCC#N	408819515	XOHJUXNNEMDEEF-RVDMUPIBSA-N	365.364	3.672	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cccc(Cl)c1	408872733	PHKXHUKRENEORC-OVCLIPMQSA-N	356.809	3.710	50	40	FHGB	
O=C(N/N=C/c1ccc(O)c(Br)c1)c1cccc(Cl)c1	58951700	ZGGXSCGUPQCIKB-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
COc1cccc(/C=N/NC(=O)CSCc2cc(C)cc(C)c2)c1OC	59473457	LSINPTYGZXPYCK-SRZZPIQSSA-N	372.490	3.704	50	40	FHGB	
COc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C)cc(SC#N)c1O	4472252	MIPDFNMFZKLEQX-NVNXTCNLSA-N	365.414	3.780	50	40	FHGB	
CCCCOc1ccc(/C(C)=N\NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1	408737394	OSMHKIBWYHTUQF-QNGOZBTKSA-N	369.421	3.857	50	40	FHGB	
C#CCOc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1CC=C	408850841	SBVBDEBWOYJTPI-HAHDFKILSA-N	358.397	3.937	50	40	FHGB	
CC(=O)Nc1cccc(C(=O)NN(Cc2ccccc2)Cc2ccccc2)c1	15741118	OEWXSGLDCIAVEW-UHFFFAOYSA-N	373.456	3.992	50	40	FHGB	
CC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)cc1	408764045	VTDNAXNWJGQFAW-DJKKODMXSA-N	351.189	3.683	50	40	FHGB	
COc1ccc(/C=N/NC(N)=O)cc1OCc1ccc(Cl)cc1Cl	408878556	BVZYUPGWTHDSPA-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
CC(C)N(C(=O)CCl)[C@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1	79392737	ZCWLYRNUEUDMNZ-IRXDYDNUSA-N	366.889	3.700	50	40	FHGB	
COC(=O)N/N=C/c1cn(CCOc2cccc(C)c2)c2ccccc12	2209158	UTMDGKNQXOBNMC-FYJGNVAPSA-N	351.406	3.719	50	40	FHGB	
COc1cc(SC)ccc1C(=O)NNc1c(F)c(F)cc(F)c1F	7977680	VJNXBUONWDLENN-UHFFFAOYSA-N	360.332	3.730	50	40	FHGB	
COc1cccc(/C(C)=N\NC(=O)CSc2nc3ccccc3s2)c1	1240750	FQUVZOKEOLOJMT-NDENLUEZSA-N	371.487	3.937	50	40	FHGB	
CCC1=C(C(=O)OC)[C@@H](c2cccc(Cl)c2Cl)C(C#N)=C(N)O1	706893	ZSMPKTJMQPWKCG-LBPRGKRZSA-N	353.205	3.638	50	40	FHGB	
Cc1ccc(S(=O)(=O)N(CCCBr)c2ccccc2)cc1	1751775	MPNVXJNVUADUDJ-UHFFFAOYSA-N	368.296	3.975	50	40	FHGB	
CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(OCC)cc2)cc1	3308752	KKOGPFMRRJHQPX-LGMDPLHJSA-N	364.401	3.808	50	40	FHGB	
C/C(C/C(C)=N/NC(=O)Nc1ccccc1)=N\NC(=O)Nc1ccccc1	5288690	MEFXIMRENBMDQU-HOFJZWJUSA-N	366.425	3.772	50	40	FHGB	
CC(=O)OC1=C(C)C2=C3OC(=O)C(C)=C3CC[C@]2(C)[C@H](Cl)[C@@H]1Cl	6050438	YVGHSBLNSIYVSA-VMGRFDJRSA-N	357.233	3.979	50	40	FHGB	
COC(=O)c1c(SC)sc(C(=C(C#N)C#N)c2ccccc2)c1N	6640263	VNYDJKLCHCPFSS-UHFFFAOYSA-N	355.444	3.688	50	40	FHGB	
O=C(CCSc1ccccc1Cl)NNc1ccccc1[N+](=O)[O-]	15504556	VUKPSRKYFKLJPY-UHFFFAOYSA-N	351.815	3.874	50	40	FHGB	
CC1=C[C@@]2(Nc3cc(C(C)C)cc(Br)c3O2)C(C#N)=C(N)O1	40546270	QOHXTPBHYRJFDX-INIZCTEOSA-N	362.227	3.701	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccncc2)c(C)n1-c1ccccc1Cl	58917809	DPQKWCXVXRGHHA-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
C#CCOc1c(CC=C)cc(/C=C(\C#N)C(=O)Nc2ccccc2)cc1OC	409067338	COBBMMAPELAQOY-XMHGGMMESA-N	372.424	3.981	50	40	FHGB	
O=C(CSCc1ccc(Cl)cc1)N/N=C/c1ccccc1[N+](=O)[O-]	903671	IZEIAVDPUGXZSZ-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
CCOc1ccc(CCCC(=O)N/N=C/c2ccc(OC)c(OC)c2)cc1	5872961	ZCAIPGSLHVKOLS-PXLXIMEGSA-N	370.449	3.576	50	40	FHGB	
N#CC1=C2SC[C@](O)(c3ccco3)N2C(=O)C[C@@H]1c1ccc(Cl)cc1	12274956	HTPUSOGNMGTVSA-ACJLOTCBSA-N	372.833	3.576	50	40	FHGB	
CN1CC2=C(OC(N)=C(C#N)[C@@H]2c2ccsc2)/C(=C\c2ccsc2)C1	20814677	JCDPDYKQFWTJNV-ZRBJYGNNSA-N	367.499	3.900	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NC2CCCCC2)c(C)n1C[C@@H]1CCCO1	59109268	MPGRLTUQBLQYOF-YWFITGJYSA-N	355.482	3.640	50	40	FHGB	
COc1ccc(OC)c(/C=C(\C#N)C(=O)Nc2cc(C)ccc2OC)c1	408804965	HSSKOPBNSVRASV-XNTDXEJSSA-N	352.390	3.567	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccccc1OC	409272374	PVZCFWGWBXAACV-HZHRSRAPSA-N	358.397	3.624	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)cc1Cl)c1ccc(O)cc1	1775996550	LQZNIKFNQFSURH-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
COc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccc(C)cc1	989064	SJAFVYBCNOVBEO-FQEVSTJZSA-N	372.428	3.716	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2cc(Cl)c(OC)c(OC)c2)cc1	6683807	MNBPLLPQHCFHKM-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
CC(C)COc1ccc(/C=N\NC(=O)c2ccco2)cc1Br	408600581	DRRGLORRPPXLPX-NVMNQCDNSA-N	365.227	3.841	50	40	FHGB	
Cc1cc(/C=N/NC(=O)CN2CCCCC2)c(C)n1-c1cccc(Cl)c1	28216584	TVDMMWVEHJVHGQ-LPYMAVHISA-N	372.900	3.684	50	40	FHGB	
Cc1ccc(OCCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	6049114	DAYHTTHWANNWHE-UHFFFAOYSA-N	370.493	3.518	50	40	FHGB	
C/C(=N\NC(=O)c1cccc(N/N=C(\C)c2ccco2)c1)c1ccco1	4863599	QWLYOMAXILCPFL-KVVJQUGZSA-N	350.378	3.863	50	40	FHGB	
C[C@H]1Cc2cc(/C=N\NC(=O)c3ccc(Br)cc3)ccc2O1	408710882	UBLHJPVATUYIFA-ORPVNXHJSA-N	359.223	3.536	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/c2ccc(F)s2)ccc1OC(F)F	252484838	GJHHJNNXPYSSSK-UFWORHAWSA-N	358.341	3.651	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)CSCc2ccc(C)cc2)c1	5543934	QYSFPCKKWMSWCT-FYJGNVAPSA-N	354.475	3.943	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccc(OCc3ccccc3Cl)cc2)[nH]n1	993673	JRDDFSYNLGADFR-SRZZPIQSSA-N	368.824	3.714	50	40	FHGB	
Cc1nc(Cc2ccccc2)sc1C(=O)N/N=C/c1ccccc1O	5183801	MNZUAEUKKOIMJI-UDWIEESQSA-N	351.431	3.512	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NC2CCCCC2)ccc1OC(F)F	6410659	GDMYRNIAONUNQH-UKTHLTGXSA-N	350.365	3.652	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/C=C/c2ccccc2[N+](=O)[O-])ccc1Cl	8183375	MRRIDIFLINBYRK-PHNSAVJNSA-N	373.796	3.751	50	40	FHGB	
COc1cccc2sc(NNC(=O)c3nc4ccccc4s3)nc12	4121317	VTLINUCYRLUWDQ-UHFFFAOYSA-N	356.432	3.672	50	40	FHGB	aggregator
O=C(N/N=C1/C[C@H]2CC=C[C@@H]12)c1cc(-c2ccccn2)nc2ccccc12	32706036	XWJIEOOWGPKFTR-HBGIEXGCSA-N	354.413	3.979	50	40	FHGB	
COC(=O)N/N=C/c1cc(Br)ccc1OCc1ccccc1	1185266	PWXOXTWFAGDXIM-VCHYOVAHSA-N	363.211	3.718	50	40	FHGB	
CC(/C=C(/C#N)C(=O)N1CCN(c2ccccc2)CC1)=C\c1ccccc1	59333167	IBYGHSCXVBVJFX-GYVOIKSCSA-N	357.457	3.889	50	40	FHGB	
CN(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1	2730470	RLAQRNHJRVCIGU-UKTHLTGXSA-N	370.796	3.860	50	40	FHGB	
CCC(C)(C)[C@H]1CCc2n[nH]c(C(=O)N/N=C/c3ccc(F)cc3)c2C1	9108817	YOQYZTXXADEVBO-OFJBCHTGSA-N	356.445	3.854	50	40	FHGB	
COC(=O)c1ccccc1-c1ccc(/C=C(\C#N)C(=O)Nc2cccnc2)o1	409196046	YJDYZZGPRDCZLH-SDNWHVSQSA-N	373.368	3.674	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)cc(OC)c1OC	5166592	KMUCOTCJYVMOQR-LPYMAVHISA-N	370.449	3.774	50	40	FHGB	
O=S(=O)(c1ccccc1)n1ccc2cc(CBr)ccc21	2513743	WEPKKLRCOPTNLP-UHFFFAOYSA-N	350.237	3.773	50	40	FHGB	in-vitro
Cc1nn(Cc2ccccc2)c(Cl)c1/C=N/NC(=O)c1cccs1	6683672	UWXFXDKACVQISM-VXLYETTFSA-N	358.854	3.719	50	40	FHGB	
CCc1ccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2Cl)nc1	811445	FLSGACJZRSGMOA-WSDLNYQXSA-N	367.840	3.555	50	40	FHGB	
COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)NC2CCCCC2)o1	6180085	BICOLKMLTFNVQN-FYJGNVAPSA-N	369.421	3.699	50	40	FHGB	
CC(C)(C)C(=O)N/N=C(\CNC(=O)c1ccccc1Cl)c1ccccc1	18191644	UUHIPYABCRTENA-HAVVHWLPSA-N	371.868	3.636	50	40	FHGB	
C[C@H](NC(=O)c1ccc(NC(=O)CBr)cc1)c1ccccc1	35605491	IFHYYVBBGMKHDT-LBPRGKRZSA-N	361.239	3.511	50	40	FHGB	
Cc1ccccc1-c1nc2cc(N3C[C@H](C(=O)Cl)CC3=O)ccc2o1	57327038	WRKKNTSMDCRNQX-GFCCVEGCSA-N	354.793	3.922	50	40	FHGB	
CCCC/C(C)=N/NC(=O)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	58885727	YOFMRKBAEZWYMF-ZVBGSRNCSA-N	363.767	3.980	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1cccc(F)c1	59333740	YLGWPCRMNGJOKB-YVLHZVERSA-N	368.408	3.799	50	40	FHGB	
COc1ccc(/C=C/C(=O)NN)cc1OCc1ccc(Cl)cc1Cl	216901300	DGWLQSJUMNILIK-XVNBXDOJSA-N	367.232	3.584	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)CSCc2cccc(Cl)c2)cc1	408786508	ROHSKEVPOFMGLT-RGVLZGJSSA-N	361.898	3.790	50	40	FHGB	
COc1cc(N2CCCCC2)ccc1/C=N\NC(=O)Cc1ccc(F)cc1	409238297	DCRWSWSQAZFRPD-HAHDFKILSA-N	369.440	3.517	50	40	FHGB	
CN(C)c1ccc(/C=N/N(CCC#N)C(=O)c2cc3ccccc3o2)cc1	524732911	ZCXVACLBRMONCN-HZHRSRAPSA-N	360.417	3.889	50	40	FHGB	
Cc1ccc(SCC(=O)N/N=C/c2cccc(Br)c2)cc1	8515400	MCQIYENZISFKAU-VCHYOVAHSA-N	363.280	4.000	50	40	FHGB	
Cc1c(C(=O)N/N=C/c2c(Cl)cccc2Cl)cccc1[N+](=O)[O-]	58871262	VGBDYAUVNNYYMC-QGMBQPNBSA-N	352.177	3.974	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)Cc2cccc3ccccc23)cc1OC	408548671	KXXLLSSBEBDHOF-OEAKJJBVSA-N	362.429	3.858	50	40	FHGB	
CC(C)N(C[C@@H]1CCCCN1C(=O)CCl)C(=O)OCc1ccccc1	79412031	LQDYAEDKPVRVJR-KRWDZBQOSA-N	366.889	3.654	50	40	FHGB	
Cc1cc(C)nc(SCC(=O)N/N=C/c2cc(C)n(C(C)(C)C)c2C)n1	8336660	RXYFXNQYVUNALW-KEBDBYFISA-N	373.526	3.509	50	40	FHGB	
Cc1cc(-c2ccc(/C=N/NC(=O)c3cccnc3)o2)c([N+](=O)[O-])cc1C	809059	WKZOELUFLZDQGD-SRZZPIQSSA-N	364.361	3.631	50	40	FHGB	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2F)c1C	10408520	LAVGVMMIHOSOHQ-OQLLNIDSSA-N	359.376	3.575	50	40	FHGB	
N#C/C(=C/c1cccc([N+](=O)[O-])c1)c1nc(O)c2cc(Cl)ccc2n1	33471683	CBWKHRBTFKWVFM-WDZFZDKYSA-N	352.737	3.961	50	40	FHGB	
COc1ccc(/C=N\NC(=O)COc2cccc(Cl)c2)cc1Cl	30802418	LYIVSYLEGAXOKU-OCKHKDLRSA-N	353.205	3.531	50	40	FHGB	
Cn1cnc2ccc(NC(=O)CCCC[C@@H]3CCSS3)cc2c1=O	95478245	OTUQMSLAOPUNLE-CYBMUJFWSA-N	363.508	3.586	50	40	FHGB	biogenic
C/C(N)=C(\C#N)C(=O)COC(=O)c1sc2cc(Cl)ccc2c1Cl	104625345	CISAVFXVUHFJPS-YFHOEESVSA-N	369.229	3.690	50	40	FHGB	
N#C/C(=C\c1ccc(O)cc1)C(=O)Nc1ncc(Cc2ccccc2)s1	1905701	LUXMNGVORQAGIW-MHWRWJLKSA-N	361.426	3.985	50	40	FHGB	
O=C(Oc1ccc(/C=N/NC(=O)c2ccco2)cc1)c1ccc(Cl)cc1	59417858	RFKLYNFZPGQIQI-CIAFOILYSA-N	368.776	3.916	50	40	FHGB	
COc1cccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1	59133375	XBYJKPTVZSAJHR-KPKJPENVSA-N	357.753	3.802	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1	5712726	GYRUOCYNNGKXPO-XNTDXEJSSA-N	351.362	3.848	50	40	FHGB	
Cc1ccc2nc(C)c(C(=O)N/N=C/c3c(O)ccc4ccccc34)n2c1	59444056	QIYGVGCSLJARFJ-SSDVNMTOSA-N	358.401	3.574	50	40	FHGB	
C/C(=N\NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(O)cc1O	100039744	IOGOXVDCAVWWJF-HZHRSRAPSA-N	360.413	3.770	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)[C@@H](C#N)c1ccccc1	409204100	BBCCQKSAHFUULO-WWJLXRQJSA-N	357.413	3.996	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCCC2)o1)C(=O)Nc1cccc(C(=O)O)c1	408543051	OPWAUCXEXZTXMB-QINSGFPZSA-N	365.389	3.514	50	40	FHGB	
COCCOc1ccc(/C=N/NC(=O)Cc2cccs2)c2ccccc12	409200193	QVMXZONXRHGFEY-KGENOOAVSA-N	368.458	3.619	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1	408872045	JOLZLURKFXBFEC-HYARGMPZSA-N	362.385	3.728	50	40	FHGB	
CC(C)c1ccc(NC(=O)C(=O)N/N=C\c2c(F)cccc2Cl)cc1	408751973	DHUKWOUPEVBSJW-FBHDLOMBSA-N	361.804	3.691	50	40	FHGB	
COC(=O)[C@@H](Cc1ccccc1)P(=O)(c1ccccc1)c1ccccc1	667961	BSXVOEYIIHQNPT-OAQYLSRUSA-N	364.381	3.785	50	40	FHGB	
O=C(N/N=C/c1ccccc1Cl)C1(O)c2ccccc2-c2ccccc21	861673	PHXZZWVULKEKBS-YDZHTSKRSA-N	362.816	3.707	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2ccc(Br)o2)cc1	20197397	CEPUIUNQIJLQFX-LICLKQGHSA-N	351.200	3.595	50	40	FHGB	
N#CC1=C2SCN(Cc3ccco3)CN2C(=O)C[C@@H]1c1cccs1	20347970	WKCARMWWWUBUOD-ZDUSSCGKSA-N	357.460	3.556	50	40	FHGB	
CCCCCCOc1ccc(C(=O)NNC(=O)/C=C/c2ccco2)cc1	32904318	WIRFWNXTOWGEKV-OUKQBFOZSA-N	356.422	3.713	50	40	FHGB	
CC(C)COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1	33850366	IPNWRLLPURYXOW-YVLHZVERSA-N	364.401	3.965	50	40	FHGB	
COc1ccc2nc(/C(C#N)=C\c3ccc(N4CCOCC4)c(C)c3)[nH]c2c1	409393491	XTZIOJWOBHFNEM-ATVHPVEESA-N	374.444	3.781	50	40	FHGB	
Cc1c(Br)cc(C(=O)CSC#N)c(O)c1Br	6417908	JIOXQYQPFVXOAJ-UHFFFAOYSA-N	365.046	3.623	50	40	FHGB	
O=C(CC(c1ccccc1)c1ccccc1)NNC(=O)c1ccc(F)cc1	6509134	NHDSQEIDSUNNMS-UHFFFAOYSA-N	362.404	3.809	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)cc1	408971869	MRQBWOSJIYMPNS-FYJGNVAPSA-N	350.374	3.770	50	40	FHGB	
Cc1n[nH]c2c1[C@H](c1ccc(OCc3ccccc3)cc1)C(C#N)=C(N)O2	642378	KRMZFCRKDXGONU-LJQANCHMSA-N	358.401	3.515	50	40	FHGB	
Cc1ccc(-c2nn(-c3ccccc3)cc2/C=N/NC(=O)c2cccnc2)o1	52410593	FICIEGXZRRDSTQ-YDZHTSKRSA-N	371.400	3.600	50	40	FHGB	
Cc1cc(OCc2ccc(C(=O)N/N=C/[C@@H]3CCOC3)cc2)ccc1Cl	84090160	SMYYNZZWRWMKOK-RSFOSLOZSA-N	372.852	3.980	50	40	FHGB	
Cc1cc(C)n(CC(=O)N/N=C2/C[C@@H](c3ccccc3)Oc3ccccc32)n1	84102136	OCJWFFHFZSVALN-HFBCPUAESA-N	374.444	3.544	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)c2cc3ccccc3o2)cc(OC)c1O	408857015	MPROWPHLEPFNGW-MTJSOVHGSA-N	350.374	3.639	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@H]2C[C@@H]3C[C@H]2[C@H](CBr)C3)cc1	33414704	SSOHWXRVPHYKLJ-JURCDPSOSA-N	359.285	3.510	50	40	FHGB	
O=C(N/N=C/c1cccc(OCc2ccc(F)cc2)c1)c1ccc(O)cc1	82375282	PYKCICSGVJMNHY-YDZHTSKRSA-N	364.376	3.874	50	40	FHGB	
CC1=C[C@]2(Nc3cc(C(C)C)cc(Br)c3O2)C(C#N)=C(N)O1	40546268	QOHXTPBHYRJFDX-MRXNPFEDSA-N	362.227	3.701	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)NCc1ccco1	2697991	LLFMXLSYESKJJR-GXDHUFHOSA-N	363.329	3.671	50	40	FHGB	
COc1ccc(OCC(=O)N/N=C(\C)CC(C)(C)c2ccccc2)cc1	408875784	KUUXIFKLGBMKQA-CJLVFECKSA-N	354.450	3.934	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(OC)c2)cc1OC	5654015	SWQDSAIDCOQLST-XNTDXEJSSA-N	352.390	3.648	50	40	FHGB	
CC(C)c1ccc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)cc1	15424624	AUAAOQVFNLERPC-UHFFFAOYSA-N	352.825	3.896	50	40	FHGB	
C/C(=N\NC(=O)c1cccc(C)c1)c1cccc(NC(=O)c2ccco2)c1	695770	WVCSMTLPOVQQLI-HZHRSRAPSA-N	361.401	3.994	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=N/NC(=O)c2ccccc2)cc1OCC	2175991	HOIFAEMGWAXBTJ-FYJGNVAPSA-N	356.809	3.515	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/c2ccc(Br)o2)ccc1Cl	3026949	FWUPWJPZOCSTCH-REZTVBANSA-N	371.618	3.533	50	40	FHGB	
O=C(N/N=C/c1ccccc1Br)c1ccc2ccccc2n1	3375219	KNBMUIMMNNBEPO-YBFXNURJSA-N	354.207	3.761	50	40	FHGB	
CCc1cc2ccccc2nc1SCC(=O)NNC(=O)C1CCCCC1	4849229	WKEAHGPCLLIOPV-UHFFFAOYSA-N	371.506	3.617	50	40	FHGB	
CCc1nc(CC(=O)NN(Cc2ccccc2)c2ccccc2)cs1	55111457	VSIZWQMPKNQRCY-UHFFFAOYSA-N	351.475	3.986	50	40	FHGB	
COc1c(Cl)cc(Cl)cc1[C@@H]1C(C#N)=C(N)Oc2cc(O)ccc21	409128938	LIHUNJLJPPTHKH-OAHLLOKOSA-N	363.200	3.926	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-]	4702492	RTJSDWWQRVKGOS-UDWIEESQSA-N	355.394	3.665	50	40	FHGB	
C#CCOc1cccc(/C=N/NC(=O)C(c2ccccc2)c2ccccc2)c1	409392277	OSAZJIRTEJNLAF-XIEYBQDHSA-N	368.436	3.981	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C\c2ccc(N(C)C)c(Br)c2)cc1	409362206	IGBYCXQLLODLCZ-NDENLUEZSA-N	374.282	3.516	50	40	FHGB	
CCOC(=O)c1cc(-c2ccc(/C=C(/C#N)C(=O)OC)o2)ccc1Cl	252482050	CXDQEYALQSGYES-WQLSENKSSA-N	359.765	3.857	50	40	FHGB	
O=C(CSc1ccc(Cl)cc1)N/N=C/c1cc(Cl)ccc1O	5769923	XLZYVRHBLWVEIZ-QGMBQPNBSA-N	355.246	3.941	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccn2)c(C)n1-c1ccc(Cl)cc1	6329330	IJCNRZRPFKDFRE-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
CCN1c2ccc(/C=N/NC(=O)c3ccccn3)cc2[C@H](C)CC1(C)C	208302626	RKIWQZCZBVUXNX-QKIXXSFTSA-N	350.466	3.958	50	40	FHGB	
CC1CCN(c2ccc(N/C=C(\C#N)C(=O)NCc3ccco3)cc2)CC1	1911171	IFYLVXTZLAFTJK-SAPNQHFASA-N	364.449	3.652	50	40	FHGB	
COCCNC(=O)/C(C#N)=C/c1ccccc1OCc1cccc(Cl)c1	408814092	PXYCIQIXACQNHS-SFQUDFHCSA-N	370.836	3.589	50	40	FHGB	
CC(C)Oc1cccc(NC(=O)/C(C#N)=C\c2ccc(C(=O)O)cc2)c1	408779604	GGJMNYYMHDSOCE-YBEGLDIGSA-N	350.374	3.718	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)o1	408996387	DIQDRRAOTGUSTN-FYJGNVAPSA-N	351.406	3.749	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)cc(OC)c1OC	409076061	XGGFIGWMQRQTAT-XDHOZWIPSA-N	362.429	3.656	50	40	FHGB	
N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1ccc2ccccc2c1	16545840	OAVUQWVCSYFQJG-SXGWCWSVSA-N	359.341	3.999	50	40	FHGB	
COc1ccc(/C=C/C(=N\NC(=O)c2ccccc2)[C@@H](C)CN(C)C)cc1	6437141	ZWXRBVGZBVIQPO-GKGQZOAWSA-N	365.477	3.692	50	40	FHGB	
COc1ccc(-c2cc(C(=O)N/N=C\c3ccc(Cl)cc3)[nH]n2)cc1	33089299	LPAJKNBBZRICPD-JAIQZWGSSA-N	354.797	3.503	50	40	FHGB	
COc1ccccc1[C@H]1C(C#N)=C(N)Oc2[nH]nc(-c3ccc(C)cc3)c21	20033313	UFFREBLTLVXNRT-KRWDZBQOSA-N	358.401	3.612	50	40	FHGB	
O=C(COc1cccc(Cl)c1)N/N=C/c1ccccc1C(F)(F)F	695345	BEZNPRJTGNHHDH-ZVBGSRNCSA-N	356.731	3.888	50	40	FHGB	
Cc1ccc(C(C)C)cc1OCC(=O)N/N=C/c1ccc([N+](=O)[O-])s1	704752	CMZNSMHGHZYIHD-GIJQJNRQSA-N	361.423	3.617	50	40	FHGB	
CCCc1cc([C@@H]2C(C#N)=C(N)Nc3oc(OC)nc32)ccc1OC(C)C	1073904	CWFLBJFLROKJBH-MRXNPFEDSA-N	368.437	3.674	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)CNc2cccc3ccccc23)ccc1O	1434475	NEJRAAOGYAWXHF-YDZHTSKRSA-N	363.417	3.506	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)COc2ccc(C)cc2C)cc1	1445102	CSBYJVMUMIAPRF-HYARGMPZSA-N	353.466	3.679	50	40	FHGB	
C/C(=N\NC(=O)c1cncc(Br)c1)c1ccc(Cl)cc1	4551132	YOIGAXLPHRGBHQ-GIJQJNRQSA-N	352.619	3.652	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)c2ccc3ccccc3c2O)cc1Cl	4680648	VKVGLFHNQYZVIT-UHFFFAOYSA-N	354.793	3.582	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2ccccc2Cl)cc(Cl)c1O	6672677	WFRRPDVHFAPDNY-DJKKODMXSA-N	353.205	3.862	50	40	FHGB	
C[C@H]1CCCC[C@H]1NC(=O)/C(C#N)=C/c1ccc(O)c(Br)c1	23723808	LPBYOLKRVIVKAH-PCKNOYNLSA-N	363.255	3.757	50	40	FHGB	
COc1ccc(N2C=C(C#N)S(=O)(=O)c3ccc(C)cc32)cc1Cl	44167423	DOTJSJBPQUYNFQ-UHFFFAOYSA-N	360.822	3.947	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C\c2cccc(Br)c2)cc1	408711772	JVICQQHJZVONDS-UNOMPAQXSA-N	361.239	3.541	50	40	FHGB	
CC(=O)N/N=C/c1cc(Cl)c(OCc2ccccc2C#N)c(Cl)c1	409013327	MYNKGHKHQRNUKX-ZVBGSRNCSA-N	362.216	3.914	50	40	FHGB	
COc1cc(C)c(C=NNC(=O)c2cccc(NC(C)=O)c2)cc1C(C)C	1531372791	ZGWPHSRUHPJBMW-UHFFFAOYSA-N	367.449	3.849	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccc(C)cc1)c1ccc(Br)cc1	1051728	OITYSKMXVZYIFU-DEDYPNTBSA-N	360.255	3.710	50	40	FHGB	
COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccccc3C)o2)cc1	4544373	ZWFQMLBLAVJLPJ-LPYMAVHISA-N	362.385	3.806	50	40	FHGB	
O=C(O)c1cccc(-n2cccc2/C=N/NC(=O)c2ccccc2Cl)c1	409085652	FDPOSDBIELRXJP-CIAFOILYSA-N	367.792	3.593	50	40	FHGB	
C/C(=N\NC(=O)COc1cccc(Br)c1)c1ccc(C)cc1	4461629	GNFOVDIOLDBINV-CPNJWEJPSA-N	361.239	3.677	50	40	FHGB	
O=C1OC(=O)c2ccc(Br)c3c(Br)ccc1c23	101030656	HJUUAJMSVJJHQP-UHFFFAOYSA-N	355.969	3.675	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccccc1	7892486	JQKHSUZVRZJTQE-FYJGNVAPSA-N	362.389	3.766	50	40	FHGB	
C[C@@H](Oc1ccc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)cc1)C(=O)O	59248088	KCOXLNYEHPNSTK-XTCQQWIJSA-N	370.792	3.738	50	40	FHGB	
COc1ccc(Br)cc1/C=C(\C#N)C(=O)NC1CCCCC1	5720626	DRPWIGBDSIAMAS-UKTHLTGXSA-N	363.255	3.814	50	40	FHGB	
COc1ccc(C(=O)N/N=C/c2ccc(Cl)cc2Cl)c(OC)c1	6170223	RSKDZMOFLRFCHX-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
Cc1ccc(C(=O)N/N=C2/CC(=O)CC(C)(C)C2)cc1Br	101500390	LOKNLKIHDYHAMS-PDGQHHTCSA-N	351.244	3.623	50	40	FHGB	
C/C(=N/NC(=O)C1CC1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1	672761	KTKAAJFDNHURGJ-UUYOSTAYSA-N	355.825	3.843	50	40	FHGB	
N#C/C(=C\c1cn(CCOc2ccccc2Cl)c2ccccc12)C(N)=O	872767	LAFRORHXGAQANJ-SDNWHVSQSA-N	365.820	3.766	50	40	FHGB	
COc1cccc(OC)c1C(=O)NNc1nc2c(Cl)cccc2s1	4121372	BDKHRZREMMHSDH-UHFFFAOYSA-N	363.826	3.724	50	40	FHGB	
Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1/C=N/NC(=O)C1CC1	5863496	QMUBPMYIHITURF-ODCIPOBUSA-N	370.762	3.713	50	40	FHGB	
CC(C)COc1ccc(Cl)cc1/C=C(\C#N)C(=O)NC[C@H]1CCCO1	6827227	WNHJYYFBEPQOKQ-YBYKNVHQSA-N	362.857	3.577	50	40	FHGB	
CC(=O)N/N=C/c1c(Br)c(C)n(-c2cc(C)ccc2C)c1C	20243816	OAMVKTICNOZZRW-DJKKODMXSA-N	362.271	3.943	50	40	FHGB	
CCCC/C(C)=N/NC(=O)C(=O)Nc1ccc(OCc2ccccc2)cc1	59444748	YUOSJTNLXWQFRI-XQNSMLJCSA-N	367.449	3.886	50	40	FHGB	
O=C1OC(=O)[C@]23Cc4ccccc4C[C@@]12C[C@@H]1Cc2ccccc2C[C@H]1C3	104188481	IQIBRSZRBYIBNJ-UWXQAFAOSA-N	358.437	3.666	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2cc([N+](=O)[O-])ccc2N(C)C)c(C)c1	408999382	KRUGYBBMBUSLNT-MHWRWJLKSA-N	364.405	3.823	50	40	FHGB	
O=C(CSCc1c(Cl)cccc1Cl)N/N=C/c1ccncc1	409127140	BZDLDLTUIVIEBJ-UFWORHAWSA-N	354.262	3.772	50	40	FHGB	
N#CC1=C(SCCOc2ccccc2)NC(=O)C[C@@H]1c1ccc(F)cc1	409303217	MHEBAKNVNYRAJO-QGZVFWFLSA-N	368.433	3.977	50	40	FHGB	
CCN(CC)C(=O)[C@H](Br)[C@@H](Br)c1ccccc1	1690346	ZNLSNPVEZHLCGQ-NWDGAFQWSA-N	363.093	3.755	50	40	FHGB	
O=C(COc1ccc2ccccc2c1)NNC(=O)Nc1cccc(Cl)c1	4156221	YFKZBINCHGETKX-UHFFFAOYSA-N	369.808	3.725	50	40	FHGB	
C/C(=N\NC(=O)CNc1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1	5657543	AUYTXBQFLDPCHV-WYMPLXKRSA-N	360.339	3.529	50	40	FHGB	
CCCCc1ccc(NC(=O)CCNC(=O)[C@@H](Br)CC)cc1	8733011	RJSMETWZPNXHFL-HNNXBMFYSA-N	369.303	3.648	50	40	FHGB	
Cc1n[nH]c2c1[C@H](c1ccc(-c3ccc(Cl)cc3)o1)C(C#N)=C(N)O2	8973355	POCUTTXWTZHJQP-INIZCTEOSA-N	352.781	3.850	50	40	FHGB	
COC(=O)[C@@H]1C(O)=NC(SC)=C(C#N)[C@@H]1c1ccc(Cl)cc1Cl	9089067	JXZUVPQUDLTWGP-RYUDHWBXSA-N	371.245	3.934	50	40	FHGB	
Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)Cc2ccccc2)o1	9260308	UDLVPSBIPRMULO-LPYMAVHISA-N	362.385	3.646	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2cc(OC)c(OC)cc2Cl)cc1	20764275	LFTPPDHHOAEZBI-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
Cc1cc2ccccc2nc1NNC(=O)CCc1nc(-c2ccccc2)no1	1319987016	VUPONGQGXCIISH-UHFFFAOYSA-N	373.416	3.669	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)cc1)c1cc(-c2ccccc2)n[nH]1	725528	TXABMMFFQCSRKO-YBFXNURJSA-N	369.222	3.603	50	40	FHGB	
CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)c3cccnc3)c2C)cc1	2648109	LXTICTGFWUNCDL-OEAKJJBVSA-N	362.433	3.652	50	40	FHGB	
CCOc1cc(C(=O)N/N=C/c2ccccc2F)cc(OCC)c1OCC	3239020	RAUBSOOKFRSAGQ-LPYMAVHISA-N	374.412	3.786	50	40	FHGB	
CCN(CC)c1ccc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1	5736335	DCOXIAMRCKLUAR-VBKFSLOCSA-N	364.405	3.987	50	40	FHGB	
Cc1nc(SCC(=O)N/N=C/c2ccc(Cl)cc2)c2ccccc2n1	8878006	IBKRBRQNQQWDSU-KEBDBYFISA-N	370.865	3.834	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)[C@H](C)SCc2ccccc2)c(O)c1	20248345	ICKBGJQBRCMTBH-PCXKXAPESA-N	370.474	3.729	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CC[C@H](C)C2)[C@H]1c1ccccc1	230101628	SPSUTBNAUGSSCK-BANJIEJESA-N	361.445	3.710	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=C(/C#N)C(=O)Nc2ccccc2)cc1OC	408742117	NCDJSXFKXYJIRO-GDNBJRDFSA-N	366.804	3.906	50	40	FHGB	
O=C(N/N=C\c1cccn1-c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1	408945268	NSAQUGYAJMXVDL-BKUYFWCQSA-N	374.356	3.896	50	40	FHGB	
COc1cc(OC)c(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc1Cl	408592486	YOEYSGDWHAHRMS-SRZZPIQSSA-N	360.841	3.667	50	40	FHGB	
Cc1cc(/C=N\NC(=O)COc2ccc(-c3ccccc3)cc2)c(C)n1C	408776481	ZSQZUEUGCPDSOA-UCQKPKSFSA-N	361.445	3.838	50	40	FHGB	
O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)C(c1ccccc1)c1ccccc1	704211	SOIFAJIJSUMQCP-PXLXIMEGSA-N	359.385	3.877	50	40	FHGB	
Cc1ccccc1N(CC(=O)N/N=C/c1ccccc1)C(=O)c1ccccc1	3184580	LFKJWGPSDMYJTR-LFVJCYFKSA-N	371.440	3.792	50	40	FHGB	
COc1ccc(-c2nc3cc(N4C[C@H](C(=O)Cl)CC4=O)ccc3o2)cc1	57327066	HKYGKAKULQGCSE-GFCCVEGCSA-N	370.792	3.622	50	40	FHGB	
N#C/C(=C/N1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1ccccc1	58161117	AECVKPZASMWHAY-NXVVXOECSA-N	366.852	3.508	50	40	FHGB	
O=C(N/N=C/c1ccc([N+](=O)[O-])o1)C1c2ccccc2Oc2ccccc21	2570963	WNXHVBRQHMQXDX-RGVLZGJSSA-N	363.329	3.576	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1	408963626	CWMUUHRMJBLSCE-YBFXNURJSA-N	353.334	3.504	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1cccc(C(F)(F)F)c1)c1ccccn1	408938851	SKHGOZVXVFQZHM-FSJBWODESA-N	358.323	3.655	50	40	FHGB	
N#C/C(=C/c1cc([N+](=O)[O-])ccc1Cl)C(=O)NCCCc1ccccc1	409244989	LROXTMARRICESD-WJDWOHSUSA-N	369.808	3.904	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1cccc(C(F)(F)F)c1)c1ccc(O)cc1	408932393	WQNRAMXHZOXDAW-FSJBWODESA-N	373.334	3.966	50	40	FHGB	
Cc1cc2c(cc1/C=N/NC(=O)c1ccccn1)[C@H](C)CC(C)(C)N2C	208215209	GHXVCXMTNYFOJO-LJGKHRNASA-N	350.466	3.876	50	40	FHGB	
O=C(Cc1c[nH]c2ccccc12)N/N=C/c1ccccc1Br	1513267	XEGASGSLQGQTMS-RGVLZGJSSA-N	356.223	3.623	50	40	FHGB	
O=C(NNC(=O)c1cccc2ccccc12)c1ccccc1Br	1995683	SYFZOPWQKVMOOJ-UHFFFAOYSA-N	369.218	3.677	50	40	FHGB	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccccc2Cl)c1	3217555	PHZHVSHUNQGCQW-UHFFFAOYSA-N	360.841	3.612	50	40	FHGB	
Cc1cc(C(=O)N/N=C\c2ccc(-c3ccc(Br)cc3)o2)[nH]n1	8574899	BYDHJEQMTGJUOS-NVMNQCDNSA-N	373.210	3.505	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc1OCC	14134551	BQLCNQWEIIHVJJ-HYARGMPZSA-N	354.450	3.794	50	40	FHGB	
CCN1C(=O)/C(=C/c2ccc(OCCBr)cc2)SC1=S	41108591	BNFBOMLEMJXRPN-XFXZXTDPSA-N	372.309	3.681	50	40	FHGB	
COC(=O)c1sccc1NC(=O)/C(C#N)=C/c1cn(C)c2ccccc12	49545257	UQUNWBVOTNDGSW-FMIVXFBMSA-N	365.414	3.572	50	40	FHGB	
C[C@@H](Oc1ccccc1Br)C(=O)N/N=C/c1ccccc1F	1085464	LCUOKKXRJXYLOJ-VURRPDKYSA-N	365.202	3.506	50	40	FHGB	
CCOc1ccc(-c2n[nH]c3c2[C@H](c2ccc(C)o2)C(C#N)=C(N)O3)cc1	4453082	NMLIDKOFHYILBY-INIZCTEOSA-N	362.389	3.595	50	40	FHGB	
CC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	408806634	FYEOLKGZGZZNNG-AUWXEVLLSA-N	369.377	3.685	50	40	FHGB	
N#C/C(=C\c1ccc(Cc2cccc(F)c2)c(Br)c1)C(N)=O	408875398	IENHBOODJFIULX-VGOFMYFVSA-N	359.198	3.571	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccc2c(c1)OCO2)c1ccc(C(C)(C)C)cc1	409144461	JWJWLUDIEMNMHF-HYARGMPZSA-N	352.434	3.796	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)Nc2cccc(Br)c2)c(C)n1C	408775236	OSZYRTJELIXDMP-ZSOIEALJSA-N	358.239	3.950	50	40	FHGB	
CN(C)c1cc(Cl)cc(Cl)c1/C=N/NC(=O)c1ccc(O)cc1	1775988642	RPGGQXAMOGSDNI-DJKKODMXSA-N	352.221	3.529	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccncc2)c(C)n1-c1ccc(Cl)cc1	5739693	RSUQXSVOJNZFGH-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
CCCCOc1ccc(/C=N\NC(=O)Cc2ccccc2)cc1OCC	169900918	HYLAFEGPCOCQSO-JWGURIENSA-N	354.450	3.957	50	40	FHGB	
CC(C)(C)c1n[nH]c2c1[C@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2	5051890	MEMSJZLIRKDKMV-GFCCVEGCSA-N	362.355	3.944	50	40	FHGB	
CC(/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)=C\c1ccco1	14921085	MOEPDVWIRCLIOA-XYKMIDAESA-N	360.413	3.721	50	40	FHGB	
C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccc(Cl)cc1Cl	2189076	VNOXXCFFCOKSIU-OAHLLOKOSA-N	365.216	3.804	50	40	FHGB	
N#CC1=C(SCC(=O)c2ccccc2)NC(=O)C[C@H]1c1cccs1	3140852	OPJMFDOCAPOZAP-CYBMUJFWSA-N	354.456	3.703	50	40	FHGB	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(Cl)s1	12917312	CNAKXZMGTXNMNW-NSHDSACASA-N	374.849	3.783	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2cc(Cl)cc([N+](=O)[O-])c2O)cc1	59335071	UIVJGRALMYMVBV-SDQBBNPISA-N	357.753	3.808	50	40	FHGB	
COc1ccc(-n2c(C)cc(/C=N/NC(=O)c3ccc(C)o3)c2C)cc1	408586620	CQISCMLXDSIPKU-CIAFOILYSA-N	351.406	3.768	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1ccc(Cl)cc1	408822164	LDSDDSBFEVOLBU-GXDHUFHOSA-N	370.792	3.983	50	40	FHGB	
CC(C)COc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1	408907618	BVIWKFWHOQEZIQ-SRZZPIQSSA-N	360.841	3.904	50	40	FHGB	
COc1ccc(OCC(=O)N/N=C\c2ccc(-c3cccc(F)c3)o2)cc1	409020408	OYDCEIMKCJBRPM-UUYOSTAYSA-N	368.364	3.623	50	40	FHGB	
CN(C)c1ccc(/C=N\NC(=O)COc2ccc(-c3ccccc3)cc2)o1	408994856	HHQBBYTZAZPXKZ-HMAPJEAMSA-N	363.417	3.542	50	40	FHGB	
CSc1nc(NNC(=O)c2ccccc2)c2c3c(sc2n1)CCC3	5024627	GGKZPKGOHRDWFL-UHFFFAOYSA-N	356.476	3.659	50	40	FHGB	
C/C(=N\NC(=O)Cc1ccccc1)c1ccc(NC(=O)c2ccco2)cc1	5892428	IOEJEVAUADFUBS-HZHRSRAPSA-N	361.401	3.615	50	40	FHGB	
Cc1cc2c(cc1/C=N/NC(=O)CSc1ccc(Cl)cc1)OCO2	8336784	TUWQDZUMMIZTNJ-UFWORHAWSA-N	362.838	3.620	50	40	FHGB	
Cc1ccc(S(=O)(=O)O[C@H](C#N)CO[Si](C)(C)C(C)(C)C)cc1	206562547	PIXYABSVURGQOD-CQSZACIVSA-N	355.532	3.614	50	40	FHGB	in-vitro
CC/C(=N\NC(=O)c1ccc(Br)cc1)c1cc(F)ccc1O	57556789	KHBXJESFHYHJLX-XMHGGMMESA-N	365.202	3.838	50	40	FHGB	
Cc1ccc(-c2nc(CC(=O)NNC(=O)C3CCCCC3)cs2)c(C)c1	9513239	BGROHALTOXPLFV-UHFFFAOYSA-N	371.506	3.697	50	40	FHGB	
CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc1OCC	8846171	HJCYKYRPHWETMU-HXUWFJFHSA-N	365.433	3.674	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(C)c(C)c1)OCO2	409086988	IFGDYPZWJNMBEM-LZYBPNLTSA-N	364.401	3.977	50	40	FHGB	
O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1ccc2ccccc2c1	408885944	BUIYKZCDRPQLDN-UFFVCSGVSA-N	352.777	3.986	50	40	FHGB	
Cc1ccc(C)n1-c1ccc(C(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1	13337858	GEHYLISKGACQLT-LPYMAVHISA-N	361.401	3.556	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@H](C)Nc2ccc(Cl)c(Cl)c2)cc1	850505	KFJXNECKGVLKQE-KKBVUKDESA-N	366.248	3.953	50	40	FHGB	
O=C(CCC(=O)NC1CCCCC1)N/N=C/c1cccc2ccccc12	3666823	IIUXIFGOCSHFJQ-PXLXIMEGSA-N	351.450	3.519	50	40	FHGB	
O=C(c1ccccc1)c1ccc(NS(=O)(=O)CCCCCl)cc1	3851072	BXJOEYQRNNLZKX-UHFFFAOYSA-N	351.855	3.678	50	40	FHGB	biogenic
CC(C)(C)c1ccc([C@H]2C[C@@H]2C(=O)N/N=C\c2ccc(C(=O)O)cc2)cc1	30802731	XYIDJLMIMJSDJT-IVGYBKNSSA-N	364.445	3.936	50	40	FHGB	
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)/C(C#N)=C/c1csc(C2CC2)n1	63276743	IOLVXYIDWGQSPD-NTUHNPAUSA-N	369.446	3.932	50	40	FHGB	
Cc1[nH]c2ccccc2c1C(=O)/C(C#N)=C\c1cnc(N2CCCC2)nc1	58407005	ADCFBWBXNOZLOU-YBEGLDIGSA-N	357.417	3.656	50	40	FHGB	
CC(C)(C)c1cc(C(=O)N/N=C/c2ccc(O)cc2)n(-c2ccccc2)n1	799234	QBLFCHYNSXJTIQ-HYARGMPZSA-N	362.433	3.639	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1cccc(C)c1	16678652	FNHKGHNPOZGJGH-DEDYPNTBSA-N	354.410	3.513	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)CSc2ncccc2Cl)Nc2ccccc21	102179398	NGGWYOIZYOKLAO-LFIBNONCSA-N	356.838	3.693	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3ccc(F)cc3)c2[C@H]1c1ccc(F)cc1	1068190	OZDIDZUEUZLQPQ-HNNXBMFYSA-N	350.328	3.573	50	40	FHGB	
Cc1ccc(C(C)C)c(OCC(=O)N/N=C/c2cc([N+](=O)[O-])cs2)c1	3175153	DMAPUCZEFCWETL-QGMBQPNBSA-N	361.423	3.617	50	40	FHGB	
Cn1cccc1/C=C(\C(=O)c1ccccc1)N1C=CC=CC1=C(C#N)C#N	4174056	DVLCLJMXJVXATP-KGENOOAVSA-N	352.397	3.936	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/C=C/c1ccc(Br)cc1	4544143	XLUZLUDJGLMWEH-NYIWCXCSSA-N	359.223	3.887	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)CN2CCCc3ccccc32)Sc2ccccc21	8119147	QQSMJHCZLNFNPC-PGMHBOJBSA-N	361.470	3.986	50	40	FHGB	
O=C(N/N=C\c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1ccccc1	30814063	NZYZBCIPTOQESX-MTJSOVHGSA-N	362.345	3.546	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(NC(=O)/C(C#N)=C\c2ccccc2)cc1	33687398	ZSCTUUDWMOWIMK-BKHHGCLFSA-N	371.396	3.702	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1c(C)cc(C)cc1C	59305875	OFJKWPSTMCMEOF-VCHYOVAHSA-N	364.445	3.982	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1cccc(Cl)c1	408822463	CARHEZXEXNRFIH-NTEUORMPSA-N	370.792	3.983	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)Nc2ccc(F)cc2)cc(OCC)c1O	408851640	DXTJSPPFAISLQM-MTJSOVHGSA-N	357.385	3.814	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)SCc1ccccc1)c1ccc2c(c1)OCCO2	4714595	RUIIBUBPRUGJEM-HFITWMCCSA-N	370.474	3.620	50	40	FHGB	
CCOc1ccccc1[C@H]1C(C#N)=C(N)Nc2onc(-c3ccccc3)c21	100616262	XYTDLUGDHRJOKJ-KRWDZBQOSA-N	358.401	3.992	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)cc1	20197499	WTROQDNAYRNQFX-YBFXNURJSA-N	361.785	3.801	50	40	FHGB	
O=C(NNc1c(F)c(F)nc(F)c1F)Nc1ccc(C(F)(F)F)cc1	3771014	ATRMQEREUQPFQH-UHFFFAOYSA-N	368.212	3.805	50	40	FHGB	
Cc1c(/C=N/NC(=O)COc2ccc(Cl)cc2)c2ccccc2n1C	18190738	FULZXWYWQWXABG-SRZZPIQSSA-N	355.825	3.669	50	40	FHGB	
COc1ccc2cc(/C(C)=N/NC(=O)c3ccc4c(c3)OCO4)ccc2c1	33044049	YZHGYSGCIUYKAO-LPYMAVHISA-N	362.385	3.731	50	40	FHGB	
CC[C@H](Nc1ccc(C)cc1C)C(=O)N/N=C/c1ccc(N(C)C)cc1	1001444	UMAXDXVDYLSOLQ-KWJZBXMYSA-N	352.482	3.710	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2[nH]c3c([N+](=O)[O-])cccc3c2C)cc1	2205121	WPCHTSDKZRPSLP-RGVLZGJSSA-N	366.377	3.547	50	40	FHGB	
O=C(COc1ccc(Cl)cc1)N/N=C/c1cc(Br)cs1	4018457	DWNUKJIETUIVHZ-OMCISZLKSA-N	373.659	3.693	50	40	FHGB	
C/C(=N/NC(=O)c1cc(-c2ccc(C)s2)n[nH]1)c1cccc([N+](=O)[O-])c1	4135661	MTRYONNMXUZQSA-WQRHYEAKSA-N	369.406	3.509	50	40	FHGB	
COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(OC)cc2)sc(C)c1C	949270	SZRLRDJVFBAREC-NTEUORMPSA-N	370.430	3.706	50	40	FHGB	
Cc1cccc(C)c1OCC(=O)N/N=C/c1ccc(Br)cc1	1437591	HKBCBXAQJMWPLO-VXLYETTFSA-N	361.239	3.595	50	40	FHGB	
CN(C(=O)[C@@]12CC[C@@](C)(C(=O)[C@@H]1Br)C2(C)C)c1ccccc1	16712936	FTAAUGWQDXBZLU-DOPJRALCSA-N	364.283	3.808	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)ccc1OCC#N	408805891	IBOWLRBYHBANQS-QPYDYZPCSA-N	367.449	3.590	50	40	FHGB	
Cc1cc(SCC(=O)N/N=C/c2ccc(O)cc2)c2cccc(C)c2n1	871098	ASQKKDPSNBNHFR-SRZZPIQSSA-N	365.458	3.800	50	40	FHGB	
N#CC1=C(N)Oc2ccc3ccc(=O)oc3c2[C@@H]1c1ccc(Cl)cc1	5945445	CXLATDWSPLCOAR-MRXNPFEDSA-N	350.761	3.665	50	40	FHGB	
CCOc1ccccc1NC(=O)C(=O)NN=C1CCC(C(C)(C)C)CC1	58885858	IEWHSKYEFRKVGZ-UHFFFAOYSA-N	359.470	3.732	50	40	FHGB	
CC(C)C1=C/C(=N\S(=O)(=O)c2ccccc2)[C@@](C)(Cl)[C@H](Cl)C1=O	12562492	AMKNSIWVDQASDH-GWFRJOEUSA-N	374.289	3.586	50	40	FHGB	
N#CC1=C(SCc2ccccc2)NC(=O)C[C@H]1c1cccc([N+](=O)[O-])c1	6448669	RHHUMTVSXDOENJ-INIZCTEOSA-N	365.414	3.867	50	40	FHGB	
O=C(Cc1ccc(Br)cc1)N/N=C/c1ccc(Cl)cc1	5862769	QREDKCOSKKJZBJ-VCHYOVAHSA-N	351.631	3.795	50	40	FHGB	
O=C(CSc1ccc(Cl)cc1)NNC(=O)Nc1ccc(F)cc1F	2570971	IWTOMZXDZRPGKG-UHFFFAOYSA-N	371.796	3.563	50	40	FHGB	
O=C(N/N=C1/CCCc2ccccc21)C(O)(c1ccccc1)c1ccccc1	694885	SGPFPAGLVBYXGP-LVWGJNHUSA-N	370.452	3.779	50	40	FHGB	
CC(C)CC(=O)NNC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1	58006754	ZWGYRZAUWNFPTM-UHFFFAOYSA-N	365.433	3.554	50	40	FHGB	
Cc1cccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCCCC2)c1	409002965	XNIFNYDVHREQMB-KGENOOAVSA-N	366.421	3.657	50	40	FHGB	
CCN(CC)c1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc([N+](=O)[O-])cc1	5322064	ZGCSLKRRWDNVMM-IBGZPJMESA-N	364.405	3.659	50	40	FHGB	
O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccccc1Cl	831135	IRKSFQVWZSYPOP-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)COc2cccc(Cl)c2)cc1	941966	AUUOHBULODOHHT-FYJGNVAPSA-N	359.857	3.715	50	40	FHGB	
COc1ccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C#N)cc1OC	3215425	ZBWJSVWOSUJXRK-UHFFFAOYSA-N	356.385	3.987	50	40	FHGB	
CC(C)N1CCC(=NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1	5384385	MUWDLNLXHPITMR-GFCCVEGCSA-N	372.296	3.737	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2cc(Cl)c(O)c(OCC)c2)cc1	6683806	ILDBLELTFDNGPW-RGVLZGJSSA-N	362.813	3.607	50	40	FHGB	
CCCc1[nH]nc2c1[C@@H](c1ccc(OC3CCCC3)cc1)C(C#N)=C(N)O2	8382680	STCUPEZVMRQGQV-SFHVURJKSA-N	364.449	3.902	50	40	FHGB	
O=C(Cn1ccc(C(F)(F)F)n1)NN(c1ccccc1)c1ccccc1	68741516	NKRNSPHHEBYYQO-UHFFFAOYSA-N	360.339	3.771	50	40	FHGB	
Cc1ccc(-n2c(C)cc(/C=N/NC(=O)CNC3CCCCC3)c2C)cc1	409379744	ZAILRXQWDJRMTD-ZVHZXABRSA-N	366.509	3.775	50	40	FHGB	
CCOc1cc(/C=C(/C#N)c2cccc([N+](=O)[O-])c2)ccc1OCC(=O)O	6844841	DZRCETIQUADXSB-NVNXTCNLSA-N	368.345	3.521	50	40	FHGB	
CN(C)C(=O)/C(C#N)=C\c1cn(Cc2cccc([N+](=O)[O-])c2)c2ccccc12	59334594	WDXUMQPDVVOAEF-WJDWOHSUSA-N	374.400	3.593	50	40	FHGB	
COc1cccc(/C=N\NC(=O)c2cc3cc(Cl)ccc3o2)c1OC	409015550	OCGRTPMJZWDEMJ-JMIUGGIZSA-N	358.781	3.867	50	40	FHGB	
Cc1nn(-c2ccccc2)c(C)c1/C=N\NC(=O)c1ccc(Cl)cc1	408995210	AWMHKNGEMVZAJN-MTJSOVHGSA-N	352.825	3.906	50	40	FHGB	
Cc1cc(Cl)ccc1NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)cc1	408802411	ZWUCYNKKFNNRMK-NTEUORMPSA-N	370.792	3.658	50	40	FHGB	
CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccccc4)c32)cc1	4993093	YWVUNQBNZYGISM-QGZVFWFLSA-N	358.401	3.694	50	40	FHGB	
O=C(COc1cc(Cl)c(Cl)cc1Cl)N/N=C/c1ccccc1O	3149893	BBKVUKYKHFUCPD-FBCYGCLPSA-N	373.623	3.882	50	40	FHGB	
Cc1cccc(C(=O)NNC(=S)Nc2ccc(Cl)cc2Cl)c1	4753367	ZLCBHPBFXUMBOJ-UHFFFAOYSA-N	354.262	3.933	50	40	FHGB	
COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2[nH]nc(-c3ccc(C)cc3)c21	20033309	UFFREBLTLVXNRT-QGZVFWFLSA-N	358.401	3.612	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C/c1ccc(OC(=O)c2ccccc2)cc1	1458006	MAXJNLWZERRNDL-XQNSMLJCSA-N	358.397	3.599	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)cc1Cl)C(=O)Nc1ccccc1Cl	3008743	VZIWRWKEVYQKRR-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)c(O)c1	3212119	IFSDIMVTWMHLHL-YDZHTSKRSA-N	363.417	3.506	50	40	FHGB	
CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(Br)o2)cc1	4722810	XTUJWHSLHUNFRB-LUAWRHEFSA-N	361.195	3.986	50	40	FHGB	
N#C/C(=C\N1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1ccccc1	5488694	AECVKPZASMWHAY-FOCLMDBBSA-N	366.852	3.508	50	40	FHGB	
CC(C)N(C(=O)CCl)C1CCC(NC(=O)OCc2ccccc2)CC1	79392731	XLTOXUILBPGDFS-UHFFFAOYSA-N	366.889	3.700	50	40	FHGB	
COc1cc(/C=C(\C#N)c2nc3cc(C)c(C)cc3[nH]2)cc([N+](=O)[O-])c1O	408542575	JUDWRSRZRJXULX-AWNIVKPZSA-N	364.361	3.866	50	40	FHGB	
Cc1cc(N2CCOCC2)ccc1/C=C(/C#N)C(=O)Nc1ccc(F)cc1	409076117	XZLQPTSKLRMUQA-LGMDPLHJSA-N	365.408	3.516	50	40	FHGB	
C#CCOc1ccc(/C=N\NC(=O)c2cc3cc(OCC)ccc3o2)cc1	409187304	ORJZKTONFOCLBP-HMAPJEAMSA-N	362.385	3.607	50	40	FHGB	
CCN(C(=O)c1cccc(NC(=O)CBr)c1)c1ccccc1	35605311	RFYKUHAVOOKKPC-UHFFFAOYSA-N	361.239	3.687	50	40	FHGB	
CCCCCOc1ccccc1/C=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1	2166401	MUHGJAUWPWZKNF-RCCKNPSSSA-N	369.421	3.857	50	40	FHGB	
O=C(CNc1ccccc1)N/N=C/C(Br)=C/c1ccccc1	4711927	JUZWVGUGPZDGKM-JABDDIKQSA-N	358.239	3.637	50	40	FHGB	
COc1cccc(C(=O)N/N=C(\CC(F)(F)F)C(=O)c2cccs2)c1	4836794	KMALZNIRUIJOAK-UDWIEESQSA-N	370.352	3.678	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)c(Cl)cc1OC	408789329	OTNUUXFPRBPUOO-MDWZMJQESA-N	372.808	3.999	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)o1)c1cccc(C(F)(F)F)c1	408962333	HMMBUNLJYSBKII-CNHKJKLMSA-N	361.117	3.825	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N/NC(=O)Cc3ccccc3)o2)cc1[N+](=O)[O-]	409036335	VQXTUBWCASANCN-FYJGNVAPSA-N	363.373	3.856	50	40	FHGB	
O=C(Cc1ccc(F)cc1)N/N=C\c1cccn1-c1ccc(Cl)cc1	409236094	QYGOGCSMIHTDOO-XKZIYDEJSA-N	355.800	3.963	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(C(=O)O)cc1	408725972	JPKCUHGAKOYNSA-VSMYLPJWSA-N	362.838	3.669	50	40	FHGB	
O=C(N/N=C/c1cccc(Cl)c1)C(=O)Nc1cc(Cl)cc(Cl)c1	408964540	TXZWUPHXKYARNI-UFWORHAWSA-N	370.623	3.736	50	40	FHGB	
O=C(O)c1ccc(-n2cccc2/C=N\NC(=O)c2cc3ccccc3o2)cc1	30820832	HMPUGTPBQKNAHY-XKZIYDEJSA-N	373.368	3.686	50	40	FHGB	
CCC[C@@H](Br)C(=O)Nc1nc2ccc(NC(C)=O)cc2s1	20132810	YEACUIGMKQJLQW-SNVBAGLBSA-N	370.272	3.757	50	40	FHGB	
O=C(N/N=C/C1CCCCC1)c1ccc(C(=O)N/N=C/C2CCCCC2)o1	695772	DIJBCARHXBFGSN-JFMUQQRKSA-N	372.469	3.871	50	40	FHGB	
COc1cc(C(=O)N/N=C/C(Cl)=C/c2ccccc2)cc(OC)c1OC	3275817	SFNVBUXGYMSMMQ-IYKLUDEYSA-N	374.824	3.708	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1	408677889	VTPALDKAXXWAPW-HAVVHWLPSA-N	364.493	3.897	50	40	FHGB	
O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1cccnc1	3182159	NMZFEYPYPAENBF-BUVRLJJBSA-N	367.412	3.698	50	40	FHGB	
CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(N(CC)CC)cc2)cc1	672096	RTAPZIWBCJANQF-PXLXIMEGSA-N	366.465	3.645	50	40	FHGB	
Cc1ccc(OCC(=O)Oc2ccc([N+](=O)[O-])cc2)c(Br)c1	673890	WDKROWZEWUTANP-UHFFFAOYSA-N	366.167	3.650	50	40	FHGB	
CCCCOc1ccc(C(=O)N/N=C/c2coc3ccccc3c2=O)cc1	2752533	CQKMJUOKGSACTG-LPYMAVHISA-N	364.401	3.736	50	40	FHGB	
COc1cc(OC)cc(C(=O)NNc2nc3c(C)cc(C)cc3s2)c1	4121446	CETSVDCEUYHPNK-UHFFFAOYSA-N	357.435	3.687	50	40	FHGB	
O=C(CCCc1ccc(O)cc1)N/N=C/c1ccc(Br)cc1	6241857	RDVZMYZYDXRIBH-XDHOZWIPSA-N	361.239	3.628	50	40	FHGB	
O=C(NNC(=O)c1ccccc1F)c1ccc(-c2ccccc2Cl)o1	7957632	GABVPFHTDAZYCL-UHFFFAOYSA-N	358.756	3.814	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)NC1CCCC1	13371751	FPBPNWVGVVHEMU-PTNGSMBKSA-N	350.374	3.611	50	40	FHGB	
O=C(COc1ccccc1Cl)N/N=C\c1ccc(Br)s1	33474498	LQDHZHAYDAAUCK-APSNUPSMSA-N	373.659	3.693	50	40	FHGB	
CCc1cc(C)cc(OCC(=O)N/N=C/c2c(C)n(C)c3ccccc23)c1	59678752	BFPVPZSODQPOEH-YDZHTSKRSA-N	363.461	3.887	50	40	FHGB	
O=N[C@H]1[C@@H]2C[C@H]([C@@H]3C[C@H](Br)[C@H](Br)[C@@H]32)[C@H]1Cl	100498133	RTOAGUKGFNBCKI-WUAFESOFSA-N	357.473	3.542	50	40	FHGB	
CN(C(=O)[C@]12CC[C@@](C)(C(=O)[C@H]1Br)C2(C)C)c1ccccc1	100868180	FTAAUGWQDXBZLU-BVGQSLNGSA-N	364.283	3.808	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)NN=Cc1ccccc1Cl)c(C)n2C	252679829	RTZFQUXZFNYEAC-UHFFFAOYSA-N	355.825	3.913	50	40	FHGB	
C#CCOc1ccc(OC)cc1/C=N/NC(=O)c1ccc(C(C)(C)C)cc1	408598785	JQWHAQZLEDLLLV-HZHRSRAPSA-N	364.445	3.769	50	40	FHGB	
C/C(=N/NC(=O)[C@@H](C)Nc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1	4647019	XJTPOFJXVZHWFQ-WXYNYTDUSA-N	360.801	3.589	50	40	FHGB	
BrCc1nn(-c2ccccc2)c2nnc(-c3ccccc3)nc12	68602656	DLJUIEPTPDJKLZ-UHFFFAOYSA-N	366.222	3.772	50	40	FHGB	biogenic
COc1ccc(C(=O)N/N=C(\CC(=O)c2cccs2)C(F)(F)F)cc1	100338971	XFZXGMKACJNASM-XSFVSMFZSA-N	370.352	3.678	50	40	FHGB	
Cc1cc(/C=N\NC(=O)CSc2nc3ccccc3s2)cc(C)c1O	108948734	VIVXXRWHPFTHGX-OCKHKDLRSA-N	371.487	3.861	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc(Cl)c1OC	408794746	JCFZEVFWRMYPBF-MDWZMJQESA-N	372.808	3.999	50	40	FHGB	
COc1c(Cl)cc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1Cl	408964695	DDEGNSPBVJXAKZ-ODCIPOBUSA-N	366.179	3.777	50	40	FHGB	
C#CCn1c(C)c(/C=C(\C#N)C(=O)Nn2c(C)ccc2C)c2ccccc21	409376525	YTPWIVWHUHZQEK-QGOAFFKASA-N	356.429	3.679	50	40	FHGB	
COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)c2ccc(C)o2)o1	408726482	TTYZYEPGJBAICL-VXLYETTFSA-N	369.333	3.529	50	40	FHGB	
COc1cc([N+](=O)[O-])cc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)c1O	408747028	YBIVELOIZDDSFU-WDZFZDKYSA-N	373.752	3.508	50	40	FHGB	
CCCOc1cccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)OC)cc2)c1	408933499	AJCQYSFMHLEVIT-ATVHPVEESA-N	364.401	3.808	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1	408997196	LUSKCVQYKMAMNM-HZHRSRAPSA-N	373.412	3.711	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Sc1ccc(C)cc1)c1ccc([N+](=O)[O-])cc1	409129669	VURGBCOPZYXDAY-NFECSFHCSA-N	357.435	3.924	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)ccc1O	942399	OJQPHECJQXZWNS-LPYMAVHISA-N	370.449	3.618	50	40	FHGB	
C=CCN1C(=O)/C(=C2/Sc3ccccc3N2C)S/C1=N\CCCl	3149609	XNYSTUYTJFXNMM-ALKJTPJRSA-N	365.911	3.754	50	40	FHGB	
O=C(N/N=C/c1sc(Nc2ccccc2)nc1Cl)c1cccnc1	3344987	OYFGQABAALKAQM-VXLYETTFSA-N	357.826	3.699	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2cc3cc(Br)ccc3o2)cc1	83292841	ONWBHBSWKRDQFP-GRSHGNNSSA-N	373.206	3.968	50	40	FHGB	
CCOC(=O)c1cn(CCCCl)c2cc(C(F)(F)F)ccc2c1=O	199731490	OCPMIZPVLQNAEF-UHFFFAOYSA-N	361.747	3.826	50	40	FHGB	
Cn1nc(-c2ccccc2)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	253406839	VBNXIVVZKXRYEE-LJQANCHMSA-N	374.444	3.538	50	40	FHGB	
Cc1ccc(SCC(=O)N/N=C/c2cccc(OC3CSC3)c2)cc1	408842589	QQMLBSUWKCDAAW-KEBDBYFISA-N	372.515	3.732	50	40	FHGB	
Cc1cccc(COc2ccccc2[C@@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)c1	409136808	VPXSUJPCWUCXHR-HXUWFJFHSA-N	372.428	3.824	50	40	FHGB	
CCCc1n[nH]c2c1C1(C(C#N)=C(N)O2)c2ccccc2-c2ccccc21	4150187	HHYRKMNGJBHODC-UHFFFAOYSA-N	354.413	3.763	50	40	FHGB	
CCCCC1CCC(C(=O)NNc2nc3ccccc3c(=O)n2CC)CC1	10680803	LLYAALZPXIRPES-UHFFFAOYSA-N	370.497	3.856	50	40	FHGB	
Cc1cc(/C=N/NC(=O)CNC2CCCCC2)c(C)n1-c1ccc(F)cc1	409378182	NJHHREHPQNZTDN-ZMOGYAJESA-N	370.472	3.606	50	40	FHGB	
N#CC1=C2SCN(Cc3ccco3)CN2C(=O)C[C@@H]1c1ccccc1F	20348340	MYMONVUDPHNFKN-OAHLLOKOSA-N	369.421	3.634	50	40	FHGB	
C[S@](=O)c1ccc(C(=O)NN=C(c2ccccc2)c2ccccc2)cc1	65492471	XPOYJZQKKLMFQS-AREMUKBSSA-N	362.454	3.606	50	40	FHGB	
N#C/C(=C\c1ccc(I)cc1)C(=O)Nc1ccccc1	408727682	VWCVLSSERQNVMY-JLHYYAGUSA-N	374.181	3.837	50	40	FHGB	
O=C(N/N=C/c1ccccc1O)[C@@H]1Cc2ccccc2[C@H]1C(Cl)Cl	1575162	HUGRKRXTSNUAFA-XDVRNAMESA-N	363.244	3.602	50	40	FHGB	
O=C(N/N=C/c1cc([N+](=O)[O-])c(Cl)cc1Cl)c1ccc(F)cc1	704688	YQZQKCRVAXMCHD-CNHKJKLMSA-N	356.140	3.805	50	40	FHGB	
CCCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1OC	4168358	APHTTZKUDFBGPD-SFHVURJKSA-N	368.437	3.514	50	40	FHGB	
O=C(COc1ccc(-c2ccccc2)cc1)NNC(=O)Nc1ccccc1	5948060	RIVBMFLMTKFOBU-UHFFFAOYSA-N	361.401	3.585	50	40	FHGB	
C/C(=N\NC(=O)CN1CCCc2ccccc21)c1nc2ccccc2s1	6980628	JBGJUVKWDLRCIA-HYARGMPZSA-N	364.474	3.589	50	40	FHGB	
N#C/C(=C\c1c(F)cccc1F)c1nc(N)nc(Nc2ccccc2)n1	11296504	SRVUSRLBUGCJEC-PKNBQFBNSA-N	350.332	3.540	50	40	FHGB	
Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C\c1c(F)cccc1Cl	59444778	PSPUCIFAYIHBNE-ZBKNUEDVSA-N	368.195	3.530	50	40	FHGB	
Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)c1	59472222	AMLQAWVVUPHYMT-LPYMAVHISA-N	351.450	3.690	50	40	FHGB	
N#CC(C#N)=C(N)/C(C#N)=C(\C=C\c1cccc(Br)c1)C1CC1	110213200	SDSVHNDEWZMEJV-NWRLYJHWSA-N	365.234	3.952	50	40	FHGB	
CC[C@H](Br)C(=O)NCCC(=O)Nc1ccc([C@H](C)CC)cc1	8733026	KXZNNHPWYAYLKK-DOMZBBRYSA-N	369.303	3.818	50	40	FHGB	
N#C/C(=C\c1ccccc1)C(=O)Oc1ccc(C=O)cc1Br	408753342	OAGKTAXWZBQIOA-RIYZIHGNSA-N	356.175	3.774	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)ccc1OC	408965581	WBJLUKHIEDNLIU-SSDVNMTOSA-N	366.339	3.877	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)c1	408534750	WRRSHDGMDUSKCU-FOKLQQMPSA-N	365.355	3.666	50	40	FHGB	
CCCCc1ccc2[nH]/c(=N\C(=S)NC(=O)CCCCl)sc2c1	32118985	XSRYZOUKXGJMTN-UHFFFAOYSA-N	369.943	3.893	50	40	FHGB	
O=C(N/N=C/c1cccc(O)c1)c1ccc(NC(=O)C2CCCCC2)cc1	674544	BFYMUSALEKIFLX-HYARGMPZSA-N	365.433	3.675	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)COc1c(C)cccc1C	1103483	ZMBZVFOZWTYCNZ-YDZHTSKRSA-N	362.429	3.994	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)NCc1ccccc1	2337595	YMVKTSGSPWFUQM-LDADJPATSA-N	372.380	3.868	50	40	FHGB	
C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1ccccc1O	5527764	YTOHAVNXTPAHPR-XPAGJJBOSA-N	353.205	3.617	50	40	FHGB	
C[C@H]1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc(OC(F)(F)F)cc1	2561524	CFJHPNILZRCIJV-BJOHPYRUSA-N	364.323	3.646	50	40	FHGB	
CN1/C(=C(\C#N)C(=O)c2ccc(Br)s2)Nc2ccccc21	11617382	PZOTWBFFIRIMMK-OQLLNIDSSA-N	360.236	3.990	50	40	FHGB	
O=[P@@]1(N(CCCl)CCCl)NCC23C[C@@H]4CC(C[C@H](C4)C2)[C@H]3O1	104211289	KQPFNDFZAYNYAJ-MGKACFPVSA-N	367.257	3.689	50	40	FHGB	
COc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1Cc1cc(C)cc(C)c1	408870545	WKYYJTJSBJTLJG-FRKPEAEDSA-N	354.837	3.949	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(N(C)C)o1	408996434	DRZFWOISIDHALJ-VDCVXVNISA-N	351.859	3.630	50	40	FHGB	
N#CC1=C(SCc2ccc(C#N)cc2)NC(=O)[C@H](C#N)C12CCCCC2	3418704	PFBCIJMUYCDQNT-INIZCTEOSA-N	362.458	3.747	50	40	FHGB	
N#C/C(=C\c1ccc(Br)cc1F)C(=O)NCc1ccccc1	13137656	WYYYIWQRGFIPHY-RIYZIHGNSA-N	359.198	3.812	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C\c1ccc(OCc2cccc([N+](=O)[O-])c2)cc1	4506794	MWAMXDLQHBLAIK-YVLHZVERSA-N	365.389	3.605	50	40	FHGB	
CCCCOc1ccc(/C=C(\C#N)C(=O)NCc2ccco2)cc1OC	28495792	YATYAGBPMLMFEX-LFIBNONCSA-N	354.406	3.690	50	40	FHGB	
COc1cc(OC)c(/C=N\NC(=O)Cc2cc(C)ccc2C)cc1Cl	409366757	XYZJJRKTGFNVDO-NHDPSOOVSA-N	360.841	3.667	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)CC(=O)Nc2ccc(Cl)c(Cl)c2)cc1	3093579	NNPMZFOCGXFDSI-KEBDBYFISA-N	364.232	3.781	50	40	FHGB	
O=C(CCc1ccccc1)NNC1=C(C(=O)C(F)(F)F)CCCCC1	59489009	DDVSAYGYDYOBBH-UHFFFAOYSA-N	354.372	3.590	50	40	FHGB	
COc1cc(C)c(/C=N\NC(=O)c2cccc(-n3cccc3)c2)cc1OC	408548100	DJZLQIAQYMTVKY-HMAPJEAMSA-N	363.417	3.567	50	40	FHGB	
C[C@@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc([N+](=O)[O-])s1	1081814	DQCDDUONGDZAND-ZGXHQARYSA-N	368.418	3.760	50	40	FHGB	
O=c1c2ccccc2n2c(CCl)nnc2n1-c1ccc(F)c(Cl)c1	15424623	LICABCCSZCKVSN-UHFFFAOYSA-N	363.179	3.565	50	40	FHGB	
Cc1n[nH]c2c1[C@H](c1ccc(-c3cccc(Cl)c3)o1)C(C#N)=C(N)O2	818760	RWTIUDVCBQDVDM-INIZCTEOSA-N	352.781	3.850	50	40	FHGB	
O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1cccs1)c1ccco1	1105673	RWGNYGAGYWWDOB-UDWIEESQSA-N	362.414	3.958	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)c(C)n1-c1ccccn1	409189054	HYWOLXFIHFHADO-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(N2CCCC2)cc1	408676692	MKFCLVKMTAEGQQ-UDWIEESQSA-N	372.812	3.612	50	40	FHGB	
COc1cc2c(cc1/C=N\NC(=O)c1cc3cc(Cl)ccc3o1)OCO2	409024106	VOTNIIOBZSNBMF-ZBKNUEDVSA-N	372.764	3.587	50	40	FHGB	
CCOC(=O)/C(C#N)=C/NC[C@H](c1cccs1)c1c[nH]c2ccccc12	103550342	NLBYGOBXFMTMIT-WKOYGUFESA-N	365.458	3.921	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C/c1cccc(OC(=O)c2cccs2)c1	3101598	FUENQDVUFREJFC-KGENOOAVSA-N	364.426	3.660	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)N2CCCC2)ccc1OCc1ccccc1	16214814	WMSBSEBLOVTHHL-UYRXBGFRSA-N	362.429	3.804	50	40	FHGB	
CCN(CC)CCCNC(=S)P(=O)(c1ccccc1)c1ccccc1	2380460	VZXHPELOBKPSKN-UHFFFAOYSA-N	374.490	3.607	50	40	FHGB	
COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(F)cc2)sc(C)c1C	2669856	OYFISDQJNAOPRG-MDWZMJQESA-N	358.394	3.836	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1cc(Br)c(OCC)c(OCC)c1	6944308	VKDPMBPBGCZRNN-GHXNOFRVSA-N	368.227	3.717	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(SCc2ccco2)c([N+](=O)[O-])c1	17256783	ZEPUUVIRGHGCLB-JYRVWZFOSA-N	358.375	3.950	50	40	FHGB	
C/C(Cc1ccccc1)=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1	20248385	WKXCGNGGMKPEOX-XMHGGMMESA-N	357.435	3.563	50	40	FHGB	
CC(C)(C)OC(=O)NNC(=O)NCCC(c1ccccc1)c1ccccc1	24637994	YOUGGSYDFASTLG-UHFFFAOYSA-N	369.465	3.948	50	40	FHGB	
CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cccc(OCC)c2)cc1	59269700	ZDJJFXBJXMYFSL-SFQUDFHCSA-N	364.401	3.808	50	40	FHGB	
Cn1c(CCNC(=O)CCCC[C@@H]2CCSS2)nc2ccccc21	96114510	PKOAOQKPJUOYQV-CQSZACIVSA-N	363.552	3.946	50	40	FHGB	biogenic
CCOc1ccc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)c2ccccc12	409197091	VREAFWSYDLRJOC-UDIPQKBFSA-N	357.413	3.996	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2Cl)cc(OC)c1OC	2708457	JHJAJYKPRSGGOG-MDWZMJQESA-N	372.808	3.911	50	40	FHGB	
CN1C2=C(C#N)[C@@](c3ccccc3)(C(F)(F)F)NC(=O)N2c2ccccc21	3227168	QSXSNZHAFQYIML-SFHVURJKSA-N	370.334	3.859	50	40	FHGB	
COc1ccc(-c2cc(C(=O)N/N=C(/C)c3ccc(Cl)cc3)[nH]n2)cc1	5443927	TWHWZTAVLMKNNL-MTJSOVHGSA-N	368.824	3.893	50	40	FHGB	
CC/C(Cc1ccccc1)=N\NC(=O)C(=O)Nc1ccc(Cl)cc1C	5727574	BLILTGYMDXQKBI-CJLVFECKSA-N	357.841	3.712	50	40	FHGB	
C#CCOc1ccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)cc1	6295371	JABHTEGYTGREQG-UDWIEESQSA-N	358.850	3.594	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)N(C)[C@@H](C)c2cc3ccccc3o2)cc1	32779667	IYOQGWXVWVAWOU-AWEZNQCLSA-N	351.406	3.789	50	40	FHGB	
Cn1cc(C(=O)N/N=C\c2cccc(Br)c2)c2ccccc21	33333309	FEUXVPPSUWONJF-GRSHGNNSSA-N	356.223	3.705	50	40	FHGB	
CCOC(=O)c1ccc(N/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)cc1	101192752	UZRUYPMIKOOSKQ-WYMLVPIESA-N	369.808	3.975	50	40	FHGB	
COc1ccc(CCCC(=O)N/N=C/c2ccc(C)c([N+](=O)[O-])c2)c(C)c1	408910450	WQPFBCQAEIZAAX-FYJGNVAPSA-N	369.421	3.693	50	40	FHGB	
CCCC(O)(CCC)C(=O)N/N=C(\C)c1ccc(Br)cc1	4811956	FNIXRPOMJPSVPD-LDADJPATSA-N	355.276	3.621	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)c2cc3ccccc3cc2O)cc1OC	5288954	MJFBHDJADKDPAB-LPYMAVHISA-N	364.401	3.717	50	40	FHGB	
N#CC(C(=O)CN1CCC(Cc2ccccc2)CC1)=C1Nc2ccccc2N1	7612791	WHNVFCQCYKLTFN-UHFFFAOYSA-N	372.472	3.783	50	40	FHGB	
Cc1nn(C)c(Cl)c1/C=C/C(=O)NNc1ccccc1C(F)(F)F	54565469	YTGPIMNOBFQYFG-BQYQJAHWSA-N	358.751	3.557	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C\c2ccc(Br)cc2)cc1	408711993	UMEPDNHKSGQSOJ-UNOMPAQXSA-N	361.239	3.541	50	40	FHGB	
CCOc1cccc(/C=N\NC(=O)c2ccc(OCC)c(OCC)c2)c1	409317116	OYXLNXIZZZEIQE-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)CCC(=O)Nc2cc(Cl)ccc2Cl)o1	2100813	RPGVHCFTMWOBKW-DJKKODMXSA-N	368.220	3.764	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2O)ccc1OC(C)C	5409324	POYAVFIMFVIVFL-XNTDXEJSSA-N	352.390	3.734	50	40	FHGB	
CCOc1cc(C(=O)N/N=C\c2ccc(OC)c(Cl)c2)ccc1OC	409324564	UUKJNBMYFJMUMO-JAIQZWGSSA-N	362.813	3.520	50	40	FHGB	
COc1ccc(CCCC(=O)N/N=C/c2cc(Cl)ccc2O)c(C)c1	408910852	LTSDJXUKQYDSLB-CIAFOILYSA-N	360.841	3.836	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C(\C)c2ccc(OC)cc2OC)cc1	216064765	UKALRDVBODDFJL-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
O=C(CCl)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1	95682180	PMPCVXLLWURZJI-UHFFFAOYSA-N	353.809	3.788	50	40	FHGB	
Cc1nn(C)c2ncc(/C=C(\C#N)C(=O)Nc3ccc(F)c(Cl)c3)cc12	96314839	LHRPYUMRXQGAJT-LFYBBSHMSA-N	369.787	3.615	50	40	FHGB	
COC(=O)/C=C\C[P+](c1ccccc1)(c1ccccc1)c1ccccc1	100387185	ZXBTZXOFZBTFSO-WQRHYEAKSA-N	361.401	3.710	50	40	FHGB	
CCOC(=O)c1c(C)[nH]c(C(=O)/C(C#N)=C\c2ccc(OCC)cc2)c1C	6207494	LWTZRUWFVYZFEH-WJDWOHSUSA-N	366.417	3.997	50	40	FHGB	
CCc1ccc(OCCCOc2c(/C=N/NC(C)=O)cccc2OC)cc1	9553862	IYLKCBPVQRHMOB-PXLXIMEGSA-N	370.449	3.576	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1cccc([N+](=O)[O-])c1	408862581	HMHBALKEHGYLJB-KPKJPENVSA-N	357.753	3.802	50	40	FHGB	
COc1ccc(/C=N\NC(=O)CSc2nc3ccccc3s2)cc1	31282916	ZHWOZHUDZLEPIT-ZDLGFXPLSA-N	357.460	3.547	50	40	FHGB	
COc1cccc(/C=N/NC(=O)[C@H](C)Nc2ccc3ccccc3c2)c1O	1095717	FSVAFLXQOBQMOR-KOUDTOEKSA-N	363.417	3.505	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1-c1ccc(Cl)cc1	3333717	AIVANJLZMBVMOG-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
O=C(O)/C=C/C(=O)Nc1ccc2c(c1)[C@H](Br)c1ccccc1-2	1681541	JTIYJRIPYLNEHT-IWAYRVGRSA-N	358.191	3.731	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)COc2ccc([C@H](C)CC)cc2)c1O	1319852	SGQVEZOTVFBRII-IKMPRTQCSA-N	370.449	3.834	50	40	FHGB	
Cc1ccc(C)c(OCC(=O)N/N=C\c2cc(Cl)cc(Cl)c2O)c1	4601984	UDPFWMVBASRLAO-ZBKNUEDVSA-N	367.232	3.845	50	40	FHGB	
C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccc(Cl)cc1Cl	2189075	VNOXXCFFCOKSIU-HNNXBMFYSA-N	365.216	3.804	50	40	FHGB	
C[C@@]1(Br)C[P@](=O)(c2ccccc2)C[C@@H]1Br	1665728	WLMNWAODWCNVJT-RWSFTLGLSA-N	352.006	3.606	50	40	FHGB	
CC(C)COc1ccc(C(=O)N/N=C/c2coc3ccccc3c2=O)cc1	2754685	JJHPJUDZGTZCQW-SSDVNMTOSA-N	364.401	3.592	50	40	FHGB	
BrCCOc1c(Br)cccc1Br	21012604	GGANKCYHHSNNJR-UHFFFAOYSA-N	358.855	3.985	50	40	FHGB	
COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1C)OCO2	409093589	AYCKFNXNYYZLJR-VIZOYTHASA-N	350.374	3.586	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=S)ccc1OCc1ccccc1C#N	408541423	ARODBLOABJKBLZ-RQZCQDPDSA-N	363.442	3.729	50	40	FHGB	
COc1cccc(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)c1OC	33593430	HDOVAQRXRFJOGQ-JLPGSUDCSA-N	374.440	3.986	50	40	FHGB	
CC(C)c1ccc([C@H]2[C@@H]3CSCC=C3C(C#N)=C(N)C2(C#N)C#N)cc1	1438267	DOQZLYHJAPRIQA-MOPGFXCFSA-N	360.486	3.967	50	40	FHGB	
COC1=C/C(=N/c2ccc(N(CCCl)CCCl)cc2)C=CC1=O	4774367	WEZPCKABMLDZEE-XSFVSMFZSA-N	353.249	3.712	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1occc1-c1ccccc1	12975207	IHSUWKJZPDBJJT-UHFFFAOYSA-N	364.445	3.924	50	40	FHGB	
O=[N+]([O-])c1cc([C@H](O)CBr)ccc1OCc1ccccc1	22011964	HQGAJOFIQLBIIM-CQSZACIVSA-N	352.184	3.602	50	40	FHGB	in-vitro
Cc1c(/C=N\NC(=O)COc2ccc(Cl)cc2)c2ccccc2n1C	97024568	FULZXWYWQWXABG-NHDPSOOVSA-N	355.825	3.669	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Cl)cc1Cl)=N\NC(=O)c1cccnc1	101376987	QOKGHSZMGLGSCO-UFFVCSGVSA-N	365.220	3.523	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1cc(C)ccc1C	408823885	GTOYYIKIIGLSML-GZTJUZNOSA-N	364.401	3.946	50	40	FHGB	
CC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)NCc3ccco3)o2)cc1	408980565	FPEMGDPSMZILOB-GZTJUZNOSA-N	360.369	3.966	50	40	FHGB	
CCOc1ccc(Br)cc1/C=C(/C#N)C(=O)NC1CCCC1	409194570	PBAIWHDHCJMEPN-LCYFTJDESA-N	363.255	3.814	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccc(F)cc1	1021386	MHKAHTWYVZFBFC-RGVLZGJSSA-N	353.309	3.758	50	40	FHGB	
N#CC1=C(N)Oc2oc3ccccc3c(=O)c2[C@H]1c1cccc(Cl)c1	1073565	BWULDWUFYWIJML-HNNXBMFYSA-N	350.761	3.665	50	40	FHGB	
CC[C@H](C)Oc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1OC	4544643	LMVOLFGGGBYNQW-ZXCVBSDHSA-N	369.396	3.647	50	40	FHGB	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)c1	5793758	USFMGSGLQBAQLQ-UHFFFAOYSA-N	374.440	3.810	50	40	FHGB	
O=C(NN=C1CCCCC1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	20933877	RQLQBFYXIOEWHU-UHFFFAOYSA-N	359.433	3.984	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2)c(C)c1	211256828	FTVPQWCMLZKQMK-RGEXLXHISA-N	361.445	3.686	50	40	FHGB	
CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1OC	408748051	XRSOADVBMCZVJR-SXGWCWSVSA-N	370.836	3.971	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)ccc1OCC#N	408805893	IBOWLRBYHBANQS-VTYXAESKSA-N	367.449	3.590	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCC2)cc1)C(=O)NCCCc1ccccc1	409229029	IPMFREKMWZIDIV-FXBPSFAMSA-N	359.473	3.943	50	40	FHGB	
CNC(=O)/C(C#N)=C/c1cn(CCOc2ccc(F)cc2)c2ccccc12	872779	QWHDKIBBECTRSG-NTCAYCPXSA-N	363.392	3.512	50	40	FHGB	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccccc1Cl	7649846	UPIVOKVPRLOZGY-ZDUSSCGKSA-N	368.820	3.722	50	40	FHGB	
O=C(N/N=C\c1cn(Cc2ccccc2)c2ccccc12)c1ccncc1	33343673	MWRQHPQDTWMPLQ-OYKKKHCWSA-N	354.413	3.849	50	40	FHGB	
O=C(N/N=C/C(Cl)=C\c1ccccc1)c1nnc(-c2ccccc2)o1	63423440	LBUPGQDVPISGFE-KFURHSOJSA-N	352.781	3.732	50	40	FHGB	
C[C@H]1CC(C)(C)N(C)c2ccc(/C=N\NC(=O)c3ccccc3O)cc21	208201956	YYUSXMIUGKSDNY-CRRPLPBISA-N	351.450	3.878	50	40	FHGB	
N#CC(Nc1ccc(N2CCCCC2)cc1)=C1C(=O)c2ccccc2C1=O	959634	SBJCBEJHQSXXOY-UHFFFAOYSA-N	357.413	3.946	50	40	FHGB	
CCCCCC[C@H]1/C(=N\NC(=O)Cc2ccccc2)CC[C@@H]1C(=O)OC	5184949	KQXIKFNFOVCXOR-GRWJUENRSA-N	358.482	3.871	50	40	FHGB	
CCOC(=O)COc1ccc(/C=C(/C#N)c2nc3ccc(C)cc3[nH]2)cc1	33666335	KDSWSGFHINJFIX-WJDWOHSUSA-N	361.401	3.877	50	40	FHGB	
Cc1ccc(/C(=N\NC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1	66326070	LBYPITTZUPRCDO-XSFVSMFZSA-N	351.284	3.600	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(Cl)c2)cc1C(=O)O	83318443	ALCDXTUATRRQKI-GHXNOFRVSA-N	356.765	3.592	50	40	FHGB	
CCN1c2ccc(/C=N/NC(=O)c3ccccn3)cc2[C@@H](C)CC1(C)C	223528729	RKIWQZCZBVUXNX-FVQJWRHTSA-N	350.466	3.958	50	40	FHGB	
COc1ccc(/C(C#N)=C/c2ccc(OCC(=O)O)c(Cl)c2)cc1OC	408583353	TXUITZAYVNABOW-VGOFMYFVSA-N	373.792	3.885	50	40	FHGB	
Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C\c1c(F)cccc1Cl	5611781	VHYZSZPAJKWNQD-SCDVKCJHSA-N	365.195	3.853	50	40	FHGB	
Cc1ccccc1OCC(=O)N/N=C/C(Br)=C/c1ccccc1	6999228	AIXMFBYQWKMHKT-ULQIOQDBSA-N	373.250	3.912	50	40	FHGB	
CC[C@@H](C)Oc1c(Cl)cc(/C=C(\C#N)C(=O)OCCOC)cc1OC	9973301	IIBGKHWTGHRLJX-ZBQKXELDSA-N	367.829	3.622	50	40	FHGB	
N#C/C(=C\c1cccc(OCc2ccccc2F)c1)C(=O)N1CCCC1	47080770	IJFODDURFKHVFX-LDADJPATSA-N	350.393	3.934	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CSCc2cc(C)cc(C)c2)cc1OC	59473079	CNBGCTVUFIZVPU-SRZZPIQSSA-N	372.490	3.704	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@H]2[C@@H]3CCCC[C@@]32C)cc1Br	4544912	KBHIRKVXQIODMK-IQOOGUQXSA-N	365.271	3.734	50	40	FHGB	
C/C(=N/NC(=O)CC1(C)SCCS1)c1ccc(Br)cc1	12362176	RRIMYTMEWXKJEG-YBEGLDIGSA-N	373.341	3.876	50	40	FHGB	
CN1CC2=C(OC(N)=C(C#N)[C@H]2c2cccs2)/C(=C\c2cccs2)C1	20813250	HICPRZRMTPGVDW-SAYIFAPPSA-N	367.499	3.900	50	40	FHGB	
C[C@@H](NC(=O)c1cccc(NC(=O)CBr)c1)c1ccccc1	35605437	OAEKEUFRGKJOEB-GFCCVEGCSA-N	361.239	3.511	50	40	FHGB	
Cc1ccc(-c2n[nH]c3c2[C@H](c2ccc(N(C)C)cc2)C(C#N)=C(N)O3)cc1	985584	AKVGQFWVWIASKQ-GOSISDBHSA-N	371.444	3.669	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C/C=C/c2ccc(Br)cc2)cc1	3102676	YNSWISQBYLDRBN-FGHRRNBQSA-N	373.250	3.952	50	40	FHGB	
Cc1c(C(=O)O)cccc1-c1ccc(/C=C(\C#N)C(=O)NC2CCCC2)o1	4723186	VQYWFLGVOJSQEN-SDNWHVSQSA-N	364.401	3.919	50	40	FHGB	
Cc1c(C(=O)NNC(=O)[C@H]2C[C@H]2c2ccccc2Cl)oc2ccccc12	8727964	VGGARVOSCHHKSS-GJZGRUSLSA-N	368.820	3.959	50	40	FHGB	
N#Cc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(F)cc3)o2)c(F)c1	408966393	LIIWXCLHBKRIFZ-FOKLQQMPSA-N	351.312	3.860	50	40	FHGB	
O=C(NNC(=S)Nc1cccc(C(F)(F)F)c1)c1ccccc1Cl	8691941	DUNLTDLRKRNYCT-UHFFFAOYSA-N	373.787	3.990	50	40	FHGB	
CCC(=O)N/N=C/C1=C(N2CCOCC2)/C(=C/c2ccc(Cl)cc2)CC1	84718241	XVKRQDKLNORDDT-JCIZPVLLSA-N	373.884	3.616	50	40	FHGB	
N#C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nn2c(-c3ccccc3)nnc2s1	33700867	PHCBRSZCBHXWMX-GXDHUFHOSA-N	374.385	3.825	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/C=C/c1ccccc1)c1ccco1	6337503	HGCDKZOZEYLDDL-AJDSVQIQSA-N	359.385	3.961	50	40	FHGB	
Cc1onc(-c2ccccc2Cl)c1C(=O)NNC(=O)c1ccc(F)cc1	888138	WQQVYWDBDRCOEY-UHFFFAOYSA-N	373.771	3.517	50	40	FHGB	
O=C(N/N=C/c1cc(Cl)cc(Br)c1O)c1ccccc1	4784708	XAPVUCXKFVECGO-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
COc1ccc2c(c1)c(C(=O)N/N=C/c1ccc(Cl)cc1)c(C)n2C	2232821	ICHVQFCBGVXEKY-SRZZPIQSSA-N	355.825	3.913	50	40	FHGB	
C/C(=N\NC(=O)COc1ccc(-c2ccccc2)cc1)c1ccccc1O	12289723	LNTFOEOWDGNQEL-XQNSMLJCSA-N	360.413	3.978	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=C(\C#N)C(=O)Nn1c(C)ccc1C	409380578	NVXGBZKZQYSIOL-XMHGGMMESA-N	369.424	3.947	50	40	FHGB	
Cc1cc(/C=N\NC(=O)COc2ccc(Cl)cc2)ccc1N1CCCC1	408846306	MPPVNXQMZNCOKY-XKZIYDEJSA-N	371.868	3.778	50	40	FHGB	
O=C(N/N=C\c1cccc(OC(=O)c2ccccc2)c1)c1ccc(F)cc1	30822030	NAGAVUBHNFFFGJ-UCQKPKSFSA-N	362.360	3.809	50	40	FHGB	
CC(C)(C)c1ccc([C@H]2C[C@H]2C(=O)N/N=C\c2ccc(O)c(O)c2)cc1	30738466	YSMQCTMMMJDQNV-MPRKLJSHSA-N	352.434	3.649	50	40	FHGB	
COc1ccccc1/C=N/NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1	8237253	OVSMDNZYBVJPMQ-VCHYOVAHSA-N	355.375	3.582	50	40	FHGB	
O=C(N/N=C/c1c(Cl)nc2sccn12)c1ccc(C(F)(F)F)cc1	2557646	CMXHPFTWLPTILK-FBCYGCLPSA-N	372.759	3.832	50	40	FHGB	
CC(C)Oc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(=O)oc1ccccc21	663568	MFVYQEAPUQYMMS-GOSISDBHSA-N	374.396	3.798	50	40	FHGB	
O=C(N/N=C/c1ccc2c(c1)OCO2)C(c1ccccc1)c1ccccc1	704435	KUBVMOSTXCYNNJ-OEAKJJBVSA-N	358.397	3.698	50	40	FHGB	
O=C(N/N=C/c1ccccc1O)c1cc2cc(Br)ccc2o1	2741806	SAWNGNVIBFTRQT-GIJQJNRQSA-N	359.179	3.665	50	40	FHGB	
O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1cccc(Cl)c1	3088967	SJOJCNHCSQDRLW-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
CCOc1cc(/C=C(/C#N)c2cccc([N+](=O)[O-])c2)cc([N+](=O)[O-])c1O	6595505	NJLZSGFYSAZIEY-MLPAPPSSSA-N	355.306	3.671	50	40	FHGB	
CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\c1ccc(-c2ccccc2Cl)o1	16741513	SEMNNQYOSXKHMR-ZROIWOOFSA-N	352.777	3.822	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)c2c[nH]c3ccc(OC)cc23)c(OC)c1	40139909	FEWFXJCIPPDMII-RIYZIHGNSA-N	362.385	3.984	50	40	FHGB	
N#CCOc1ccc(/C=N/NC(=O)CCSc2ccc(Cl)cc2)cc1	59472800	GZJGIEURQAMWJS-FYJGNVAPSA-N	373.865	3.875	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)c(Cl)c2)cc(OC)c1O	96476420	PGUREDQPODGQJF-MLPAPPSSSA-N	372.808	3.917	50	40	FHGB	
O=P(C(=S)N[C@H]1C[C@H]2C=C[C@H]1C2)(c1ccccc1)c1ccccc1	100013620	FGUUHJBPQVYOOT-BXWFABGCSA-N	353.427	3.840	50	40	FHGB	
Cc1n[nH]c2c1[C@H](c1ccc(F)c(Oc3ccccc3)c1)C(C#N)=C(N)O2	804046	LPAFRQAQWKXFMT-GOSISDBHSA-N	362.364	3.868	50	40	FHGB	
CCc1ccccc1OCC(=O)N/N=C/c1ccc(Br)cc1	3152574	SEDRGIGXLZAOJG-YBFXNURJSA-N	361.239	3.541	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@H]2[C@H]3CCCC[C@@]23C)cc1Br	4544911	KBHIRKVXQIODMK-PMQHQLPZSA-N	365.271	3.734	50	40	FHGB	
Cc1cc(N2CCCC2)c(F)cc1/C=C(/C#N)C(=O)NCc1ccccc1	107826275	YWUSSGGBJAZZPG-UNOMPAQXSA-N	363.436	3.958	50	40	FHGB	
N#C/C(=C/c1ccc(Br)cc1)C(=O)Nc1cccc(C(=O)O)c1	408545188	ZRROGYXUUMKFQI-JYRVWZFOSA-N	371.190	3.693	50	40	FHGB	
CCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	408924865	PBLABHKIWCPCES-GXDHUFHOSA-N	367.361	3.548	50	40	FHGB	
COc1cccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2Cl)c1	2746074	VCFSSYAVCRWJRG-CIAFOILYSA-N	368.824	3.607	50	40	FHGB	
C/C(CC(=O)Nc1ccc(C)c(C)c1)=N\NC(=O)COc1ccc(C)cc1	4690686	RTFIOOOAFXGREI-HAVVHWLPSA-N	367.449	3.512	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)[C@@H](C)SCc2ccccc2)c(O)c1	20248342	ICKBGJQBRCMTBH-NWGMWSOJSA-N	370.474	3.729	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2ccc(N(C)C)c(Br)c2)cc1	408867062	JBDXFHNZHIQQCA-YBFXNURJSA-N	360.255	3.587	50	40	FHGB	
O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(Cl)cc1	20248528	HWYNICOQUHIRQJ-GIJQJNRQSA-N	363.826	3.632	50	40	FHGB	
COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)c1cccc([N+](=O)[O-])c1	6627382	BQSUDOOQVAEAPR-MLPAPPSSSA-N	355.306	3.584	50	40	FHGB	
CCOc1ccc(/C=C(C#N)/C(O)=N/c2nnc(CC)s2)cc1OC	17016904	RHODJWWMNPZYSK-XYOKQWHBSA-N	358.423	3.703	50	40	FHGB	
N#C/C(=C\c1c[nH]nc1-c1ccccc1F)C(=O)Nc1ccccc1F	95410223	IJBSNLGKRKGGRU-FMIVXFBMSA-N	350.328	3.901	50	40	FHGB	
FC(F)(Br)C(F)(F)[C@@H](Br)CBr	95676951	CUYGTVOLVMBWLF-REOHCLBHSA-N	366.772	3.768	50	40	FHGB	
CC(=O)Nc1cccc(C(=O)N/N=C/c2cc(C)n(-c3ccccc3)c2C)c1	107943257	FUQXZTPRWAJIEW-OEAKJJBVSA-N	374.444	3.816	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)c2ccc3ccccc3c2)cc1[N+](=O)[O-]	408598521	CGFXFKJURNLNNS-FYJGNVAPSA-N	363.373	3.911	50	40	FHGB	
Cc1c(/C=N/NC(=O)Nc2ccccc2)c(Cl)nn1-c1ccccc1	408894561	RERXSAMFTQQQLH-UDWIEESQSA-N	353.813	3.990	50	40	FHGB	
C[C@@H]1C[C@H]2[C@@H]3CC/C(=C(/O)C=O)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12	1570003326	XYGYYRSXRDASPZ-UDJWKBCESA-N	356.462	3.522	50	40	FHGB	
O=C(N/N=C/c1cc(Br)ccc1O)c1ccccc1Cl	723607	ZBQGQODXTZYKLE-CAOOACKPSA-N	353.603	3.572	50	40	FHGB	
COc1cc(OC)c(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)c(OC)c1	1095575	WOHVVGDWTQACII-KPKJPENVSA-N	372.808	3.911	50	40	FHGB	
COc1ccc(Cl)cc1/C=N/NC(=O)c1cccc(Br)c1	2796140	FFSSKYQNJHDEFW-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
N#CC1=C(N)Oc2cc([N+](=O)[O-])ccc2[C@H]1c1c(O)ccc2ccccc12	5904546	INHSLGIAEHYIMM-GOSISDBHSA-N	359.341	3.672	50	40	FHGB	
N#C/C(=C\c1ccc(OC(=O)c2ccco2)cc1)C(=O)NCc1ccccc1	59133449	IGXUUXDSFNZZFN-QGOAFFKASA-N	372.380	3.722	50	40	FHGB	
CCCO[C@@](C)(CC)C(=O)Nc1ccc(OCCBr)cc1	225729870	DSQLPYHFIKLILT-INIZCTEOSA-N	358.276	3.994	50	40	FHGB	
O=[P@]1(N(CCCl)CCCl)NCC23C[C@@H]4CC(C[C@H](C4)C2)[C@H]3O1	301054430	KQPFNDFZAYNYAJ-ZHWIEXDJSA-N	367.257	3.689	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/C=C/c2ccc([N+](=O)[O-])cc2)ccc1Cl	5540368	RBNDCIFNKIHROY-VXCFCLNRSA-N	373.796	3.751	50	40	FHGB	
O=C(N/N=C/c1cc(Br)c(Br)o1)c1ccccc1	4784684	HDLNVEHECQVMLC-VIZOYTHASA-N	372.016	3.569	50	40	FHGB	
N#C/C(=C/c1ccc(F)c(F)c1)c1nc(N)nc(Nc2ccccc2)n1	96931668	URMWGOKCCQBVRR-WQLSENKSSA-N	350.332	3.540	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(OCC(C)C)c(Br)c1	408600710	FHOJRUFXZSDHFX-QPEQYQDCSA-N	352.228	3.954	50	40	FHGB	
COc1ccc2cc(/C=N/NC(=O)c3ccc(F)cc3)c(Cl)nc2c1	408831683	RSYQWYLZWHXYLY-UFFVCSGVSA-N	357.772	3.800	50	40	FHGB	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H](C)c2ccccc2)c1C	78267772	YBIUABXOMXQMQO-SMEDBKPVSA-N	351.450	3.536	50	40	FHGB	
CCCCCc1ccc(OCC(=O)N/N=C/c2cc(OC)ccc2O)cc1	2148037	RXAKCNITJFHFAE-HYARGMPZSA-N	370.449	3.663	50	40	FHGB	
CCC[C@H](C)CC(CCBr)(C(=O)OCC)C(=O)OCC	2035443	ISNOAFJMQNMZLU-LBPRGKRZSA-N	351.281	3.710	50	40	FHGB	
CC[C@@]1(C)Cc2c(sc(NC(=O)[C@H](C)Br)c2C#N)CO1	4311720	TXVLOHFDOKENJV-RTHLEPHNSA-N	357.273	3.583	50	40	FHGB	
CC(C)(C)c1cc(C(=O)N/N=C/c2cccs2)n(-c2ccccc2)n1	9384644	GGLLGKVBIXBVHG-DEDYPNTBSA-N	352.463	3.995	50	40	FHGB	
O=C(CC(=O)Nc1ccc(Cl)c(Cl)c1)N/N=C/c1ccc(F)cc1	1437786	FXHILVDPWAIRFO-AWQFTUOYSA-N	368.195	3.611	50	40	FHGB	
N#CC1=C2SCN(C3CCCC3)CN2C(=O)C[C@@H]1c1ccc(F)cc1	20347999	UNBVKIRRLVMAQK-MRXNPFEDSA-N	357.454	3.783	50	40	FHGB	
COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1cccc(Cl)c1	844046	RWLUJSXBSRGJFT-UHFFFAOYSA-N	367.792	3.797	50	40	FHGB	
O=C(CCSc1ccc(Cl)cc1)NNC(=O)c1cccc(Cl)c1	2646051	LZEXEPBRMMAVEP-UHFFFAOYSA-N	369.273	3.937	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2cc3ccccc3cc2OC)ccc1O	6892298	BPOGUUQNBNZSMR-LPYMAVHISA-N	364.401	3.717	50	40	FHGB	
COc1cc(C)c(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1C(C)C	59147179	NFUKCJLPUDLSMY-RGVLZGJSSA-N	355.394	3.799	50	40	FHGB	
N#C/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	4953647	YEPYSKNXZBUURR-IZZDOVSWSA-N	372.724	3.702	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)c1c[nH]c2ccccc12	17523250	BKOSLOYWQQONJV-UHFFFAOYSA-N	351.450	3.535	50	40	FHGB	
NC(=O)c1ccc(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)s1	69740364	JSAZEHTZDGQEBU-UHFFFAOYSA-N	364.641	3.564	50	40	FHGB	
COc1ccc(C(=O)Oc2c(Cl)cc(C(=O)Cl)cc2OC)cc1	218718738	MSPWMJSMYRLMSU-UHFFFAOYSA-N	355.173	3.955	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccccc1Cl	3254359	GNUXVEQEFFLALO-OQLLNIDSSA-N	356.809	3.710	50	40	FHGB	
O=C(N/N=C/c1csc(-c2ccc(Cl)cc2)n1)c1cccc(O)c1	7785925	VBIAKZBBXSRULT-DJKKODMXSA-N	357.822	3.933	50	40	FHGB	
Cc1ccc(N(Cc2cc(=O)[nH]c3ccccc23)C(=O)CCl)c(C)c1	9158992	KKFWZWWDMXIUDR-UHFFFAOYSA-N	354.837	3.917	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1occc1-c1ccccc1	12742198	JYSWDLWCFFSRFN-UHFFFAOYSA-N	354.793	3.604	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NC2CCCC2)cc1OCC	33721664	JNKUOCWACCRYJY-GDNBJRDFSA-N	372.852	3.716	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccc2O)c(C)n1-c1ccc(F)cc1	58928325	FRUMOPSZSVGZBT-WSDLNYQXSA-N	351.381	3.703	50	40	FHGB	
COc1cccc(/C=C2/C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)c1OC	103856952	LPCUQAJMJFKJEM-ZSOIEALJSA-N	358.401	3.712	50	40	FHGB	
CCCOc1cccc(/C=N\NC(=O)c2ccc(OC)c(OCC)c2)c1	409312972	APOUVYOYMFJRCC-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccccc2)ccc1OC(=O)c1ccccc1	3193523	GGPJWXKQMTXDAA-HZHRSRAPSA-N	374.396	3.678	50	40	FHGB	
Cc1ccc(C(=O)N/N=C\c2c(C)nn(-c3ccccc3)c2O)c(Cl)c1	4473963	IHKUONXJDVRFOC-NHDPSOOVSA-N	368.824	3.612	50	40	FHGB	
N#C/C(=C\c1ccc2c(c1)OCO2)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	5769922	WPQANACRZXWVNA-VZUCSPMQSA-N	371.736	3.523	50	40	FHGB	
O=C(CSCc1ccccc1)NNC(=O)CC12CC3CC(CC(C3)C1)C2	5788114	YLKVIZDHRHVOGN-UHFFFAOYSA-N	372.534	3.674	50	40	FHGB	
COc1ccccc1/C=C(\C#N)c1nc2sc3c(c2c(=O)[nH]1)CCCC3	5826993	UFGQRJOBJSQCAR-JLHYYAGUSA-N	363.442	3.936	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccc(F)cc2)o1)c1cccc([N+](=O)[O-])c1	43776071	QFNTZWDAJGPVFF-RGVLZGJSSA-N	353.309	3.758	50	40	FHGB	
N#CC1=C(NC(=O)c2cc3ccccc3oc2=O)S[C@H]2CCCC[C@@H]12	100026345	WDMRXEGZHCJKGY-LRDDRELGSA-N	352.415	3.564	50	40	FHGB	
Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)n1	408978222	LKMBCUISZPAIAH-XNTDXEJSSA-N	362.345	3.916	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2cccc(Cl)c2Cl)cc1OC	4735407	LMRCGZCKCIVGOE-KEBDBYFISA-N	367.232	3.703	50	40	FHGB	
O=C(N/N=C/c1ccc(Cl)cc1Cl)c1cc(=O)[nH]c2ccccc12	15906443	HUULUBGKMRNIHP-AWQFTUOYSA-N	360.200	3.599	50	40	FHGB	
Cc1ccc(S[C@H](C)C(=O)N/N=C/c2ccc(OCC#N)cc2)cc1	409141199	JAXWWCSKZSMUFU-NWGMWSOJSA-N	353.447	3.528	50	40	FHGB	
CN(C)c1ccc(/C=N/NC(=O)COc2ccc(-c3ccccc3)cc2)cc1	3202329	KNLRBPCANSHNIY-LFVJCYFKSA-N	373.456	3.949	50	40	FHGB	
COc1cc([C@@H]2C(C#N)=C(C)NC3=C2C(=O)CC(C)(C)C3)cc(OC)c1O	3297654	POTVRDCWQZDICL-GOSISDBHSA-N	368.433	3.537	50	40	FHGB	
Cc1ccc2c(c1)C(=O)[C@H](Br)[C@@H](C)N2C(=O)c1ccccc1	4592927	IBOKEPCJSUHPMN-MLGOLLRUSA-N	358.235	3.990	50	40	FHGB	
CCOC(=O)COc1ccc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)cc1	6954970	QFIRYWXTQYJTEU-WJDWOHSUSA-N	352.346	3.601	50	40	FHGB	
O=C(NNC(=O)c1cc(-c2cccs2)nc2ccccc12)c1ccco1	8355254	MQJVVMLKPRMALX-UHFFFAOYSA-N	363.398	3.631	50	40	FHGB	
CC(=O)Nc1ccc(C2=NN(C(=O)CCl)[C@H](c3cccs3)C2)cc1	23175942	JEYVOXWFEXRISB-HNNXBMFYSA-N	361.854	3.623	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)cc1	409361819	PZNBDUDENUMJJU-FYJGNVAPSA-N	363.373	3.856	50	40	FHGB	
CC(C)Oc1ccc(-c2cc(C(=O)N/N=C/c3cccs3)[nH]n2)cc1	1836577	PTNHTTDXTCOXOG-YBFXNURJSA-N	354.435	3.689	50	40	FHGB	
Cc1ccc(C)c(Sc2ncccc2C(=O)NNC(=O)c2ccco2)c1	12770723	IJGVVYIFBIQBSC-UHFFFAOYSA-N	367.430	3.517	50	40	FHGB	
O=C(NNC1=C(C(=O)C(F)(F)F)CCCCC1)c1ccccc1Cl	59488998	ANJUUHJQYIJMKN-UHFFFAOYSA-N	360.763	3.924	50	40	FHGB	
CC(=O)N/N=C/c1c(Br)c(C)n(-c2ccc(C)cc2C)c1C	20243815	JBUBRDURFGJPAY-DJKKODMXSA-N	362.271	3.943	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@H]1C[C@@H]1c1ccccc1	84525433	RWLQMNWECRZJKB-MKHYBWHDSA-N	352.478	3.544	50	40	FHGB	
COC(=O)N/N=C/c1ccc(OCCCOc2ccccc2Cl)cc1	41108643	PKZCBXWOLVIVFY-DEDYPNTBSA-N	362.813	3.878	50	40	FHGB	
COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccc(Cl)cc1Cl	107655776	XFPOZWCGVJWEBC-QGMBQPNBSA-N	368.176	3.674	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2OC)cc1OC	5475789	IETABXYXTUHVPE-RGVLZGJSSA-N	362.813	3.520	50	40	FHGB	
COc1ccc(Cl)cc1/C=N\NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1	408907848	PGLAJOYATHCRPN-OCKHKDLRSA-N	373.752	3.767	50	40	FHGB	
N#C/C(=C/c1cccc(Cl)c1)C(=O)N1CCN(c2ccccc2)CC1	255353679	QMIBFDCXZYLMLR-LGMDPLHJSA-N	351.837	3.596	50	40	FHGB	
COC(=O)[C@@H](c1ccccc1)[C@@](CBr)(OC)c1ccccc1	1593547	MRFSAIICLWMCNZ-AEFFLSMTSA-N	363.251	3.880	50	40	FHGB	
N#CC1=C(SCCOc2ccccc2)NC(=O)C[C@@H]1c1ccccc1	6496150	CMOZDOWCTXPEIO-QGZVFWFLSA-N	350.443	3.837	50	40	FHGB	
COc1ccc(OC)c([C@@H]2[C@H]3C[C@@H](C)CC=C3C(C#N)=C(N)C2(C#N)C#N)c1	4631522	NRWDKGSHVNWVQS-RISOHXOYSA-N	374.444	3.543	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C/c2cc([N+](=O)[O-])ccc2N(C)C)c1C	408995411	CLHKXSDVWDXGNE-MHWRWJLKSA-N	364.405	3.823	50	40	FHGB	
Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)c2ccccc2F)o1	408960029	IEGUDWAGZUHFGH-SSDVNMTOSA-N	366.348	3.856	50	40	FHGB	
COCCCNC(=O)/C(C#N)=C/c1ccc(OCc2cccc(C)c2)cc1	408804967	HUKYJNTXYISAFH-XSFVSMFZSA-N	364.445	3.634	50	40	FHGB	
COC(=O)c1cccc(-c2ccc(/C=N\NC(=O)c3cccc(C)c3)o2)c1	408878449	AVHJNGLPIATEOY-XKZIYDEJSA-N	362.385	3.806	50	40	FHGB	
N#C/C(=C/c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Br)cc1	408743563	GSQVTLCNACMAIB-XFXZXTDPSA-N	372.178	3.903	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2)c(OC)c1OC	211796217	NSRAIAXAUPRGPE-RAXLEYEMSA-N	372.808	3.911	50	40	FHGB	
C=C1C(C)(C)[C@@H]2CC[C@]1(C(=O)NNC(=O)[C@]13CC[C@@H](C1)C(C)(C)C3=C)C2	136530997	HFZJKRKZPFNURH-WGKKAQPQSA-N	356.510	3.899	50	40	FHGB	
COC(=O)c1c(C)[nH]c(C(=O)/C(C#N)=C\c2ccc(OC(F)F)cc2)c1C	35080039	OLLQRBOOSAWEJK-JYRVWZFOSA-N	374.343	3.809	50	40	FHGB	
COc1cc(/C=C(\C#N)c2n[nH]c(N)c2C#N)ccc1OCc1ccccc1	4067321	KDVDSKCHXYKOLV-CXUHLZMHSA-N	371.400	3.515	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)Nc2ccc(OC)cc2)cc(OCC)c1O	408859514	UVLOHZYQCHTGOR-BKUYFWCQSA-N	369.421	3.684	50	40	FHGB	
COc1cc(/C=C(/C#N)c2nc3cc(C)ccc3[nH]2)cc([N+](=O)[O-])c1O	44506009	MEMKDJAGJLJEOO-SDQBBNPISA-N	350.334	3.558	50	40	FHGB	
Cc1ccn2c(C(=O)N/N=C/c3ccccc3C(F)(F)F)c(C)nc2c1	5634985	SMJGRMYWYKREBE-LSHDLFTRSA-N	360.339	3.734	50	40	FHGB	
COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1cccc2ccccc12	5526573	HLTHMVITMYKKET-LPYMAVHISA-N	364.401	3.630	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)cc1)c1ccc(Br)o1	993983	VTEFGTYURIUYDU-VIZOYTHASA-N	372.016	3.569	50	40	FHGB	
COc1cc2cc(C(=O)N/N=C/c3ccccc3Cl)[nH]c2cc1OC	2421732	PINWTGHQADQQHS-KEBDBYFISA-N	357.797	3.602	50	40	FHGB	
O=C(N/N=C/C1=Cc2cc(Cl)cc(Cl)c2OC1)c1ccc(O)cc1	36843708	BIVLXOMYPWLAHX-DNTJNYDQSA-N	363.200	3.891	50	40	FHGB	
COc1ccc2[nH]cc(C(=O)/C(C#N)=C\c3cccc(OC)c3OC)c2c1	48366742	NBXCMUYIASUIKB-ZROIWOOFSA-N	362.385	3.984	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c(C)c1C	58927883	PZZHRDNOPHXZGD-KEBDBYFISA-N	371.462	3.904	50	40	FHGB	
CCCCCCC[C@H](O)CCC(=O)N/N=C/c1ccc(OC)c(OC)c1	98001316	IWLBZWFKZXUSCU-LBSLPOPVSA-N	364.486	3.656	50	40	FHGB	
N#CC1=C(NC(=O)c2cc3ccccc3oc2=O)S[C@@H]2CCCC[C@@H]12	100026348	WDMRXEGZHCJKGY-BLLLJJGKSA-N	352.415	3.564	50	40	FHGB	
O=C(CSCc1ccccc1)N/N=C/c1ccc(N2CCCCC2)o1	408996283	LTTNFKCMUKLMTF-DEDYPNTBSA-N	357.479	3.653	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2ccc(O)c(Cl)c2)cc1OCC	409334413	LIZBPNOVKHIBPM-MTJSOVHGSA-N	374.824	3.773	50	40	FHGB	
N#CC1=C(N)Oc2n[nH]c(-c3ccccc3)c2[C@@H]1c1ccc(F)cc1F	6720051	LIMXAXJRTJBFSS-OAHLLOKOSA-N	350.328	3.573	50	40	FHGB	
N#C/C(=C\Nc1ccc(C(N)=O)cc1)c1nc(-c2cccs2)cs1	17170196	OWWJLPMHVLSBBA-FMIVXFBMSA-N	352.444	3.947	50	40	FHGB	
CCc1ccccc1NC(=O)/C(C#N)=C\c1ccc(OCC#N)c(OC)c1	10130265	CECCBVYDUAGANF-ATVHPVEESA-N	361.401	3.706	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2O)c(Cl)c1	6199214	IHKUONXJDVRFOC-SRZZPIQSSA-N	368.824	3.612	50	40	FHGB	
CCCNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1	5951864	YONNYTPVODWQDL-JXAWBTAJSA-N	356.429	3.972	50	40	FHGB	
CCOc1cc2c(cc1/C=N\NC(=O)c1ccc3ccccc3c1)OCO2	409097369	GLWQBTISLOVPRZ-UUYOSTAYSA-N	362.385	3.731	50	40	FHGB	
CCOc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1ccc(C)cc1	409004733	BPYDGQDIBNMAEZ-UHFFFAOYSA-N	361.401	3.842	50	40	FHGB	
CC(=O)Nc1sc(NNC(=O)c2ccccc2)nc1-c1ccccc1	35681841	DDHLFJZYIAMGIM-UHFFFAOYSA-N	352.419	3.525	50	40	FHGB	
N#CC1=C2SCN(Cc3ccccc3)CN2C(=O)C[C@@H]1c1ccccc1	20517477	VVFMQWOKWDJISL-GOSISDBHSA-N	361.470	3.902	50	40	FHGB	
C/C(=N/NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl)c1ccccn1	694909	KYGKCUYZMPIVIZ-BPXUPMHTSA-N	352.221	3.696	50	40	FHGB	
CCC(=O)N1c2ccc(-c3csc(NC(=O)CCl)n3)cc2C[C@H]1C	1366591	NUAQKIOUWQXANE-SNVBAGLBSA-N	363.870	3.675	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccc(C)cc1	59334428	PQYHYTOHBWBBKZ-UNOMPAQXSA-N	364.445	3.968	50	40	FHGB	
Cc1c(C(=O)NNc2ccccc2C(F)(F)F)oc2c1C(=O)CCC2	45080384	DCJXXCIEJXUKPP-UHFFFAOYSA-N	352.312	3.883	50	40	FHGB	
COC(=O)[C@@]12CC[C@@H](C1)C(C)(C)[C@]2(Br)CBr	4041434	XXGJBUQJCZYXKR-XXILOJSOSA-N	354.082	3.514	50	40	FHGB	biogenic
COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccccc2)sc2c1CCC2	1768667	MACTZTWKPKNQNN-JLHYYAGUSA-N	352.415	3.569	50	40	FHGB	
COc1cccc(/C=C2\C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)c1OC	20291815	LPCUQAJMJFKJEM-RIYZIHGNSA-N	358.401	3.712	50	40	FHGB	
CN(C(=O)[C@@]12CC[C@](C)(C(=O)[C@H]1Br)C2(C)C)c1ccccc1	100868176	FTAAUGWQDXBZLU-FSPWUOQZSA-N	364.283	3.808	50	40	FHGB	
Cc1cc(-c2ccc(/C=N/NC(=O)c3cccnc3)o2)c(C)c([N+](=O)[O-])c1	809065	QINLYMQCGOPUQQ-SRZZPIQSSA-N	364.361	3.631	50	40	FHGB	
COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2ccc(=O)c2c(C)oc(C)c32)cc1	807679	MEWLYERVPBCGNT-FQEVSTJZSA-N	374.396	3.637	50	40	FHGB	
COc1ccc(C(=O)N/N=C2\CCCc3ccccc32)cc1Br	904146	GSIIGJVWEKPXOA-CAPFRKAQSA-N	373.250	3.928	50	40	FHGB	
COc1ccccc1NC(=S)NNC(=O)c1ccc(C(C)(C)C)cc1	4663371	MBZQJFLAIZAKNW-UHFFFAOYSA-N	357.479	3.624	50	40	FHGB	
CCCCCC[C@H]1/C(=N\NC(=O)Cc2ccccc2)CC[C@H]1C(=O)OC	5184935	KQXIKFNFOVCXOR-ODMRFGQBSA-N	358.482	3.871	50	40	FHGB	
O=C(NNC(=O)N1CCc2ccccc21)c1sc2ccccc2c1Cl	9517070	CQAHLGYMLQXVQY-UHFFFAOYSA-N	371.849	3.972	50	40	FHGB	
Cc1ccc(C)c(OCC(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1C	12844031	SLLKPMPFSAFTOB-ODCIPOBUSA-N	374.824	3.523	50	40	FHGB	
Cc1ccc(OCC(=O)N/N=C\c2cc(Br)cs2)c(C)c1	18173287	IILIHEZXWYSBLH-IDUWFGFVSA-N	367.268	3.657	50	40	FHGB	
Cc1cccc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c1	23230850	RPCNAXLTAFMKSU-KPSZGOFPSA-N	357.628	3.696	50	40	FHGB	
Cc1cc2c(cc1/C=N/NC(=O)c1cccnc1)[C@@H](C)CC(C)(C)N2C	208214773	UWUPSYXUWWTZLI-LUILSVGHSA-N	350.466	3.876	50	40	FHGB	
COc1ccc(/C(C)=N\NC(=O)COc2c(C)cc(C)cc2C)cc1OC	408948688	DCMGOTJOOGPTQM-JWGURIENSA-N	370.449	3.548	50	40	FHGB	
N#CC1=C2SCN(c3ccccc3)CN2C(=O)C[C@@H]1c1cccs1	2346829	MQCAXPORVOCTBZ-AWEZNQCLSA-N	353.472	3.968	50	40	FHGB	aggregator
CCOC(=O)Cn1cc(/C=C(/C#N)c2ccc3c(c2)OCO3)c2ccccc21	409362196	IFDXWBFWZYBAGU-SXGWCWSVSA-N	374.396	3.997	50	40	FHGB	
NNC(=O)c1cc(-c2ccc(Oc3ccccc3)cc2)n(-c2ccccc2)n1	59472524	WGHDLSAPMMUYBM-UHFFFAOYSA-N	370.412	3.935	50	40	FHGB	
COc1ccc(-c2ccc(/C=N\NC(=O)Cc3cccn3C)o2)cc1Cl	71335832	ZYBPDEBFYXHSBX-MTJSOVHGSA-N	371.824	3.640	50	40	FHGB	
CCOc1c(Cl)cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc1OC	408791579	YZAWIIBKIDWXPB-MDWZMJQESA-N	372.808	3.999	50	40	FHGB	
COc1ccc(O)c(/C=N/NC(=O)C(c2ccccc2)c2ccccc2)c1	1434271	OGOHBNULJKFSNQ-HZHRSRAPSA-N	360.413	3.683	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc(Cl)c([N+](=O)[O-])c1	705800	UYMOXCHMLNMVAS-HNNXBMFYSA-N	373.796	3.699	50	40	FHGB	
CC1(C)CC(=O)C(CI)(Cc2ccccc2)C(=O)C1	3172051	ZMTHGYDERDLQAY-UHFFFAOYSA-N	370.230	3.609	50	40	FHGB	
CC(C)COc1ccc(C(=O)NNC(=O)/C=C/c2ccccc2Cl)cc1	6879598	IRWDHMTYTHYDDJ-FMIVXFBMSA-N	372.852	3.849	50	40	FHGB	
N#C/C(=C\c1cccc(OCCOc2ccccc2)c1)C(=O)N1CCCC1	409371669	JKFSOONUEQHXBX-XDJHFCHBSA-N	362.429	3.674	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2C)cc1OCC	216043725	ICBCMPXISCTKLB-HMAPJEAMSA-N	354.450	3.794	50	40	FHGB	
CCCn1nc(C)c(Cl)c1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	253401035	MIPRCIREECCKPR-AWEZNQCLSA-N	374.872	3.706	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cccc(Br)c2)o1)c1ccncc1	830878	IOXDPFWZJQHTGF-RGVLZGJSSA-N	370.206	3.868	50	40	FHGB	
CCCOc1ccc(/C=C(\C#N)C(=O)Oc2ccc(C(=O)OC)cc2)cc1	1903525	UUBNUMMZQWXONW-GHRIWEEISA-N	365.385	3.775	50	40	FHGB	
O=C(NN=C(c1ccccc1)c1ccccc1)c1cc(=O)c2ccccc2o1	10129933	WUTXNQZZLLGIPU-UHFFFAOYSA-N	368.392	3.975	50	40	FHGB	
C[C@@H]1CCC/C(=N\NC(=O)c2ccc(C(=O)N/N=C3\CCC[C@@H](C)C3)o2)C1	6249945	PDXPWQNXVXYGHX-RYPSAWBKSA-N	372.469	3.871	50	40	FHGB	
Cc1c(C(=O)NNC(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)oc2ccccc12	8727958	VGGARVOSCHHKSS-HUUCEWRRSA-N	368.820	3.959	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccc2)c(C)n1-c1ccc([N+](=O)[O-])cc1	408997629	HNGCYDHLINQUDO-FYJGNVAPSA-N	362.389	3.766	50	40	FHGB	
IC[C@H]1CCCC[C@H]1CI	82133025	UYOGTWIDMSRPJU-OCAPTIKFSA-N	364.008	3.663	50	40	FHGB	
O=C(Cc1ccc(Br)c2ccccc12)N/N=C/c1ccco1	1444187	IBDAMTIMCWBBDO-YBFXNURJSA-N	357.207	3.888	50	40	FHGB	
CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(-c3ccccc3C#N)o2)cc1	6562971	JJJXSYHBWKBGQV-YDZHTSKRSA-N	372.384	3.541	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2ccccc2)cc1)[C@@H]1COc2ccccc2O1	3282739	YHNXJFHGGAEPOA-VSIOZEBNSA-N	358.397	3.644	50	40	FHGB	
CCc1ccc(OCC(=O)N/N=C/c2ccc(C(F)(F)F)cc2)cc1	6543719	DECPOQIKLDDHOX-SSDVNMTOSA-N	350.340	3.797	50	40	FHGB	
CCOc1ccc2oc(C(=O)N/N=C\c3cccc(OC)c3OC)cc2c1	409186715	GXMIAGHOXIJTID-MTJSOVHGSA-N	368.389	3.613	50	40	FHGB	
CCC[C@H](Br)C(=O)NCCC(=O)Nc1ccccc1C(C)C	15423172	SMGSFUOYWRRHNX-AWEZNQCLSA-N	369.303	3.818	50	40	FHGB	
CCOC(=O)/C(C#N)=C/C=C(\Sc1nncn1C)c1ccc(Cl)cc1	16682020	YRBMSRPMXNGWPX-OELJXHARSA-N	374.853	3.615	50	40	FHGB	
CCCCCCC(/C=C/c1ccc(Cl)c(Cl)c1)=N\NC(=O)C(N)=O	17109932	KNMKBQAECHDPAT-WXYKTORPSA-N	370.280	3.935	50	40	FHGB	
CC(C)(C)c1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccnc4)c32)cc1	4163101	FCYOZHMHWVFJRT-KRWDZBQOSA-N	371.444	3.987	50	40	FHGB	
CC1(C)[C@]2(C(=O)NC3CCCCC3)CC[C@@]1(C)C(=O)[C@H]2Br	13541067	VKMWSCRLAWWBDN-OAUYIBNBSA-N	356.304	3.594	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)Nc2cnn(C)c2)c(C)n1C1CCCCC1	25309231	VTZJHLVLOFUJSX-LICLKQGHSA-N	351.454	3.889	50	40	FHGB	
CCOC(=O)c1csc(NC(=O)CCCC[C@H]2CCSS2)n1	96115699	VHEVAEXUONJSSB-JTQLQIEISA-N	360.526	3.972	50	40	FHGB	biogenic
C/C(CC(=O)Nc1cccc(C(F)(F)F)c1)=N\NC(=O)c1cccs1	100510215	GPXBGYGYRITUMQ-UFFVCSGVSA-N	369.368	3.901	50	40	FHGB	
N#C/C(C(=O)CSc1nncs1)=C1/Nc2cc(Cl)ccc2S1	102818733	XXPGAKFRWNCKOR-XYOKQWHBSA-N	366.880	3.806	50	40	FHGB	
N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3/C[C@H]4C=CC[C@@H]34)cc2)cc1	138388573	HXGHNTSONLLCSQ-YBLSXXKVSA-N	357.413	3.672	50	40	FHGB	
Cc1ccccc1OCC(=O)NNC(=O)c1sc2ccccc2c1Cl	672406	UKKQDOMCUHSGNV-UHFFFAOYSA-N	374.849	3.703	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2ccco2)cc1OCc1ccccc1	1250022	KIQMEQQCBMVALT-FYJGNVAPSA-N	350.374	3.631	50	40	FHGB	
COc1ccc(-n2cccc2/C=C(\C#N)C(=O)NCc2ccccc2)cc1	2726902	YGNUNQODBZXPEM-NBVRZTHBSA-N	357.413	3.709	50	40	FHGB	
O=C(COc1cccc(Br)c1)N/N=C/c1ccc(Cl)s1	4680100	MAZXKDBQHPULRZ-FRKPEAEDSA-N	373.659	3.693	50	40	FHGB	
CCOC(=O)C1=C(C)OC(n2cccc2)=C(C#N)[C@H]1c1ccc(F)cc1	4744773	AOEIYMJUMUWBEP-GOSISDBHSA-N	352.365	3.970	50	40	FHGB	
CCOC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccccc3)o2)cc1	4814087	OFOYJZBGYJPMGU-HYARGMPZSA-N	362.385	3.887	50	40	FHGB	
O=N[C@H]1[C@@H](Cl)[C@@H]2C[C@H]1[C@H]1C[C@H](Br)[C@H](Br)[C@H]21	4934504	GKAXFKDNWWJFFR-QPALZHRCSA-N	357.473	3.542	50	40	FHGB	
Cc1ccc(C(=O)N/N=C\c2c(C)nn(-c3ccccc3)c2Cl)cc1	4950776	UYELZUDQVMJDNL-MTJSOVHGSA-N	352.825	3.906	50	40	FHGB	
Cc1cc(/C=C(\C#N)c2nc(N)nc(N(C)C)n2)c(C)n1C1CCCCC1	11298307	DOPFKJCFUPVKIX-LFIBNONCSA-N	365.485	3.508	50	40	FHGB	
O=C(CNc1ccc(Br)cc1)N/N=C/C=C/c1ccccc1	59369580	DXXKCVSNDZNGIJ-LIJKSJPWSA-N	358.239	3.676	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc1	59483765	CRRIDRCUGWUCDL-HYARGMPZSA-N	367.449	3.688	50	40	FHGB	
Cc1ccc([C@@H](NC(=O)N2C[C@H](C)O[C@@H](C)C2)C(Cl)Cl)cc1F	169344393	HVZZCOGLJCDBBM-COPLHBTASA-N	363.260	3.798	50	40	FHGB	
NNC(=O)c1ccc(CCc2ccccc2)n1Cc1ccc(Cl)cc1	226029094	CBCORUDFDQBMJN-UHFFFAOYSA-N	353.853	3.579	50	40	FHGB	
Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)[C@@H](O)c2ccccc2)c1C	408585993	ACRYRICTTJQJQS-VSIOZEBNSA-N	361.445	3.586	50	40	FHGB	
COc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1Br	3034085	KZSURZPLUMUTKR-XDHOZWIPSA-N	361.239	3.541	50	40	FHGB	
CCOc1cc2c(cc1C[C@@H](Br)CBr)OCO2	2048607	IVXMVUCZBLZXJQ-SECBINFHSA-N	366.049	3.515	50	40	FHGB	
COc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)C)cc2)cc1Cl	59515451	UHZDGYKFQZBNAD-SRZZPIQSSA-N	373.840	3.561	50	40	FHGB	
COc1ccc(CSCC(=O)N/N=C/c2ccc(SC)cc2)cc1	58915574	LTBNOUCRTCHJFC-YBFXNURJSA-N	360.504	3.801	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@H]1c1ccccc1C	2697889	XVUSKEOVADWTMJ-GOSISDBHSA-N	360.413	3.777	50	40	FHGB	
CCc1ccc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(-c4cccc(OC)c4)c32)cc1	5163544	KPFIWUGXXDJNSO-GOSISDBHSA-N	372.428	3.866	50	40	FHGB	
C/C(=N\NC(=O)COc1cccc(C)c1)c1ccc(Br)s1	5418874	NSDYAHBZDNSLGE-GZTJUZNOSA-N	367.268	3.738	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)COc2ccccc2C(C)(C)C)cc1	4724413	OSFQZQJNUZUKDH-PXLXIMEGSA-N	354.450	3.912	50	40	FHGB	
CS(=O)(=O)c1cccc(C(=O)NN(c2ccccc2)c2ccccc2)c1	14862491	HCWWFCZBBLEBCH-UHFFFAOYSA-N	366.442	3.573	50	40	FHGB	
N#C/C(=C/c1c[nH]nc1-c1ccc(F)cc1)C(=O)Nc1ccccc1F	17072659	SMAZPRFWLXGYOM-LCYFTJDESA-N	350.328	3.901	50	40	FHGB	
CCOP(=S)(OCC)Oc1[nH]s/c(=N/c2ccccc2)c1C#N	2567057	ZNQGDSZTQLXDJB-JQIJEIRASA-N	369.408	3.857	50	40	FHGB	
CO[P@@](O)(=S)Oc1cc(Cl)c(Br)cc1Cl	1851872	SWZHPVYVLAUYFW-CQSZACIVSA-N	351.973	3.998	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)c2ccc(Cl)cc2Cl)c1	5357969	BZNRVVJVMLJGDJ-DJKKODMXSA-N	353.205	3.775	50	40	FHGB	
Br[C@@H]1CSc2n(c3ccccc3[n+]2Cc2ccccc2)C1	4868303	VPCCNKQDDMJXRN-AWEZNQCLSA-N	360.300	3.846	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc1	4735258	LZAIACIPLDFZQI-XDHOZWIPSA-N	361.239	3.541	50	40	FHGB	
CCc1ccc(CC(=O)N/N=C/c2cc(OC)c(OC)cc2Cl)cc1	409366059	XTGGYOYHIYVQJH-CIAFOILYSA-N	360.841	3.612	50	40	FHGB	
O=C1S[C@H](Nc2cccc3ccccc23)C(=O)N1CCBr	36626556	AVHHXOCVNMDBQO-ZDUSSCGKSA-N	365.252	3.668	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(C[C@H](C)CC2)[C@H]1c1ccccc1	230101644	AQSFJZCHQMDSTI-WTGRHJARSA-N	361.445	3.710	50	40	FHGB	
CCOc1ccc(CCCC(=O)N/N=C/c2ccc(C)c(OC)c2)cc1	5872958	YRHFRJZEUZPXFC-PXLXIMEGSA-N	354.450	3.875	50	40	FHGB	
CCc1ccc(OC(C)(C)C(=O)N/N=C(\C)c2cccc([N+](=O)[O-])c2)cc1	6646007	XMZHJFIWCIQKIX-KGENOOAVSA-N	369.421	3.855	50	40	FHGB	
O=C(NNC(=O)c1cc2ccccc2cc1O)Nc1cccc(Cl)c1	945095	XEFUQXWRZAGKNQ-UHFFFAOYSA-N	355.781	3.665	50	40	FHGB	
C/C(=N\NC(=O)CNc1ccccc1C)c1ccc(Br)cc1	1052561	XBIIWHXCFYOGKD-DEDYPNTBSA-N	360.255	3.710	50	40	FHGB	
Cc1ccc(CN2C(=O)/C(=N\OC(=O)CCCCl)c3ccccc32)cc1	3064099	SYFBUIYNCFEVIR-QOCHGBHMSA-N	370.836	3.808	50	40	FHGB	
Cc1ccc([C@@H]2C[C@@H]2C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	8685692	KYMUYZDKPNXNDH-HOTGVXAUSA-N	359.882	3.770	50	40	FHGB	
C/C(=N\NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1ccncc1	9218331	FFPGUVYTKVWSEE-OEAKJJBVSA-N	350.397	3.782	50	40	FHGB	
COc1cc(/C=N\NC(=O)c2cc3ccccc3o2)cc(Cl)c1OC	408854933	BIXIVVXHOMOHMS-JMIUGGIZSA-N	358.781	3.867	50	40	FHGB	
C=CCc1cc(/C=N/NC(C)=O)cc(OC)c1OCc1cccc(C)c1	409009138	BQICXOBFFASZJJ-LPYMAVHISA-N	352.434	3.781	50	40	FHGB	
N#C/C(=C/C=C/c1ccccc1[N+](=O)[O-])C(=O)NCCCc1ccccc1	409236493	SHCKJMBHJIDHNW-OFZGEPSZSA-N	361.401	3.807	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)c(OCC)c1	409369837	ZRPWOOJOEQXTEH-FYJGNVAPSA-N	360.841	3.830	50	40	FHGB	
O=C(NN=C1CCCCC1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	58885736	MXGSYTBGYFFLSA-UHFFFAOYSA-N	361.751	3.734	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cc2)cc(OC)c1OC	2708461	SMWXPXAIVAERMM-MDWZMJQESA-N	372.808	3.911	50	40	FHGB	
Cc1cccc(-n2c(C)cc(/C=N/NC(=O)[C@H](O)c3ccccc3)c2C)c1	408589930	NMRHXNGGHXSJSA-KURUZVKSSA-N	361.445	3.586	50	40	FHGB	
COc1cc(Cl)c(/C=N/NC(=O)Cc2cc(C)ccc2C)cc1OC	409365316	QNNBNTJHMYMPEP-SRZZPIQSSA-N	360.841	3.667	50	40	FHGB	
CC(C)CCn1nc(C(=O)NN=C2CCCCCC2)c2ccccc2c1=O	8491986	NHZIYSLMJGEOPB-UHFFFAOYSA-N	368.481	3.883	50	40	FHGB	
Cc1nn(-c2ccccc2)c(C)c1/C=N\NC(=O)c1cccc(Cl)c1	33333493	LBUUSPCWPDKSKZ-MTJSOVHGSA-N	352.825	3.906	50	40	FHGB	
COc1ccc(CCN2C(=O)C=C3CCC[C@H](Br)[C@@]32C)cc1	226086990	ZXNVVGRSMYIBME-FUHWJXTLSA-N	364.283	3.712	50	40	FHGB	
COc1cc(/C=C(\C#N)c2cc(OC)c3c(c2)OCO3)cc(OC)c1OC	66091622	IPLKCSHESAUCOE-LHHJGKSTSA-N	369.373	3.514	50	40	FHGB	
COc1ccc(CC(=O)N/N=C(\C)c2ccc(Br)cc2)cc1	5381563	GFUDLSAWAQEQDG-XDHOZWIPSA-N	361.239	3.541	50	40	FHGB	
CC(=O)Nc1ccc(/C=N/NC(=O)c2cc3cc(C)ccc3nc2C)cc1	685564	SRFFUVICEHZQRK-WSDLNYQXSA-N	360.417	3.574	50	40	FHGB	
COc1ccccc1OCCOc1ccc(C=C(C#N)C#N)cc1OC	4670385	KITCMNQYILWUSP-UHFFFAOYSA-N	350.374	3.592	50	40	FHGB	
Cc1cc(C(=O)N/N=C/c2ccc(C(=O)O)cc2)c(C)n1-c1ccccc1	6286468	SYGFJTSCHMGAGV-LPYMAVHISA-N	361.401	3.556	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc(C)c2C)ccc1OCC#N	7164395	BOPIKYWRVKGFAG-GZTJUZNOSA-N	361.401	3.760	50	40	FHGB	
O=P(C(=S)N[C@@H]1C[C@@H]2C=C[C@@H]1C2)(c1ccccc1)c1ccccc1	169809252	FGUUHJBPQVYOOT-GPMSIDNRSA-N	353.427	3.840	50	40	FHGB	
COc1cc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc(Cl)c1O	409051273	JZUQUOVDYXUQSI-UFWORHAWSA-N	353.205	3.780	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)cc1[N+](=O)[O-]	409113214	HCNRJCHBRWLIMO-MDBUFAAASA-N	373.434	3.543	50	40	FHGB	
C/C(=N\NC(=O)c1ccccc1OCCOc1ccccc1)c1ccco1	5020447	IEZRETVBZWYQPW-CJLVFECKSA-N	364.401	3.891	50	40	FHGB	
COc1ccc(OCC(=O)N/N=C(\C)c2cccc(C(F)(F)F)c2)cc1	5504486	SPYVCBHBTFKQLA-WSDLNYQXSA-N	366.339	3.633	50	40	FHGB	
O=C(Nc1ccccc1C(=O)N/N=C/c1ccc(F)cc1)c1cccs1	5771550	XLDWQXLQMBLUHN-CIAFOILYSA-N	367.405	3.903	50	40	FHGB	
CCOc1ccc(C(=O)N/N=C/c2ccc(OC(C)C)c(OC)c2)cc1	5906914	QIJHEJWOTAUMPT-FYJGNVAPSA-N	356.422	3.645	50	40	FHGB	
N#CC1=C(SCCOc2ccccc2)NC(=O)C[C@H]1c1ccccc1	6496097	CMOZDOWCTXPEIO-KRWDZBQOSA-N	350.443	3.837	50	40	FHGB	
O=C(COc1ccc(-c2ccccc2)cc1)N/N=C\c1ccc(C(=O)O)cc1	30840557	JLCCAVQXVPZDRQ-UCQKPKSFSA-N	374.396	3.581	50	40	FHGB	
COc1ccc(-n2cccc2/C=C(/C#N)C(=O)NCc2ccccc2)cc1	33624541	YGNUNQODBZXPEM-JXAWBTAJSA-N	357.413	3.709	50	40	FHGB	
O=C(CCn1c2ccccc2c2ccccc21)N/N=C\c1ccc(O)cc1O	40217051	ZVMZEBJIZFLTQE-UCQKPKSFSA-N	373.412	3.746	50	40	FHGB	
CN(C)C(=O)/C(C#N)=C\c1cn(Cc2ccc([N+](=O)[O-])cc2)c2ccccc12	59334562	ILFGEWLNIQBTQU-WJDWOHSUSA-N	374.400	3.593	50	40	FHGB	
COc1ccc(-c2nc3ccc(NC(=O)CSC#N)cc3o2)cc1OC	226328185	XOUKAWFRETZPRE-UHFFFAOYSA-N	369.402	3.665	50	40	FHGB	
C[C@]12CC[C@@H]3[C@@H](CC[C@H]4CCCC[C@@]43C)[C@@H]1CC/C2=N\NC(=O)C(=O)O	253497812	CTISYMLRZAHCNS-URJNBGGGSA-N	360.498	3.976	50	40	FHGB	
O=[N+]([O-])c1cc([C](O)CBr)ccc1OCc1ccccc1	1560406225	MUDMKZIAXRXIBL-UHFFFAOYSA-N	351.176	3.821	50	40	FHGB	
N#C/C(=C/c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)NC1CC1	2759217	UGVBIQADBUFNNS-LGMDPLHJSA-N	354.413	3.725	50	40	FHGB	
C=CCc1cc(/C=N/NC(=O)c2cccc(Cl)c2)cc(OCC)c1O	59679153	FXZGIMJJISLEKN-CIAFOILYSA-N	358.825	3.937	50	40	FHGB	
COc1ccc(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)c(OC)c1	59515939	RBNUXANICHANMF-JLPGSUDCSA-N	374.440	3.986	50	40	FHGB	
C=CCSC1=C(C#N)[C@@H](c2cccc([N+](=O)[O-])c2)C(C(C)=O)=C(C)N1	4473260	NCFQRTPYPMFYEF-QGZVFWFLSA-N	355.419	3.799	50	40	FHGB	
O=C(N/N=C/c1ccc(N2CCCC2)c(F)c1)c1cc2ccccc2o1	4674756	MYFBNYGOKYGCIB-LPYMAVHISA-N	351.381	3.936	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc(OC)c1OC	409074834	SJCHLZBGBXREPK-LFIBNONCSA-N	364.401	3.684	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)c2ccccc2C(F)(F)F)ccc1OC	408770720	BEWYNFGWDUQTAF-JJFYIABZSA-N	366.339	3.877	50	40	FHGB	
CCCCn1nc(C)c(NC(=O)c2cccc(NC(=O)CCl)c2)c1C	14405456	UQPLSRXIFDFGTK-UHFFFAOYSA-N	362.861	3.730	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cc(Cl)ccc2OC)ccc1O	408812490	NAARCWMIQXRFMO-KPKJPENVSA-N	358.781	3.608	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)cc2C)cc1	408733771	QGALMBQVXJWDMK-HYARGMPZSA-N	367.449	3.571	50	40	FHGB	
C#CCn1cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)c2ccccc21	408677609	SNOPJDPSLWZWRJ-LFVJCYFKSA-N	370.456	3.639	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1Cc1cccc(F)c1	408869822	UIHQOEKRQGLINS-MKMNVTDBSA-N	358.800	3.861	50	40	FHGB	
Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)[C@H](O)c2ccccc2)c1C	408585992	ACRYRICTTJQJQS-KURUZVKSSA-N	361.445	3.586	50	40	FHGB	
O=C(N/N=C\c1ccc2c(ccn2Cc2cccc(F)c2)c1)c1ccccn1	409237794	JMYFRBLGCDNYJJ-QFEZKATASA-N	372.403	3.988	50	40	FHGB	
O=C(COc1cccc(Cl)c1)N/N=C\c1ccc(Br)s1	33246545	NNVBOJUOJVYYOF-APSNUPSMSA-N	373.659	3.693	50	40	FHGB	
C[C@H](Br)C(Br)(Br)CBr	59796744	KAMLVOUBGNUKHA-VKHMYHEASA-N	373.708	3.651	50	40	FHGB	
CCOc1ccc(NCC(=O)N/N=C\c2c(O)ccc3ccccc23)cc1	38534584	JWRJGCUSLSJMMD-QRVIBDJDSA-N	363.417	3.506	50	40	FHGB	
COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)c1	989062	ZDZVKBAFFONOIJ-FQEVSTJZSA-N	372.428	3.716	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(F)c(F)c1)C(C#N)=C(N)O2	968901	AIVSLNGPGJYHMR-SFHVURJKSA-N	364.355	3.677	50	40	FHGB	
CCC(=O)Nc1ccc(C(=O)N/N=C/c2cccc(Br)c2)cc1	1421667	MYALDFKCVUCPIA-YBFXNURJSA-N	374.238	3.562	50	40	FHGB	
I[C@@H]1c2ccccc2[C@H]1I	100433054	NDFPAKDLGIXZHH-HTQZYQBOSA-N	355.944	3.652	50	40	FHGB	
N#CC1=C(SCc2ccccc2)NC(=O)C[C@@H]1c1ccc([N+](=O)[O-])cc1	12250100	GKTKSTONYYCIMD-MRXNPFEDSA-N	365.414	3.867	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc2c(c1Cl)OCO2	4676585	SQKXJOOCPSPXJK-CQSZACIVSA-N	372.808	3.520	50	40	FHGB	
COc1cc(N2CCCC2)ccc1/C=N/NC(=O)c1ccc(Cl)cc1	409189263	ODZLVYLCNNVFHO-FYJGNVAPSA-N	357.841	3.713	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C(\C)c2ccc(OC)c([N+](=O)[O-])c2)cc1	216064869	XYHQEJLMMAVLPU-DEDYPNTBSA-N	371.393	3.546	50	40	FHGB	
N#CC1=CN(c2ccc(C(F)(F)F)cc2)c2ccccc2S1(=O)=O	38487999	NNAKOJZFBMXRSR-UHFFFAOYSA-N	350.321	3.996	50	40	FHGB	
N#CC1=CN(c2ccc(Br)cc2)c2ccccc2S1(=O)=O	38487990	WFVLUVAHDDWPSA-UHFFFAOYSA-N	361.220	3.739	50	40	FHGB	
CCn1c(SCC(=O)N/N=C/C=C\c2ccco2)nc2ccccc21	12413816	PPHVBWSUSWHLMJ-PJOPPIIISA-N	354.435	3.557	50	40	FHGB	
Cc1n[nH]c2c1[C@@H](c1ccc(OCc3ccccc3)cc1)C(C#N)=C(N)O2	642379	KRMZFCRKDXGONU-IBGZPJMESA-N	358.401	3.515	50	40	FHGB	
C/C(=N\NC(=O)CSc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1	7993702	DQZACXKAAOUBTM-WOJGMQOQSA-N	363.826	3.881	50	40	FHGB	
CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccccc2)sc2c1CCC2	1768648	ZUIMQMMBCHEZFH-SDNWHVSQSA-N	366.442	3.959	50	40	FHGB	
N#C/C(=C/c1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(C(=O)O)c1	108128059	DGDCLAHQYVZTBW-QPEQYQDCSA-N	360.291	3.949	50	40	FHGB	
N#CC(C#N)=C(C#N)c1ccc(-c2ccc(N3CCOCC3)s2)s1	101002755	XEQVEAQENQXXRD-UHFFFAOYSA-N	352.444	3.638	50	40	FHGB	
CC(C)COc1ccccc1/C=N/NC(=O)COc1ccccc1Cl	408914318	NUTWHXXWYRRUAV-SRZZPIQSSA-N	360.841	3.904	50	40	FHGB	
CC[C@@H](C)NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C	36750423	LFBRYHWILFLTCE-CRRKTRLDSA-N	351.450	3.924	50	40	FHGB	
COCCCNC(=O)/C(C#N)=C/c1ccc(OCC(C)C)c2ccccc12	5006589	NVFDOYXZPSRGNP-QGOAFFKASA-N	366.461	3.934	50	40	FHGB	
CC(=O)Nc1ccc([C@H](O)P(=O)(c2ccccc2)c2ccccc2)cc1	2163365	KQZJVWFLFGVGJU-OAQYLSRUSA-N	365.369	3.650	50	40	FHGB	
N#CC1=C(N)Oc2c(oc(=O)c3ccccc23)[C@H]1c1ccc(Cl)cc1	4592815	IPYWNAQDCYFCQO-HNNXBMFYSA-N	350.761	3.665	50	40	FHGB	
CC(C)(C)C1=CC(=NNC(=O)c2ccccc2N)C=C(C(C)(C)C)C1=O	5408105	MFVGMYMYJBKKLR-UHFFFAOYSA-N	353.466	3.882	50	40	FHGB	
CC(C)C1=CC(=O)[C@@](C)(Cl)[C@H](Cl)/C1=N/S(=O)(=O)c1ccccc1	5522471	DWZUIUHHYJXENG-RSOPOUMMSA-N	374.289	3.586	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cc(OC)c(Cl)cc2OC)cc1	942029	NOANCTXOLXZLEG-MDWZMJQESA-N	372.808	3.911	50	40	FHGB	
Cc1ccc(S(=O)(=O)[C@@H](Br)CC(=O)c2ccccc2)cc1	2028294	SXPOELYKAYLQQL-MRXNPFEDSA-N	367.264	3.763	50	40	FHGB	
O=C(N/N=C/c1ccc(N2CCCC2)cc1)c1ccc(N2CCCC2)cc1	7385843	IEBCRNFZDGUANN-HAVVHWLPSA-N	362.477	3.651	50	40	FHGB	
CCOC(=O)[C@H]1C[C@H](Sc2ccccc2)[C@@H](Cl)C[C@H]1C(=O)OCC	15079827	AUTVLJMYUKTMEB-UGUYLWEFSA-N	370.898	3.907	50	40	FHGB	
CC(C)N1CCC(=NNC(=O)COc2ccccc2-c2ccccc2)CC1	55095196	JFKMMTCZJVEELP-UHFFFAOYSA-N	365.477	3.709	50	40	FHGB	
Cc1cc(C)cc(CSCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c1	59503562	YDCGAHGHVHSZKY-VXLYETTFSA-N	357.435	3.595	50	40	FHGB	
COc1ccc2ccccc2c1/C=N/NC(=O)COc1ccc(C)c(C)c1	5046971	YWVYAKSCJOCVNZ-YDZHTSKRSA-N	362.429	3.994	50	40	FHGB	
Cc1ccc(NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C)cc1C	8733233	MIOBJDJRWURXNN-OAHLLOKOSA-N	369.303	3.558	50	40	FHGB	
Cc1ccc(O)c(/C=N\NC(=O)COc2ccc(-c3ccccc3)cc2)c1	13943578	ISJDQLPRARREGJ-UCQKPKSFSA-N	360.413	3.897	50	40	FHGB	
Cc1cccc(OCC(=O)N/N=C\c2ccc(Br)cc2)c1C	30838729	BCVUKLJFXQDTLG-GRSHGNNSSA-N	361.239	3.595	50	40	FHGB	
Cc1cccc(-c2nc3cc(N4C[C@H](C(=O)Cl)CC4=O)ccc3o2)c1	57327045	CYRNBSWLDPWXJX-CYBMUJFWSA-N	354.793	3.922	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1Br	408740551	HAEQGLSEMWUZHO-DEDYPNTBSA-N	373.250	3.707	50	40	FHGB	
Cc1ccc(Sc2ccc(/C=C(/C#N)C(=O)N3CCOCC3)o2)cc1	408859676	YZOYGCUDFXOEFI-QINSGFPZSA-N	354.431	3.505	50	40	FHGB	
COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2c(C)cccc2Cl)cc1	408893774	HMQPVVCOWUKPNJ-XNTDXEJSSA-N	354.793	3.981	50	40	FHGB	
Cc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1cccc2ccccc12	409104602	JZLGBLFVTJKAIB-LFVJCYFKSA-N	373.456	3.749	50	40	FHGB	
CN(/N=C/c1cccc(OC2CSC2)c1)C(=O)OCc1ccccc1	409189344	JQAGMNGPKQGSSU-RGVLZGJSSA-N	356.447	3.783	50	40	FHGB	
Cc1ccc(-c2ccc(/C=C(\C#N)C(=O)N3CCCC3)o2)cc1[N+](=O)[O-]	409367600	BJHZITPLMMGPDH-XNTDXEJSSA-N	351.362	3.693	50	40	FHGB	
C[C@@H](CNC(=O)c1ccccc1)[C@](C)(Br)CBr	3124301	IGCDMOGIHHXANY-GXFFZTMASA-N	363.093	3.601	50	40	FHGB	
COC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1ccccc1OC(C)C	1453865	NNFUAHLLVIMRAZ-FOWTUZBSSA-N	364.401	3.806	50	40	FHGB	
COc1cc(/C=N/NC(=O)C2CC2)ccc1OCc1ccc(Cl)cc1	3261269	MWILUMXOLDPCRF-SRZZPIQSSA-N	358.825	3.788	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/[C@H](C)Cc2ccc3c(c2)OCO3)cc1	4507152	KYEZBROEXJBAGU-IKMPRTQCSA-N	368.433	3.799	50	40	FHGB	
CC/C(=N\NC(=O)Cc1ccc(C)cc1C)c1ccc(OC)cc1OC	20195384	NCVLPLSKYBOEKA-ZBJSNUHESA-N	354.450	3.794	50	40	FHGB	
CCc1c(OC)ccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)c1OC	408719545	STLFDRRJZSPXEH-HADWXUJASA-N	372.490	3.897	50	40	FHGB	
Cc1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)n(C2CCCC2)n1	253399748	JWTCCPYFWPZGPG-GOSISDBHSA-N	366.465	3.758	50	40	FHGB	
Cc1cc(SCC(=O)N/N=C/c2ccc(F)cc2)c2ccccc2n1	871060	HEEASENOYKFJIC-SRZZPIQSSA-N	353.422	3.925	50	40	FHGB	
N#CC(C#N)=Cc1cn(CC(=O)Nc2ccc([N+](=O)[O-])cc2)c2ccccc12	16525420	WFAXBOOQKOIVFV-UHFFFAOYSA-N	371.356	3.619	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C\c2ccccc2OCC)cc1OC	6324543	MLIYUOMXUQFBII-STZFKDTASA-N	356.422	3.647	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)c1cccnc1	809052	GKBCURWBEIKSPV-KEBDBYFISA-N	370.752	3.667	50	40	FHGB	
C/C(CC(=O)Nc1ccc(Cl)cc1)=N\NC(=O)COc1ccccc1C	4416380	UKQZKEZZVMBWKJ-HYARGMPZSA-N	373.840	3.548	50	40	FHGB	
C[C@@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3F)[C@@H]2C1	4730523	QBQKOQFOCNSULL-MZKGEVEHSA-N	350.372	3.804	50	40	FHGB	
N#C/C(=C\c1cc2c(cc1Br)OCO2)C(=O)c1ccccc1	7007322	QRPQQQMPCOFINI-AWNIVKPZSA-N	356.175	3.968	50	40	FHGB	
Cc1ccc(SCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)cc1	8515135	DLAIUQVGBAPICY-GIJQJNRQSA-N	363.826	3.799	50	40	FHGB	
O=C(N/N=C/c1ccco1)c1ccc(CN2CCc3ccccc3C2)cc1	20076149	SPHVFCZCSAXCSQ-OEAKJJBVSA-N	359.429	3.602	50	40	FHGB	
C=CCOc1cccc(/C=N/NC(=O)c2ccc(Br)cc2)c1	59471527	MKRQFKBWJRFCHJ-XDHOZWIPSA-N	359.223	3.778	50	40	FHGB	
COc1ccc(C(=O)[C@@H](Br)CBr)c(Cl)c1	308777455	AZVJMJVMBWCILD-QMMMGPOBSA-N	356.441	3.690	50	40	FHGB	
CNC(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2Br)c1C	408996590	IYFUZEDWYCMOQP-ZROIWOOFSA-N	358.239	3.510	50	40	FHGB	
CC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cccc(OCc2ccccc2)c1	705904	YLSJYUYCBKQQOK-OAQYLSRUSA-N	360.413	3.936	50	40	FHGB	
O=C(NNc1c(F)c(F)nc(F)c1F)Nc1ccccc1C(F)(F)F	3771019	MPKHTWAEUCYCAB-UHFFFAOYSA-N	368.212	3.805	50	40	FHGB	
O=C(NNc1ccccc1C(F)(F)F)c1cc(Cl)c2c(c1)OCO2	69831568	MENQWQZMDDZKAQ-UHFFFAOYSA-N	358.703	3.844	50	40	FHGB	
O=C(Cc1ccc(Cl)cc1Cl)NNC(=O)c1cccc(Cl)c1	3335531	BNPYVCLXYLYPDM-UHFFFAOYSA-N	357.624	3.651	50	40	FHGB	
O=C(NN(Cc1ccccc1)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1	4723602	MEHHTLPYKUFKMR-UHFFFAOYSA-N	361.401	3.942	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)Cc2ccc(Br)cc2)c1	9203668	FJNGCQLBLAEPHL-XDHOZWIPSA-N	361.239	3.541	50	40	FHGB	
Cc1cccc(NC(=O)NNC(=O)C(c2ccccc2)c2ccccc2)c1	9875922	CKZPXDYCVJMWRQ-UHFFFAOYSA-N	359.429	3.980	50	40	FHGB	
N#C/C(=C\c1ccc(Cl)s1)c1nc(N)nc(Nc2ccccc2)n1	12563522	MEJPZAWDTJTTJR-CSKARUKUSA-N	354.826	3.976	50	40	FHGB	
C/C(=N\NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl)c1ccncc1	13953969	MCCZOYYJMWRCOM-JZOCJUILSA-N	352.221	3.696	50	40	FHGB	
N#CCCn1cc(/C=C(/C#N)c2ccccn2)c(-c2ccc3c(c2)OCO3)n1	49573533	RGMATZAQOHGKBX-YBEGLDIGSA-N	369.384	3.652	50	40	FHGB	
O=C(N/N=C/c1ccc(-c2cccc(Br)c2)o1)c1ccccn1	830872	XRSVAQFUVUSXBX-RGVLZGJSSA-N	370.206	3.868	50	40	FHGB	
COc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1C	6202939	KWKGCXVEZXFRBD-VXLYETTFSA-N	369.402	3.890	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2cccc(C(F)(F)F)c2)cc1O	6209343	LGSBRCOVJGTNAN-KPKJPENVSA-N	362.307	3.965	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)Nc2sc3c(c2C#N)CCCC3)c(C)n1C	14152086	NMHTZIJRSLILQN-OQLLNIDSSA-N	364.474	4.000	50	40	FHGB	
COc1ccc(CC(=O)N/N=C\c2cccc(Cl)c2Cl)cc1OC	36144871	LMRCGZCKCIVGOE-JMIUGGIZSA-N	367.232	3.703	50	40	FHGB	
C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NN=C(CCl)CCl	100244361	FUHSULRNMXPOTE-ZETCQYMHSA-N	358.052	3.711	50	40	FHGB	
Cc1cc(C)c2c3c(c(=O)oc2c1C)[C@H](c1ccccc1)C(C#N)=C(N)O3	585181959	LEQIZQPHBMXVDN-QGZVFWFLSA-N	358.397	3.936	50	40	FHGB	
CCOc1cc(C(=O)N/N=C2/C[C@H]3C=CC[C@@H]23)cc(OCC)c1OCC	5463668	KVNSPZJFCLHDFD-JPCOMGPJSA-N	358.438	3.565	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1ccc(OCCOc2ccccc2)c(OC)c1	15011823	NREZBCDMGZIVEY-LGMDPLHJSA-N	367.401	3.623	50	40	FHGB	
Cc1cccc(COc2ccccc2[C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)c1	409136805	VPXSUJPCWUCXHR-FQEVSTJZSA-N	372.428	3.824	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1	20197497	FDRGZDZKQBAHLE-YBFXNURJSA-N	361.785	3.801	50	40	FHGB	
C=CCn1c(C)c(/C=N/NC(=O)c2ccc(OC)cc2O)c2ccccc21	409392256	OLLWTMSNWSICPZ-LPYMAVHISA-N	363.417	3.614	50	40	FHGB	
Cc1cccc(NC(=O)/C(C#N)=C\c2cc(Br)c(O)cc2O)c1	408746791	VUKBPPOMMKYRNQ-SDQBBNPISA-N	373.206	3.714	50	40	FHGB	
C[C@H]1C[C@H]2[C@@H]3CC/C(=C(/O)C=O)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12	96031457	XYGYYRSXRDASPZ-MAFKTLPYSA-N	356.462	3.522	50	40	FHGB	in-vitro
CCOc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccn2)cc1OCC	5130116	LDOXHTDIAVGFMD-CNRHGSOZSA-N	373.478	3.510	50	40	FHGB	
O=C(Cc1ccccc1)N/N=C/c1ccc(-c2ccc(F)cc2[N+](=O)[O-])o1	14134922	PLYMPOWZDBUJSX-CIAFOILYSA-N	367.336	3.687	50	40	FHGB	
O=C(N/N=C/c1c[nH]c2c1ccc1ccccc12)c1ccc([N+](=O)[O-])cc1	1502209	WAKOKNUHHYOSKS-WSDLNYQXSA-N	358.357	3.993	50	40	FHGB	
CCOC(=O)CN1C=CC=C/C1=C(/C#N)c1nc(-c2ccccc2)cs1	103699006	SNGXQKZJKONLLQ-FBMGVBCBSA-N	363.442	3.993	50	40	FHGB	
C[C@@H]1CCc2sc(C(=O)N/N=c3/c(=O)c4cccc5cccc3c54)cc2C1	3391011	XJPJMEWATKJXQO-AHGGLUHZSA-N	374.465	3.661	50	40	FHGB	
N#C/C(=C/c1ccsc1)S(=O)(=O)c1ccc(Br)cc1	96891619	HUDUFHMCCLWUAD-QPEQYQDCSA-N	354.250	3.849	50	40	FHGB	
C[C@@H]1Cc2cc(/C=N\NC(=O)c3ccc(Br)cc3)ccc2O1	408710883	UBLHJPVATUYIFA-XEQXHXIFSA-N	359.223	3.536	50	40	FHGB	
Cc1cccc(NC(=O)c2sc(NC(=O)CCl)c(C#N)c2C)c1C	871410	YYODLWRFCKWHJT-UHFFFAOYSA-N	361.854	3.975	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)C/C(C)=N/NC(=O)c1ccccc1C	4831904	AFYFQVAAJWGHHU-LPYMAVHISA-N	373.840	3.792	50	40	FHGB	
COc1ccccc1NC(=O)N/N=C\c1cc(F)c(N2CCCC2)cc1C	106373409	DMGBIJFLUQGTHM-XKZIYDEJSA-N	370.428	3.899	50	40	FHGB	
C/C(=N/NC(=O)c1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1	4314269	JXTAUBBHRUZSLZ-YVLHZVERSA-N	362.183	3.511	50	40	FHGB	
CCN1C(=O)/C(=C2/Sc3ccccc3N2C)S/C1=N\CCCl	4458425	DPJXISSVOPOXGI-NERFDCTISA-N	353.900	3.588	50	40	FHGB	
Cc1cc(/C=N\NC(=O)c2ccccc2)c(C)n1-c1ccc(C(=O)O)cc1	408993730	FGHLNQJCNPUSIQ-XKZIYDEJSA-N	361.401	3.556	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=C(/C#N)C(=O)NC2CCCCC2)cc1	33726528	FRXJILQMZQRSCR-ICFOKQHNSA-N	362.477	3.899	50	40	FHGB	
CCN(CC)c1ccc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)o1	39127078	FOYZNHTYCCDEAU-ODLFYWEKSA-N	370.365	3.544	50	40	FHGB	
C=CCOc1ccc(C(=O)N/N=C\c2cc(Cl)ccc2OC)cc1OC	8160080	WFAJFIKSDDGKJR-MTJSOVHGSA-N	374.824	3.686	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1	6222925	INEZZPSRUPZYQK-KGENOOAVSA-N	363.373	3.938	50	40	FHGB	
O=C(NNC(=O)C1c2ccccc2Oc2ccccc21)c1ccc(F)cc1	6790302	GDMARUOEZRZSIP-UHFFFAOYSA-N	362.360	3.525	50	40	FHGB	
CCOc1cc([N+](=O)[O-])cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)c1O	6958560	YPBBDLQNAVGIGI-QPEQYQDCSA-N	355.306	3.671	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)cc([N+](=O)[O-])c1O	36048058	UZSNUUZUIILPAJ-VZUCSPMQSA-N	373.752	3.508	50	40	FHGB	
N#C/C(C(=O)Nc1ccc(Cl)cc1)=C1/SCC(=O)N1c1ccccc1	2214150	RCFQQEUOPIZIKR-SDXDJHTJSA-N	369.833	3.794	50	40	FHGB	
Cc1ccc(SCC(=O)N/N=C/c2ccccc2Br)cc1	6233971	NXYJMZZINCIMHG-VCHYOVAHSA-N	363.280	4.000	50	40	FHGB	
Cc1cc(NC(=O)N/N=C\c2cc(C)n(C)c2C)ccc1Br	34828915	TVYLLCYGVZUJCK-NVMNQCDNSA-N	363.259	3.868	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1cc(Cl)c2cccnc2c1O	59459106	PJSPRYMFFQVUAE-WSDLNYQXSA-N	353.809	3.677	50	40	FHGB	
CCCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2C)[C@H](C#N)C(O)=N1	2310118	YONWMCQRGAWENO-WMLDXEAASA-N	369.446	3.610	50	40	FHGB	
C[C@]12CC[C@H]3[C@]1(C)CO[C@]3(P(c1ccccc1)c1ccccc1)C2=O	100746573	VVUKNXGGDLPMKO-WSWWRLHASA-N	350.398	3.851	50	40	FHGB	
C/C(CC(=O)Nc1cccc(C)c1C)=N\NC(=O)COc1ccc(C)cc1	4691215	KQCHATPTFYDBTA-XQNSMLJCSA-N	367.449	3.512	50	40	FHGB	
O=C(CCl)N1N=C(c2ccccc2)C[C@@H]1c1cccc2nccnc12	72314722	DGVUQOIRXYABFV-QGZVFWFLSA-N	350.809	3.546	50	40	FHGB	
C[C@@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	1092211	KLYKECGTRHWTAO-CNRHGSOZSA-N	362.389	3.699	50	40	FHGB	
CC(C)OC(=O)CSC1=C(C#N)[C@@H](c2ccc(C(C)C)cc2)CC(=O)N1	841888	QVYWXVWAQKYFMQ-MRXNPFEDSA-N	372.490	3.833	50	40	FHGB	
O=C(Cn1cnc2ccccc21)N/N=C/c1ccc(-c2ccccc2)cc1	7993317	UWMCBSKEAAPCTN-ZVHZXABRSA-N	354.413	3.854	50	40	FHGB	
O=C(COc1ccccc1)N/N=C\c1ccc(OCc2ccccc2)cc1	34835876	BLMHHXZFKXMLGI-HAHDFKILSA-N	360.413	3.795	50	40	FHGB	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)c(OC(C)C)c1	408806264	MINUVILBWDUBPR-XNTDXEJSSA-N	352.390	3.734	50	40	FHGB	
C=CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(OC)cc1	408812338	LOWVKQPHBGQGQB-FOWTUZBSSA-N	364.401	3.814	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	408826896	DLTRPQSXIHXVIN-VXLYETTFSA-N	361.785	3.799	50	40	FHGB	
C[C@]12CCCC[C@@H]1[C@@H]2C(=O)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1	408869865	ULOGQHROLVIHKQ-DKQIIYKESA-N	366.417	3.921	50	40	FHGB	
Cc1ccc(C(=O)Oc2ccccc2/C=N/NC(=O)c2ccccc2)cc1	408897238	RADGTVCIPIOFCF-HZHRSRAPSA-N	358.397	3.978	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C\c1cn(CC#N)c2ccccc12)c1ccccc1	409245801	ZGHRTHFBLCJQGA-OKSBFYSISA-N	354.413	3.949	50	40	FHGB	
Cc1cc(Cl)ccc1NC(=O)C(=O)N/N=C/c1ccc(C(C)C)cc1	3084110	UELSRFPVFRJUMS-SRZZPIQSSA-N	357.841	3.861	50	40	FHGB	
COc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1c(C)cc(C)cc1C	59305874	UTIGMKPPNPXRCH-RQZCQDPDSA-N	350.418	3.592	50	40	FHGB	
COc1ccc(CSCC(=O)N/N=C/c2ccc(OC(C)C)cc2)cc1	59473554	FVQHRCFKTIMCCD-CIAFOILYSA-N	372.490	3.866	50	40	FHGB	
CCN(CC)c1ccc(C(=O)N/N=C/C=C/c2ccccc2OC)cc1	3277657	KCOFHEGNVXCDIH-XZXXOLIVSA-N	351.450	3.970	50	40	FHGB	
CC(C)Cc1ccc(-c2n[nH]c3c2[C@@H](c2cccnc2)C(C#N)=C(N)O3)cc1	5130098	NQKDGPIQGRZZNH-SFHVURJKSA-N	371.444	3.888	50	40	FHGB	
CC(=O)N/N=C/c1cc(Cl)c(OCCOc2ccccc2)c(Cl)c1	4511037	ZETGKQCXJTXTQF-RGVLZGJSSA-N	367.232	3.921	50	40	FHGB	
N#C/C(=C\c1cc(Cl)c2c(c1)OCCCO2)c1nnc2n1CCCCC2	8220916	KRDHDYNTUJNHJR-NTEUORMPSA-N	370.840	3.883	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)ccc1OC	408970982	BWJDXTBTTXGFNG-CIAFOILYSA-N	368.389	3.613	50	40	FHGB	
Cc1ccc(COc2cccc(/C=N/NC(=O)[C@H](O)c3ccccc3)c2)cc1	409357780	RGYRHQQMPWKFLQ-VCOZGABYSA-N	374.440	3.758	50	40	FHGB	
O=C(N/N=C\c1ccc(Br)o1)c1ccccc1-n1cccc1	15930585	KLTUAJQMBCHZTD-WQRHYEAKSA-N	358.195	3.597	50	40	FHGB	
Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3ccccc3Cl)cc2)n1	6189226	RFRWKICAAWXZEI-WSDLNYQXSA-N	366.852	3.966	50	40	FHGB	
O=C(N/N=C/c1cccc(OCc2ccccc2)c1)c1ccc2c(c1)OCO2	2529644	QIBOUDCGFDMBCO-YDZHTSKRSA-N	374.396	3.758	50	40	FHGB	
O=C(NNC(=O)[C@H]1CC1(c1ccccc1)c1ccccc1)C1[C@H]2CCCC[C@@H]12	788157	AZKGMFBPXAUNBU-JQKXYWIWSA-N	374.484	3.576	50	40	FHGB	
O=C(Nc1ccc(C(=O)N/N=C/c2ccccc2)cc1)NC1CCCCC1	1085219	YUABRZYTQOSWHM-PXLXIMEGSA-N	364.449	3.905	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C/c2ccc(Br)s2)cc1	10475910	OTOMJNPVJDCBCP-LICLKQGHSA-N	367.268	3.602	50	40	FHGB	
C[C@H]1CCCC[C@@H]1NC(=O)/C(C#N)=C/c1ccc(O)c(Br)c1	23723804	LPBYOLKRVIVKAH-ZBTQSTBISA-N	363.255	3.757	50	40	FHGB	
O=C(N/N=C\c1cccc([N+](=O)[O-])c1)C1c2ccccc2Oc2ccccc21	30802670	ZTYOAKYQUFZNFC-XKZIYDEJSA-N	373.368	3.983	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OCc1ccccc1	40889266	PDOORAVBDWQVNC-WQRHYEAKSA-N	350.418	3.706	50	40	FHGB	
COc1ccccc1C(=O)N/N=C/c1cccn1-c1ccc(Cl)cc1	59302685	ZWQBZQNZDXBHFN-FYJGNVAPSA-N	353.809	3.903	50	40	FHGB	
C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)c1ccc(Cl)cc1	100522991	QJCQCRIVJYNPAB-LPYMAVHISA-N	372.856	3.541	50	40	FHGB	
CC(C)(C)OC(=O)N1CCC[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)O	198469445	WYLYLPVDJDSVHN-STQMWFEESA-N	359.539	3.861	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2cc(C)n(-c3ccccc3)c2C)cc1	408590547	POXFWAPHQKAGNP-HZHRSRAPSA-N	361.445	3.796	50	40	FHGB	
COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1cc2c(cc1Cl)OCO2	408800746	PCQCSBBBHVEHQA-AWNIVKPZSA-N	370.792	3.931	50	40	FHGB	
O=C(Cc1cccc2ccccc12)N/N=C/c1ccc(Br)o1	1435333	PTGNROSWNCKICX-YBFXNURJSA-N	357.207	3.888	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@@H]1CCCc2ccccc21	12852892	SFANKNJOWUCNOK-LZGZYFLISA-N	366.505	3.860	50	40	FHGB	
O=C(CNc1ccc(F)cc1)N/N=C/c1ccc(-c2ccc(F)cc2)o1	409357437	QHVNIDBJTMETJR-FOKLQQMPSA-N	355.344	3.787	50	40	FHGB	
CC(C)N(NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1	824852	ZLGKFFIDLZYQRR-UHFFFAOYSA-N	360.457	3.869	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)[C@H](C)Oc2cc(C)cc(C)c2)cc1OC	941959	RBMSJJQFZBQKRO-QPNANDPSSA-N	370.449	3.628	50	40	FHGB	
CCC[C@H](C(=O)OCC)/C(C)=N/NC(=O)c1cc2ccccc2cc1O	4394107	HQLOGLRAQAMGKL-REIAIGDLSA-N	356.422	3.631	50	40	FHGB	
Cc1ccc([C@H](Br)[C@H](Br)C(=O)[C@]2(C)CO2)cc1	4953579	PQHOXCGXAACSQA-GVXVVHGQSA-N	362.061	3.553	50	40	FHGB	
CC[C@H](C)Oc1c(Cl)cc(/C=N\NC(=O)c2ccco2)cc1OC	33693915	BMPODROIZPYWGB-ORPVNXHJSA-N	350.802	3.883	50	40	FHGB	
O=C(CNc1ccc(Br)cc1)N/N=C/c1ccccc1Cl	59369577	ZGQCMZGVWHXTBN-DJKKODMXSA-N	366.646	3.665	50	40	FHGB	
C[C@H](NC(=O)/C(C#N)=C\c1cccc(Br)n1)c1ccccc1	85475865	VFUAJMPDXIRPKO-GVIGZQTCSA-N	356.223	3.628	50	40	FHGB	in-vitro
CCCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)OCC)o2)cc1	252493137	MZXFIGJYXYQTHN-VBKFSLOCSA-N	353.374	3.983	50	40	FHGB	
CC1(C)C(C(=O)N/N=C2\C(=O)N(CCCCCF)c3ccccc32)C1(C)C	299817264	PRXCXNXDBMJFFC-KQWNVCNZSA-N	373.472	3.676	50	40	FHGB	in-vitro
COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)c1ccc([N+](=O)[O-])cc1	409210227	JESLGQQTFGKGMI-QPEQYQDCSA-N	355.306	3.584	50	40	FHGB	
CC(C)(C)c1n[nH]c2c1[C@H](c1cccc(C(F)(F)F)c1)C(C#N)=C(N)O2	806499	YKXVRSFKUWOUBA-GFCCVEGCSA-N	362.355	3.944	50	40	FHGB	
O=C(N/N=C/[C@@H]1C[C@H]2C=C[C@H]1C2)c1ccc(NC(=O)c2ccccc2)cc1	105670310	QSXLNIBBGZBRCI-JYSYNJAGSA-N	359.429	3.867	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)c2ccc3c(c2)OCO3)ccc1OC	44028850	IYUUDDJLOYNDJE-NVNXTCNLSA-N	351.358	3.612	50	40	FHGB	
CC(C)Oc1ccc(C(=O)NNC(=O)[C@@H](C)SCc2ccccc2)cc1	40142940	RVVNMWPTCHDITH-OAHLLOKOSA-N	372.490	3.557	50	40	FHGB	
CC1=C(C#N)[C@@H](c2cccc([N+](=O)[O-])c2)C(C(=O)OC(C)(C)C)=C(C)N1	68605253	ISIVNZCTFWPSEH-QGZVFWFLSA-N	355.394	3.695	50	40	FHGB	biogenic
O=C(OC(=O)C(C(F)(F)F)C(F)(F)F)C(C(F)(F)F)C(F)(F)F	205297669	FCMLFBCCCKHRED-UHFFFAOYSA-N	374.077	3.538	50	40	FHGB	
COc1ccc(C(=O)NNc2nc3c(Cl)cccc3s2)c(OC)c1	4121357	DFJWZODQOMOMKR-UHFFFAOYSA-N	363.826	3.724	50	40	FHGB	
O=C(N/N=C/c1ccccc1)c1cccc(NC(=O)c2ccc(F)cc2)c1	1444762	PKOXRBKIPWTMDK-OEAKJJBVSA-N	361.376	3.842	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2c(Cl)[nH]c3ccccc23)cc1OC	2295218	CQSUFDFMFWXOPY-SRZZPIQSSA-N	371.824	3.531	50	40	FHGB	
CCCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2n[nH]c(CCC)c21	9042122	LULTXHRYZIUVTI-KRWDZBQOSA-N	352.438	3.759	50	40	FHGB	
COc1cc(C)ccc1C(=O)N/N=C/c1ccc(Br)s1	408995126	JGUJCQJKXDOIMV-LZYBPNLTSA-N	353.241	3.592	50	40	FHGB	
O=C(N/N=C\c1ccc(N2CCCC2)cc1)c1cccc(Br)c1	408858529	SUDAWYBNDPDEOP-MOSHPQCFSA-N	372.266	3.813	50	40	FHGB	
COc1ccc([P+](C)(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1	95676704	LEUMZBWALJOLOV-UHFFFAOYSA-N	367.405	3.636	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccn2)c(C)n1-c1ccc2ccncc2c1	2783349	NWJIYNNWWISLDG-AFUMVMLFSA-N	369.428	3.801	50	40	FHGB	
C=C1C(C)(C)[C@H]2CC[C@]1(C(=O)NNC(=O)[C@]13CC[C@H](C1)C(C)(C)C3=C)C2	13557144	HFZJKRKZPFNURH-NLZGTENKSA-N	356.510	3.899	50	40	FHGB	
CSc1ncc(Cl)c(C(=O)/C(C#N)=C2\Nc3ccccc3S2)n1	101511024	NECKWPZYKXKBIQ-RIYZIHGNSA-N	360.851	3.988	50	40	FHGB	
N#C/C(=C\c1ccc(-c2cc(C(=O)O)ccc2Cl)o1)C(=O)N1CCCC1	409368774	LNSYDQZHFINGIW-UKTHLTGXSA-N	370.792	3.828	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)Nc2cccc(C(F)(F)F)c2)ccc1O	944716	LFKRAYWNSVZBFK-KPKJPENVSA-N	362.307	3.965	50	40	FHGB	
O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc(F)c(F)c1	3231883	ZZSOJYKBHWGXCI-LIMNOBDPSA-N	357.282	3.546	50	40	FHGB	
N#C/C(=C/c1ccc(Cl)cc1)C(=O)N1CCN(c2ccccc2)CC1	15229045	NCSUSZOJZLESPA-VKAVYKQESA-N	351.837	3.596	50	40	FHGB	
CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(CCCCC2)[C@@H]1c1ccccc1	19594800	VEVBBFJWPSYTNH-SIKLNZKXSA-N	361.445	3.854	50	40	FHGB	
CC(C)(OO)C1=C[C@@]23CC[C@@H]4[C@](C)(CCC[C@@]4(C)C(=O)O)[C@H]2C[C@@H]1OO3	38143832	HAPYGVXWHYQMIJ-PCBSZVIASA-N	366.454	3.961	50	40	FHGB	
Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)c1	59101762	DZNRKABONAYJRG-AWQFTUOYSA-N	364.232	3.699	50	40	FHGB	
COc1ccc(-c2c(C#N)c(N)c3c(c2-c2ccccc2)C(=O)OC3=O)cc1	105516359	PTMYNSXBSPNRDK-UHFFFAOYSA-N	370.364	3.794	50	40	FHGB	
Cc1nn(C2CCCC2)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	253408926	YZKJMPVZDXDIGN-SFHVURJKSA-N	366.465	3.758	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)cc1	409127734	RCNWKDILWAVIAY-WXUSHSQQSA-N	369.490	3.974	50	40	FHGB	
CC(=O)[C@@]1(O)[C@H](Cl)C[C@@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C	1772492807	FCNFDODVDQKBAV-LDXTZLFUSA-N	368.945	3.927	50	40	FHGB	
COC(=O)[C@@H](c1ccccc1)[C@](CBr)(OC)c1ccccc1	1593545	MRFSAIICLWMCNZ-SJLPKXTDSA-N	363.251	3.880	50	40	FHGB	
CC(C)Oc1ccccc1/C=C(\C#N)C(=O)Nc1cccc([N+](=O)[O-])c1	6828340	SWYZLCPJVOFDCE-XNTDXEJSSA-N	351.362	3.928	50	40	FHGB	
CCOc1cc(/C=N/NC(C)=O)cc(Cl)c1OCc1ccc(F)cc1	58822798	ABSVXOSOQHOMGJ-UFFVCSGVSA-N	364.804	3.927	50	40	FHGB	
CCOC(=O)c1c(NC(=O)[C@@H](Cl)CC)sc2c1CC(C)(C)OC2	2229574	HKIRYUJKQRZZQK-JTQLQIEISA-N	359.875	3.732	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C/c1cc(Cl)c(O)c2ncccc12	59459132	CCVPSTFGQGBPJX-WSDLNYQXSA-N	353.809	3.677	50	40	FHGB	
CC(C)(C)c1ccc(C(=O)N/N=C/c2ccc(N3CCOCC3)s2)cc1	6597629	FLJJBABUPOAGIE-KGENOOAVSA-N	371.506	3.646	50	40	FHGB	
Cc1ccc(C(=O)N/N=C/c2cc(Cl)cc([N+](=O)[O-])c2O)c(Cl)c1	4827469	FCNVQHIRMSNLQD-CNHKJKLMSA-N	368.176	3.680	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)Nc2ccc(C)cc2)cc(OCC)c1O	408854116	YAHDKKOUHSLKTO-BKUYFWCQSA-N	353.422	3.983	50	40	FHGB	
COc1ccccc1OCC(=O)N/N=C(\C)c1ccc(C(C)(C)C)cc1	5612641	LNTSTIUYLRXTOG-PXLXIMEGSA-N	354.450	3.912	50	40	FHGB	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)c1cccs1	2631382	ZFJSBUKHDJSEGX-UHFFFAOYSA-N	373.261	3.675	50	40	FHGB	
CCn1c(C)c(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21	408598538	CQRMAQRPIOUXMU-UDWIEESQSA-N	350.378	3.642	50	40	FHGB	
CCOC(=O)c1c(C)c(/C=C(\C#N)c2ccc([N+](=O)[O-])cc2)n(C)c1C	4979102	FHUWSJGVQGHHFD-XNTDXEJSSA-N	353.378	3.791	50	40	FHGB	
C[C@]12CC[C@@H]3[C@H](CC=C4CC5(CC[C@@]43C)OCCO5)[C@H]1CC[C@@]2(O)C#N	70669781	VRSHJJXUDZAQKD-ZUHHCLADSA-N	357.494	3.947	50	40	FHGB	biogenic
COc1ccccc1NC(=O)N/N=C/c1ccc(N2CCCCC2)cc1	408851545	CPFBHWMNQCDNHU-RCCKNPSSSA-N	352.438	3.841	50	40	FHGB	
COc1ccc(-n2cccc2/C=N/NC(=O)c2ccc(C)cc2OC)cc1	408949341	BECIFTFAOOYBQS-HYARGMPZSA-N	363.417	3.567	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(N(C)C)cc2)ccc1OC	408772919	NZHNUNFFBMRNMO-VBKFSLOCSA-N	365.433	3.706	50	40	FHGB	
CCN(C(C)=O)c1nc(/C=C(/C#N)c2ccc(C(F)(F)F)cn2)cs1	40051292	LUUIUJDNEDOGMA-WDZFZDKYSA-N	366.368	3.994	50	40	FHGB	
N#C/C(=C\c1ccc(OCCOc2ccccc2)cc1)C(=O)N1CCCC1	5006440	GGSSOTQDZYDAAA-KNTRCKAVSA-N	362.429	3.674	50	40	FHGB	
CCn1c(C)nc2cc(C(=O)N/N=C/C=C/c3ccccc3OC)ccc21	6621125	KIURHVDIFOLJFD-FHGPVCLNSA-N	362.433	3.802	50	40	FHGB	
Cn1c(SCC(=O)C(C#N)=C2Nc3ccccc3N2)nc2ccccc21	12537696	BXZAVBJZZZUJFA-UHFFFAOYSA-N	361.430	3.507	50	40	FHGB	
CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@H]1c1ccccc1C	2697890	XVUSKEOVADWTMJ-SFHVURJKSA-N	360.413	3.777	50	40	FHGB	
O=C(CN1CCCc2ccccc21)N/N=C/c1cccc(C(F)(F)F)c1	3202151	OOFFLGQUQZNMAD-FSJBWODESA-N	361.367	3.608	50	40	FHGB	
CCCCOc1ccc(C(=O)NNc2ccccc2[N+](=O)[O-])cc1OC	15503747	YPANPTVCAGBNPI-UHFFFAOYSA-N	359.382	3.539	50	40	FHGB	
COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2C)cc1	5678055	RPLUWVWYYCXLSZ-XNTDXEJSSA-N	354.793	3.981	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(Br)cc1)c1ccc([N+](=O)[O-])cc1	5289014	MTQSSIFPOVVMRF-LICLKQGHSA-N	362.183	3.511	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CCCC[C@H]1C(F)(F)F	44835755	WMMVCUUZWLBFQR-JKGMGYAYSA-N	372.431	3.719	50	40	FHGB	
O=P(C(=S)N[C@@H]1C[C@H]2C=C[C@@H]1C2)(c1ccccc1)c1ccccc1	105342766	FGUUHJBPQVYOOT-FRQCXROJSA-N	353.427	3.840	50	40	FHGB	
COc1cc(/C(C#N)=C\c2cc(OC)c3c(c2)OCO3)cc(OC)c1OC	96137282	DBEOZXYRHRZKBJ-RZNTYIFUSA-N	369.373	3.514	50	40	FHGB	
COC(=O)c1ccc(NC(=O)[C@]23CC[C@H]([C@H]2Br)C3(C)C)cc1	35982075	ZGDDAYBCQWSPDY-XNJGSVPQSA-N	366.255	3.611	50	40	FHGB	
O=C(CNc1ccc2ccccc2c1)N/N=C/c1ccc(Br)o1	1424057	YOTHPKBZACZZJJ-KEBDBYFISA-N	372.222	3.758	50	40	FHGB	
COc1ccc(-n2cccc2/C=C(/C#N)C(=O)Nc2ccc(O)cc2)cc1	33704960	ACKZCKRPECPISW-SQFISAMPSA-N	359.385	3.737	50	40	FHGB	
O=C(NNC(=O)C1CC1)c1sc2cc(C(F)(F)F)ccc2c1Cl	70014087	HGEKLGJVLXJRIR-UHFFFAOYSA-N	362.760	3.745	50	40	FHGB	
C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(CC)cc1	408816180	SSAOIRAYHLJMJI-QGOAFFKASA-N	360.413	3.815	50	40	FHGB	
Cc1ccc(C)c(NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C)c1	8733142	OCNOCGFBHQLWIP-OAHLLOKOSA-N	369.303	3.558	50	40	FHGB	
C/C(=N\NC(=O)c1cc(Br)ccc1O)c1ccc(C)cc1C	59922491	OVMUTZIQNVEIPX-XDHOZWIPSA-N	361.239	3.926	50	40	FHGB	
N#C/C(=C/c1cccc(Br)c1)C(=O)Nc1ccc(C(=O)O)cc1	2632414	NCCJWNHYPXFNPV-JYRVWZFOSA-N	371.190	3.693	50	40	FHGB	
COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc2c(c1)OCO2	2743885	JWTGAGXPEVAYNE-WUXMJOGZSA-N	356.765	3.623	50	40	FHGB	
OC[C@@]1(C#CCCCCl)COc2ccccc2N1Cc1ccccc1	306145458	FWPWOBFBMNAKCG-NRFANRHFSA-N	355.865	3.839	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)C2(c3cccc(Cl)c3)CCCC2)s1	71826974	ZVNRXYCPLYJCTC-UHFFFAOYSA-N	362.882	3.983	50	40	FHGB	
Cc1cccc2[nH]cc(C(=O)/C(C#N)=C\c3ccc(-n4cncn4)c(F)c3)c12	97152318	NAHNMAMQFRBVOC-CHHVJCJISA-N	371.375	3.986	50	40	FHGB	
Cc1cccc(C(=O)N/N=C\c2ccc(N(C)C)c(Br)c2)c1	408958057	XIAWTCFOLUTIRW-ODLFYWEKSA-N	360.255	3.587	50	40	FHGB	
CCOc1cc(Cl)c(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc1OC	408795314	VAGSPHGEPGYZTJ-MDWZMJQESA-N	372.808	3.999	50	40	FHGB	
O=C(O)c1ccc(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)cc1	59515948	IQPAHQLMHQCWGL-HAHDFKILSA-N	358.397	3.667	50	40	FHGB	
CCc1ccc(NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C)cc1	8733151	QOJYHQLAYZMQMD-HNNXBMFYSA-N	369.303	3.503	50	40	FHGB	
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1ccc2cccc3c2c1C(=O)OC3=O	103437329	KUEPLFZAYUBNOB-IZZDOVSWSA-N	373.320	3.955	50	40	FHGB	
O=C(N/N=C/c1cccc(OCc2ccc(F)cc2)c1)c1ccccc1O	409073733	XFNQDKOCQOMEJK-YDZHTSKRSA-N	364.376	3.874	50	40	FHGB	
COc1cc(/C=C(\C#N)c2ccc(C(F)(F)F)cn2)cc(OC)c1O	24362500	PPPXPKSMCGWBAA-VZUCSPMQSA-N	350.296	3.887	50	40	FHGB	
O=C(CSCc1ccccc1Br)N/N=C/c1ccccc1	1052147	WTVVZZIERYRQII-VCHYOVAHSA-N	363.280	3.833	50	40	FHGB	
CCCN(NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1	2302362	CEAMJUGVZCYILV-UHFFFAOYSA-N	360.457	3.870	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCOCC2)o1)C(=O)Nc1ccc2ccccc2c1	4499347	SVJWFVVPVVSKIU-JXAWBTAJSA-N	373.412	3.815	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2ccccc2Cl)c(C)n1-c1ccncc1	4675070	GIEOZDWAMRCTAI-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
COc1cc(Cl)cc(/C=N/NC(=O)c2ccc(C)cc2Cl)c1O	4815549	YXDZTBUVVPIKTD-UFWORHAWSA-N	353.205	3.780	50	40	FHGB	
O=C(CCc1ccccc1)N/N=C\c1c[nH]nc1-c1ccc(Cl)cc1	13322227	UQJUFVROUHKHIF-MTJSOVHGSA-N	352.825	3.813	50	40	FHGB	
CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N\NC(=O)c1ccc(C)cc1	15018574	NWBHJICJHVAJNE-MOSHPQCFSA-N	354.410	3.513	50	40	FHGB	
O=C(Cc1ccc(F)cc1)N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1	15147172	OHIKTTJCZMKORZ-CIAFOILYSA-N	367.336	3.687	50	40	FHGB	
O=C(N/N=C/c1ccc(Br)o1)c1ccc(Br)cc1	1187308	PQFWDFZECKFSDM-VIZOYTHASA-N	372.016	3.569	50	40	FHGB	
N#C/C(=C/c1ccc2c(c1)OCCO2)c1nc(O)c2ccc(Cl)cc2n1	40073246	GTKUHWSOBAFBHA-GHXNOFRVSA-N	365.776	3.824	50	40	FHGB	
COc1ccc2[nH]cc(C(=O)/C(C#N)=C/c3cc4ccccc4[nH]c3=O)c2c1	44026893	QMUYZHPITLDVFB-OQLLNIDSSA-N	369.380	3.808	50	40	FHGB	
O=C(CC[C@@H](O)c1ccccc1)N/N=C/c1cccn1-c1ccc(F)cc1	408753501	AIHSTHBXPFINBI-KMUCBOENSA-N	365.408	3.580	50	40	FHGB	
CC(=O)N/N=C/c1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	409012256	PSJIRHGPCBVSRA-AWQFTUOYSA-N	367.283	3.876	50	40	FHGB	
FC(F)(F)[C@@H](Br)COC[C@@H](Br)C(F)(F)F	1083807992	OVGIBYXHSJQMIX-ZXZARUISSA-N	367.909	3.655	50	40	FHGB	
C/C(=N\NC(=O)CSc1nc2ccccc2[nH]1)c1ccc(Cl)cc1	16136948	BWNWTRDFEHRTFJ-SRZZPIQSSA-N	358.854	3.849	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc(OC)c1O	408816443	YUCGOIOCQMJLLR-VXDMCVRGSA-N	354.450	3.731	50	40	FHGB	
Cc1ccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccc(O)cc3)cc2)cc1	5176137	NONFCFQWEPVOFY-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
O=C(CCl)Nc1ccccc1COC(=O)Cc1ccc(Cl)cc1	16449811	ZLUPUNWNKNNZRH-UHFFFAOYSA-N	352.217	3.803	50	40	FHGB	
Cc1ccccc1N1C(S)=C(C#N)C(=O)N[C@H]1c1ccccc1Cl	645034	HCEPHGWCQRCDEQ-MRXNPFEDSA-N	355.850	3.948	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@H]1c1ccc(F)cc1F	1444413	XNMHRJCIPHCEOX-ZDUSSCGKSA-N	356.357	3.635	50	40	FHGB	
O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1c2c(nc3ccccc13)CCCC2	5259228	OLKBYXQLCXPNNT-LPYMAVHISA-N	374.400	3.786	50	40	FHGB	
COc1cccc2cc(C(=O)N/N=C/c3cccc(OC(C)C)c3)oc12	6345978	CJUGFOIMXXDOSO-CIAFOILYSA-N	352.390	3.993	50	40	FHGB	
COc1cccc(/C=N\NC(=O)COc2ccc(-c3ccccc3)cc2)c1	34881581	VLXCSSXPVHBFGE-HAHDFKILSA-N	360.413	3.891	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccccc1Cl	59334225	WEIQXNKOWUBQRN-YBEGLDIGSA-N	370.836	3.923	50	40	FHGB	
Cc1cc(C(=O)NNC(=O)C[C@H]2C[C@@H]3CC[C@@H]2C3)c(C)n1-c1ccccc1	103043153	LGPWCQUNYSZTDF-KZNAEPCWSA-N	365.477	3.681	50	40	FHGB	
O=N[C@H]1[C@@H](Cl)[C@@H]2C[C@@H]1[C@@H]1C[C@H](Br)[C@H](Br)[C@@H]12	104068767	GKAXFKDNWWJFFR-NUFWMZOLSA-N	357.473	3.542	50	40	FHGB	
O=C(/C=C/c1ccccc1)Nc1ccccc1C(=O)N/N=C/c1ccco1	408996487	IFIHLMRODITEDN-ZCBGOQAOSA-N	359.385	3.695	50	40	FHGB	
CCOP(=O)(OCC)[C@H](NC(=O)c1ccccc1)C(Cl)Cl	3122147	LUZVMIALUQAZEI-ZDUSSCGKSA-N	354.170	3.812	50	40	FHGB	
C=CCn1c(-c2ccc(Cl)cc2)cs/c1=N/NC(=O)c1ccncc1	101350287	RCCPUXAGODCXSB-RELWKKBWSA-N	370.865	3.697	50	40	FHGB	
CN(C(=O)[C@]12CC[C@](C)(C(=O)[C@H]1Br)C2(C)C)c1ccccc1	4185823	FTAAUGWQDXBZLU-XWIAVFTESA-N	364.283	3.808	50	40	FHGB	
N#CC1=C(SCC(=O)c2ccccc2)NC(=O)[C@H](C#N)C12CCCCC2	8994878	JQJFXUAQVJYCIW-HNNXBMFYSA-N	365.458	3.558	50	40	FHGB	
COCCn1c(C)cc(/C=C(/C#N)c2nc3ccc(OC)cc3[nH]2)c1C	409392894	TUQBSPFSLDFRKE-YBEGLDIGSA-N	350.422	3.700	50	40	FHGB	
COc1cc(/C=N/NC(N)=O)ccc1OCc1c(Cl)cccc1Cl	657388	GJICHAZCTNHULM-DNTJNYDQSA-N	368.220	3.583	50	40	FHGB	
COc1cc(N2CCCCC2)ccc1/C=N/NC(=O)c1cccc(F)c1	409228213	VZKNOHVFMSRBPG-HYARGMPZSA-N	355.413	3.589	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1	4018543	GBKDEGIDSGHWLQ-FYJGNVAPSA-N	359.857	3.715	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NC2CC2)ccc1OCc1ccccc1F	111902919	SFAPNYJIEALSJI-MHWRWJLKSA-N	366.392	3.599	50	40	FHGB	
CCOC(=O)/C(C#N)=C\c1cccc(OCCOc2ccc(C)cc2)c1	15011831	PVIXOCLKMNPASZ-AQTBWJFISA-N	351.402	3.923	50	40	FHGB	
COc1ccc2cc(/C=N/NC(=O)c3ccc(C)cc3)c(Cl)nc2c1	408728842	VGDFGCUVKYGMDU-SRZZPIQSSA-N	353.809	3.969	50	40	FHGB	
CCn1ccnc1S[C@@H](C)C(=O)/C(C#N)=C1/Nc2ccccc2S1	103076706	LKSSPDHTXAXSNH-SPSOFYIISA-N	356.476	3.906	50	40	FHGB	
Cc1nn(C)c(C)c1[C@@H](C)C(=O)NN(Cc1ccccc1)c1ccccc1	60213083	CGGXQDNXUUCHPB-MRXNPFEDSA-N	362.477	3.878	50	40	FHGB	
Cc1cc(C)cc(OCC(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)c1	5539316	YKSNHTDOYJBLSV-DNTJNYDQSA-N	367.232	3.845	50	40	FHGB	
COc1ccc(C/C(C)=N\NC(=O)c2cn(C)c3ccccc23)cc1OC	4834554	WCGHQHGAGRXOPH-HMAPJEAMSA-N	365.433	3.544	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)CCSc2ccc(C)cc2)c1O	409131989	NZIGAWNAVNZWPH-DEDYPNTBSA-N	358.463	3.732	50	40	FHGB	
O=C(COc1cccc(Br)c1)N/N=C1/CCCc2ccccc21	17971892	GCYPYHRFJLXOMO-JZJYNLBNSA-N	373.250	3.685	50	40	FHGB	
CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc1OC	8846208	UXSSICMJUIFNNW-FQEVSTJZSA-N	365.433	3.674	50	40	FHGB	
COc1cc(C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)cc(OC)c1OC	5383847	TZWSGKPFPYQECT-LPYMAVHISA-N	370.449	3.774	50	40	FHGB	
COc1ccc(C(=O)N/N=C(/C)CC(=O)Nc2ccc(C(C)C)cc2)cc1	103747877	GJRLKSXGHDNOKI-HAHDFKILSA-N	367.449	3.953	50	40	FHGB	
COc1ccc2c(Cl)c(C(=O)NNC(=O)Cc3ccccc3)sc2c1	674898	SSAITRWVTZASQK-UHFFFAOYSA-N	374.849	3.567	50	40	FHGB	
COc1ccccc1/C=N/NC(=O)CSc1cc(C)nc2ccccc12	871064	POLVOJBETXVPEG-CIAFOILYSA-N	365.458	3.794	50	40	FHGB	
O=C(N/N=C/c1cc(Cc2ccccc2Cl)ccc1O)c1cccnc1	2328981	GRNAMNFQKJWKAQ-YDZHTSKRSA-N	365.820	3.795	50	40	FHGB	
COc1ccccc1OCC(=O)N/N=C/c1ccc(-c2ccccc2)cc1	4679977	PWWDMYXFMNSBBG-HZHRSRAPSA-N	360.413	3.891	50	40	FHGB	
C/C(=N\NC(=O)c1ccncc1)c1ccc(NC(=O)c2cccs2)cc1	5621235	RIUVSKYMZGHHNL-LPYMAVHISA-N	364.430	3.549	50	40	FHGB	
N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)Nc1ccc(Br)cc1	5895370	KSHXGILFWRTKLV-GHXNOFRVSA-N	371.190	3.723	50	40	FHGB	
CO[C@H](C(=O)N/N=C(\C)c1cccc(Br)c1)c1ccccc1	20248793	MGCUMFZEIJYQJB-QUYZQLMHSA-N	361.239	3.677	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2ccccc2Br)cc1	26123511	RUSZAZPCHQNVMA-XDHOZWIPSA-N	359.223	3.778	50	40	FHGB	
O=C(NNC1=C(C(=O)C(F)(F)F)CCCCC1)c1cccc(Cl)c1	59488997	JHWMIEMLNZJZMM-UHFFFAOYSA-N	360.763	3.924	50	40	FHGB	
Cc1[nH]c2ccccc2c1/C=C(/C#N)C(=O)N1CCN(c2ccccc2)CC1	208489325	STXNNXKRRPBCDV-SDXDJHTJSA-N	370.456	3.732	50	40	FHGB	
O=C(CC[C@H](O)c1ccccc1)N/N=C/c1cccn1-c1ccccc1F	408755692	LVZGAGXHWXVOCO-VRMLFSPKSA-N	365.408	3.580	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)cc(Cl)c1O	409238578	KJRIDLABXNZADJ-YBEGLDIGSA-N	370.836	3.710	50	40	FHGB	
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)OCCCl)cc1	3215401	MGXNVSSKJIOFKQ-UHFFFAOYSA-N	356.809	3.944	50	40	FHGB	
COc1cc(/C=N/NC(=O)Cc2cccc3ccccc23)cc(Cl)c1O	10847892	SCZWUYSNALBOHR-WSDLNYQXSA-N	368.820	3.900	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(C(=O)O)cc1	97086677	FPCAUHIMGXGQCC-LGMDPLHJSA-N	361.401	3.531	50	40	FHGB	
COc1cccc(/C=N/NC(=O)COc2cc(C(C)C)ccc2C)c1OC	3167254	YQJHDSIEKUVUKJ-WSDLNYQXSA-N	370.449	3.665	50	40	FHGB	
Cc1ccc(Cl)c(OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c1	31640629	MSVHAWPKJPZZGZ-UHFFFAOYSA-N	367.836	3.918	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)c(C)n1C[C@@H]1CCCO1	7638590	LTDNJQJJRIPWRD-KDMTZKAISA-N	367.424	3.969	50	40	FHGB	
CCOC(=O)CSC1=C(C#N)[C@@H](c2ccco2)C2=C(O)CCCC2=N1	2229397	CXWBORAZEGKGEJ-INIZCTEOSA-N	358.419	3.845	50	40	FHGB	
N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1c1ccc(F)c(F)c1	6813967	ITTSUPCFZLMJGO-OAHLLOKOSA-N	350.328	3.573	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(Cl)cc1Cl)c1ccc2c(c1)OCCO2	408881095	LYVKQULURMXZJN-KEBDBYFISA-N	365.216	3.919	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CCC[C@@H]2C)[C@H]1c1ccccc1	230101672	BECKUTVKDLBRRL-BANJIEJESA-N	361.445	3.710	50	40	FHGB	
N#C/C(=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)C(=O)N1CCCCC1	1202943	CNPKCAOLXKGOHU-WYMLVPIESA-N	351.362	3.774	50	40	FHGB	
Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]	3175088	LDUQZRMWVSGXCL-VRCTWVPOSA-N	369.421	3.944	50	40	FHGB	
O=C(N/N=C/C1=CCCCC1)c1cccc(I)c1	11613912	NITHVJPLXMGYER-MHWRWJLKSA-N	354.191	3.507	50	40	FHGB	
COc1ccc(OCC(=O)N/N=C/c2ccc(Cl)cc2Cl)cc1	5360306	KCLNVKIGQLRIDJ-DJKKODMXSA-N	353.205	3.531	50	40	FHGB	
CC(C)C1=C/C(=N\S(=O)(=O)c2ccccc2)[C@@](C)(Cl)[C@@H](Cl)C1=O	12562488	AMKNSIWVDQASDH-MVNPWANASA-N	374.289	3.586	50	40	FHGB	
COc1cccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(N)=S)c1	33412881	IFAWMNHGEMECMA-GDNBJRDFSA-N	360.442	3.741	50	40	FHGB	
O=C(COc1c(Cl)cc(Cl)cc1Cl)N/N=C/c1ccc(O)cc1	711522	DFVBSMWYIGHYSE-FBCYGCLPSA-N	373.623	3.882	50	40	FHGB	
CC1(C)CCC2=C(C1=O)[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2	939046	NLVARNKOPMWQRD-CQSZACIVSA-N	373.250	3.900	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C/[C@@H](C)Cc2ccc3c(c2)OCO3)cc1	4507150	KYEZBROEXJBAGU-NSMHLIOHSA-N	368.433	3.799	50	40	FHGB	
N#C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	4953646	ZMFYJWAIQWOQPD-YRNVUSSQSA-N	372.724	3.702	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)N[C@@H](C)c2ccccc2)c(OC)c1C	409235762	QJSQJKXGQUCYQX-BRYHAGSVSA-N	350.418	3.797	50	40	FHGB	
CCCOc1ccc(C(=O)N/N=C\c2ccc(O)c(Cl)c2)cc1OC	409311802	IHTQBXWGTGNHSN-JAIQZWGSSA-N	362.813	3.607	50	40	FHGB	
CC(C)Oc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1	408959905	ABIIFSPVWFKEAR-RGVLZGJSSA-N	367.361	3.892	50	40	FHGB	
O=C(N[C@H](NC(=O)c1ccc(Cl)cc1)C(Cl)Cl)c1ccccc1	5601609	WKEHNTLDEGHCEY-CQSZACIVSA-N	371.651	3.630	50	40	FHGB	
Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1	989053	KJEVULZDYBGWIC-LJQANCHMSA-N	360.392	3.846	50	40	FHGB	
CCCCOc1ccc([C@H]2C(C#N)=C(N)OC3=C2CCCC3=O)cc1OC	5792936	FGZOMSVDIHZTAG-LJQANCHMSA-N	368.433	3.689	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)CC(c2ccccc2)c2ccccc2)cc1	6221132	BYHQCTQRSYCZTO-UHFFFAOYSA-N	358.441	3.978	50	40	FHGB	
CCN(NC(=O)/C=C/c1c(Cl)nc2ccccn12)c1ccc(C)cc1	8051313	KCDDFSGXUKWXAA-VAWYXSNFSA-N	354.841	3.867	50	40	FHGB	
CN1/C(=C\C=N\NC(=O)COc2ccc(F)cc2)C(C)(C)c2ccccc21	13063145	QDDRXFPPSUHIGC-CZACTKFKSA-N	367.424	3.618	50	40	FHGB	
C/C(=N\NC(=O)[C@H](C)SCc1ccccc1)c1ccc([N+](=O)[O-])cc1	20248647	GMLMLVXGKYJPJI-ITRAFESCSA-N	357.435	3.757	50	40	FHGB	
CCOC(=O)NC[P+](c1ccccc1)(c1ccccc1)c1ccccc1	102129499	JQZVACDSPSKCLP-UHFFFAOYSA-O	364.405	3.684	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OCc1ccc(F)cc1	213933356	STUPCNGQUPUUES-YVLHZVERSA-N	368.408	3.845	50	40	FHGB	
Cc1ccc(/C=N/NC(=O)[C@@H](C)SCc2ccccc2)cc1[N+](=O)[O-]	408719164	IJBOOAISSGQIJB-HIPSJFSSSA-N	357.435	3.675	50	40	FHGB	
C[C@H]1CCCC[C@@H]1NC(=O)/C(C#N)=C/c1cc(Br)ccc1O	408804163	CQDOFLNLXSXAFE-ZBTQSTBISA-N	363.255	3.757	50	40	FHGB	
COC(=O)N/N=C/c1cc(Cl)c(OCc2ccc(F)cc2)c(OC)c1	2307043	QMSSWUKXKGLMJQ-AWQFTUOYSA-N	366.776	3.757	50	40	FHGB	
COc1ccc(C/C(C)=N\NC(=O)c2c[nH]c3ccccc23)cc1OC	4827185	KFWJWWOXQQBZHV-XKZIYDEJSA-N	351.406	3.534	50	40	FHGB	
C/C(=N/NC(=O)CCn1nnc2ccccc21)c1ccc2ccccc2c1	13618796	UNAVZGUPBFMGSV-JCMHNJIXSA-N	357.417	3.515	50	40	FHGB	
CCOc1ccc(CC(=O)N/N=C(\CC)c2ccc(OC)cc2OC)cc1	408711953	SEHAQEAHRMTSKZ-ZBJSNUHESA-N	370.449	3.576	50	40	FHGB	
Cc1ccn2c(C(=O)N/N=C/c3c(O)ccc4ccccc34)c(C)nc2c1	408976689	SJHYSHOETXXLPH-WSDLNYQXSA-N	358.401	3.574	50	40	FHGB	
CC[C@@H](C)Oc1ccc(/C=N\NC(=O)Cc2ccc(F)cc2)cc1OC	409250304	QLPGLTXBUIJPLD-BXSODOALSA-N	358.413	3.704	50	40	FHGB	
O=C(CCCc1ccccc1)NNC1=C(C(=O)C(F)(F)F)CCCCC1	59489010	UDJNOVJRYROQAZ-UHFFFAOYSA-N	368.399	3.980	50	40	FHGB	
CC(C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1	408790585	QFSJLRRPDTZKMN-KPKJPENVSA-N	359.769	3.940	50	40	FHGB	
C=CCc1cc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)cc(OC)c1O	408793209	DMQDNQXIUFGUGS-LFIBNONCSA-N	364.401	3.684	50	40	FHGB	
O=C(CC[C@@H](O)c1ccccc1)N/N=C/c1ccc(Cl)cc1Cl	83324977	ODIGWASUIDPOOW-MBTVCVBTSA-N	351.233	3.957	50	40	FHGB	
CCCC[C@](C)(OC)C(=O)Nc1ccc(OCCBr)cc1	225618195	NFKORKKKYWWZSL-INIZCTEOSA-N	358.276	3.994	50	40	FHGB	
N#C/C(=C\c1cccc([N+](=O)[O-])c1)c1nc2ncc(Br)cc2[nH]1	4855426	XFIYMTTXSYUOKV-ONNFQVAWSA-N	370.166	3.693	50	40	FHGB	
O=C(c1ccccc1OC(F)F)[C@@H](Br)CBr	309349209	ZYTFUMFPQQJKLD-ZETCQYMHSA-N	357.976	3.629	50	40	FHGB	
Cc1ccc(C)c(NC(=O)/C(C#N)=C2/C(=O)N(C(C)C)c3ccccc32)c1	198073695	UNDPADMORLJNDI-LVZFUZTISA-N	359.429	3.974	50	40	FHGB	
CCn1c2ccccc2c2cc(/C=C(\C#N)C(=O)NCCCOC)ccc21	5569476	AVHKAMFUEXCVHR-GHRIWEEISA-N	361.445	3.874	50	40	FHGB	
Cc1ccc(-c2csc(N(C[C@H]3CCCO3)C(=O)CCl)n2)cc1	932687	MZVQJTLXOCIVTE-CQSZACIVSA-N	350.871	3.869	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)CSCc2ccc(OC)cc2)cc1	5205557	UHLJMXMMRQXHRP-FYJGNVAPSA-N	370.474	3.644	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2ccc(C(C)(C)C)cc2)cc1OC	5632521	OHUPCACKBNEUHU-HYARGMPZSA-N	354.450	3.694	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2)ccc1OC(C)=O	59116735	QQQPAANHIMVQCE-LFIBNONCSA-N	350.374	3.556	50	40	FHGB	
CC(C)Oc1ccccc1/C=N\NC(=O)COc1cccc2cccnc12	409019560	UEPVWJKWMUWVCC-QRVIBDJDSA-N	363.417	3.551	50	40	FHGB	
N#C/C(=C\c1ccccc1)C(=O)Nc1ccc(I)cc1	1051824	BUHMHMUUQZEQEP-JLHYYAGUSA-N	374.181	3.837	50	40	FHGB	
Cc1ccc(S(=O)(=O)N=[S@](CCCl)CCc2ccccc2)cc1	6487297	MFZUURLQTGIEQW-JOCHJYFZSA-N	369.939	3.967	50	40	FHGB	
COc1cc(C(=O)N/N=C/c2ccc(N3CCCC3)c(C)c2)ccc1C	4712311	LXXRJLNWRODFET-HYARGMPZSA-N	351.450	3.676	50	40	FHGB	
CCCc1n[nH]c2c1[C@@H](c1ccc(OC)c3ccccc13)C(C#N)=C(N)O2	8568272	JTRXVLKSCHXFNC-SFHVURJKSA-N	360.417	3.742	50	40	FHGB	
COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2C)cc(SC#N)c1O	409048533	RQUNQVNBUBGRAI-AUWJEWJLSA-N	365.414	3.828	50	40	FHGB	
NNC(=O)c1cc(Cl)c2[nH]c(-c3ccc(Cl)cc3Cl)nc2c1	226344658	BKXRLJZYOHSUBM-UHFFFAOYSA-N	355.612	3.794	50	40	FHGB	
CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CCCCC2)[C@H]1c1ccccc1	19594802	VEVBBFJWPSYTNH-KNQAVFIVSA-N	361.445	3.854	50	40	FHGB	
COC(=O)N/N=C/c1ccccc1OCCCOc1cc(C)cc(C)c1	4599347	PBEWAPWNXRZXHZ-KGENOOAVSA-N	356.422	3.841	50	40	FHGB	
CCOc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccccc1	59333619	PVDXGGUSBFHBMH-PDGQHHTCSA-N	350.418	3.659	50	40	FHGB	
C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1OCC	409132216	PBHNWLWSFSMXNE-FQEVSTJZSA-N	364.401	3.574	50	40	FHGB	
C=CCc1cccc(/C=N/NC(=O)CNc2cccc3ccccc23)c1O	1054850	KLKTZJFZTOJGSK-ZVHZXABRSA-N	359.429	3.836	50	40	FHGB	
N#CC(C#N)=Cc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	669867	FGJIMHMESDXYPI-UHFFFAOYSA-N	352.737	3.931	50	40	FHGB	
COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)cc(OC)c1OC(C)=O	4993183	LRLPIVPJVPPKHQ-ZSOIEALJSA-N	363.373	3.570	50	40	FHGB	
N#C/C(=C/c1ccc(-c2ccccc2Cl)o1)C(=O)NC[C@H]1CCCO1	26964704	GBQMBZKFRHZHPZ-VSKPTYQZSA-N	356.809	3.802	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCC2)cc1)C(=O)Nc1ccccc1C(=O)O	97086678	ZZNOUGLWWKHLKU-SSZFMOIBSA-N	361.401	3.531	50	40	FHGB	
O=C(N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(-n2cccc2)c1	409095304	BUYQEGMJLMOBFI-NDENLUEZSA-N	368.780	3.803	50	40	FHGB	
Cc1ccc(-c2ccc(/C=N/NC(=O)c3ccccc3N)o2)cc1[N+](=O)[O-]	408726565	UCVQUBSSZIOADS-SRZZPIQSSA-N	364.361	3.509	50	40	FHGB	
COc1cccc(CC(=O)N/N=C\c2ccc(-c3cccc(F)c3)o2)c1	409019542	ZQFZUFVFJCUOBC-XKZIYDEJSA-N	352.365	3.787	50	40	FHGB	
CCOC(=O)C(CCCCCCCCBr)C(=O)OCC	35585974	SIHFOISCRVIVLF-UHFFFAOYSA-N	351.281	3.854	50	40	FHGB	
Cn1cnc2ccc(NC(=O)CCCC[C@H]3CCSS3)cc2c1=O	95478246	OTUQMSLAOPUNLE-ZDUSSCGKSA-N	363.508	3.586	50	40	FHGB	biogenic
O=C(N/N=C/c1c(O)ccc2ccccc12)c1cc(-c2ccccc2)n[nH]1	8461910	HOMZZALZTBXBCM-LPYMAVHISA-N	356.385	3.699	50	40	FHGB	
CCOc1cc2c(cc1/C=C(\C#N)C(=O)NCc1ccccc1)O[C@@H](C)C2	13137660	ATKGEZUQYNVPNY-RPJLVFAOSA-N	362.429	3.632	50	40	FHGB	
COc1cc(Cl)cc(/C=C(/C#N)C(=O)N[C@H](C)c2ccccc2)c1O	409235637	COLGIQMLVQCNEH-PWDRSIHYSA-N	356.809	3.839	50	40	FHGB	
C=CCOc1ccc(/C=C(\C#N)C(=O)N[C@@H](C)CC)cc1Br	408801449	TUFGJIDTWUHGEL-IGVUGNCQSA-N	363.255	3.836	50	40	FHGB	
CCCOc1ccc2ccccc2c1/C=N/NC(=O)[C@H](O)c1ccccc1	409268464	UASJXCJZRZDIRF-CPOKCXMASA-N	362.429	3.812	50	40	FHGB	
COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)c(Cl)c2)cc1	408735279	PNQQPUHWRVSEPX-OQLLNIDSSA-N	354.793	3.981	50	40	FHGB	
Cc1nc2ccccc2n1CC(=O)N/N=C/c1ccc(Cl)c(Cl)c1	5571443	SOIJWTWBXMTBOT-AWQFTUOYSA-N	361.232	3.802	50	40	FHGB	
N#C/C(=C\c1cn(Cc2ccc(F)cc2)c2ccccc12)[C@H](N)C(C#N)C#N	22288906	BYWAOVBNIPHRFD-NAVGAYGYSA-N	369.403	3.726	50	40	FHGB	
COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccco2)sc2c1CCCC2	1453394	JUFIFXWDYXHISZ-PKNBQFBNSA-N	356.403	3.552	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2c(Cl)cccc2Cl)cc1OC	4720809	LTKONOPGYJRHAL-KEBDBYFISA-N	367.232	3.703	50	40	FHGB	
CC(/C=C/c1ccccc1)=N\NC(=O)COc1ccc(Cl)cc1[N+](=O)[O-]	4812519	ZTPLLBCRXOIMJG-AADYKHLVSA-N	373.796	3.833	50	40	FHGB	
O=C(N/N=C/C=C/c1ccccc1[N+](=O)[O-])c1cc2c(s1)CCCC2	6932165	VKUZMSNWFPEAIJ-CEGJKDKLSA-N	355.419	3.964	50	40	FHGB	
Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc3c(c1)OCO3)C(C#N)=C(O)O2	408729780	CTOWBBJRDQJDAL-LJQANCHMSA-N	373.368	3.727	50	40	FHGB	
Cc1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)n(C2CCCC2)n1	253399749	JWTCCPYFWPZGPG-SFHVURJKSA-N	366.465	3.758	50	40	FHGB	
C[C@H]1C[C@H]([P+](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)O1	1775964768	BRGBURGZSZDDIA-AVRDEDQJSA-N	361.401	3.685	50	40	FHGB	
COC(=O)c1ccc([C@@H]2C(C#N)=C(N)Oc3ccc4ccccc4c32)cc1	1037163	DKRFJDHFZMNYLF-LJQANCHMSA-N	356.381	3.845	50	40	FHGB	
C/C(=N/NC(=O)CCC(=O)Nc1cccc(Cl)c1)c1ccc(C)cc1	4647003	UMAUXZKEVNHXJA-HMAPJEAMSA-N	357.841	3.908	50	40	FHGB	
N#CC(C#N)=C(N)/C(C#N)=C/c1ccc(-c2ccc(Br)cc2)o1	97957624	UILXENGRHYFPIQ-KPKJPENVSA-N	365.190	3.876	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C/c2ccc(N(C)C)cc2)c([N+](=O)[O-])c1	408899120	ZEQWJSUEYVSWHJ-RVDMUPIBSA-N	350.378	3.515	50	40	FHGB	
Cc1ccc(-n2nc(C)c(/C=N/NC(=O)c3cccs3)c2Cl)cc1	2657097	LAUNNSAPDPORKR-VXLYETTFSA-N	358.854	3.968	50	40	FHGB	
CCOC(=O)/C(C#N)=C(/O)c1ccc(NC(=O)c2ccccc2Cl)cc1	100076550	QVGZXUVNUWMUEP-BMRADRMJSA-N	370.792	3.948	50	40	FHGB	
O=C(N/N=C1/C[C@H]2CC=C[C@H]12)c1cc(-c2ccccn2)nc2ccccc12	32706033	XWJIEOOWGPKFTR-TXQFNFPISA-N	354.413	3.979	50	40	FHGB	
Cc1cc(C)cc(CSCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)c1	59473743	DFDBUZDBBPGEQW-VXLYETTFSA-N	357.435	3.595	50	40	FHGB	
O=C(N/N=C/c1cccc(Oc2ccccc2)c1)[C@H]1COc2ccccc2O1	3206641	YPIXHKPTAWXCTJ-KURUZVKSSA-N	374.396	3.769	50	40	FHGB	
O=C(Cc1ccccc1F)NNC(=O)c1cc2c(s1)CCCCCC2	8316176	GOGAXRZJTRDNNB-UHFFFAOYSA-N	360.454	3.550	50	40	FHGB	
N#C/C(=C\c1ccc(OCC(=O)O)c(Cl)c1)c1ccc([N+](=O)[O-])cc1	409043663	SWGSTBRDGZDUFG-NTUHNPAUSA-N	358.737	3.776	50	40	FHGB	
CC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(OCc2ccccc2C#N)cc1	408815438	WUWGQMCENPNXDK-DDLUMYACSA-N	359.429	3.959	50	40	FHGB	
COc1ccc(/C=N\NC(=O)c2ccc(Cl)cc2)cc1Br	30822093	HPJRUOZULJWZKS-NVMNQCDNSA-N	367.630	3.875	50	40	FHGB	
Cc1cc(/C=C(/C#N)C(=O)NC(C)C)c(C)n1-c1ccc(N(C)C)cc1	408780391	BTKFBBZNAYCKMV-PDGQHHTCSA-N	350.466	3.592	50	40	FHGB	
COc1cc(OC)cc(C(=O)N/N=C\c2cccc(Cl)c2Cl)c1	35525058	GPTJFJHWYWRYMH-OCKHKDLRSA-N	353.205	3.775	50	40	FHGB	
N#C/C(=C/n1c(S)nc2ccc([N+](=O)[O-])cc21)c1ccc([N+](=O)[O-])cc1	1637222	CTXPJMHLFCZYMB-LUAWRHEFSA-N	367.346	3.663	50	40	FHGB	
CCOc1ccc(-c2n[nH]c(C(=O)N/N=C(/C)c3ccccc3)c2C)cc1	4994234	NTXOFHDHHLIAPH-JCMHNJIXSA-N	362.433	3.938	50	40	FHGB	
CCOc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)cc1OC	1967101	KKGIRRHHJDCVEI-GZTJUZNOSA-N	357.431	3.741	50	40	FHGB	
O=C(N/N=C/c1cccn1-c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1	59679091	PRGUMOVXILZMFU-UDWIEESQSA-N	368.780	3.803	50	40	FHGB	
Cc1ccc(C)c(N2C(=O)CS/C2=N\NC(=O)c2ccccc2Cl)c1	13424220	ZFZBFXBVBCLQPB-UZYVYHOESA-N	373.865	3.738	50	40	FHGB	
COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OCC(C)C)cc2)cc1	408814380	GXOGVBYLKTVJLX-UNOMPAQXSA-N	364.445	3.953	50	40	FHGB	
CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1ccccc1C	408835170	MRRXLUBRCFBCJM-LFIBNONCSA-N	350.374	3.638	50	40	FHGB	
CCOc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccs4)c32)cc1	5408569	JGJQYLVNXZZSAV-HNNXBMFYSA-N	364.430	3.755	50	40	FHGB	
CCCOC(=O)CSC1=C(C#N)[C@H](c2ccc(C(C)C)cc2)CC(=O)N1	9012761	FNTPJRRYFZFJAC-INIZCTEOSA-N	372.490	3.835	50	40	FHGB	
CCCOC(=O)CSC1=C(C#N)[C@@H](c2ccc(C(C)C)cc2)CC(=O)N1	9012763	FNTPJRRYFZFJAC-MRXNPFEDSA-N	372.490	3.835	50	40	FHGB	
COc1ccc(/C=C(\C#N)c2nc(N)nc(Nc3ccccc3)n2)cc1C	9366417	ZZQUOUVGXZYIEQ-RVDMUPIBSA-N	358.405	3.579	50	40	FHGB	
Cc1cc(Cl)ccc1OCC(=O)N/N=C\c1c(F)cccc1Cl	17073414	ZKRBZARLTYBCCB-ZBKNUEDVSA-N	355.196	3.970	50	40	FHGB	
CC1=CC(=O)[C@](Cl)(C(C)C)[C@@H](Cl)/C1=N/S(=O)(=O)c1ccccc1	105600301	AMXLKTIEMKDGJB-UQDCMPHNSA-N	374.289	3.586	50	40	FHGB	
C=CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1OCC	408745919	AWBSWXKQFKPYEV-UYRXBGFRSA-N	362.429	3.873	50	40	FHGB	
Cc1ccccc1C(=O)NNC(=O)c1cc2c3ccccc3n(C)c2s1	1386907	YCLOSVAWGBJUDQ-UHFFFAOYSA-N	363.442	3.776	50	40	FHGB	
CCc1cccc2c(/C=C(\C#N)C(=O)NCc3ccc4c(c3)OCO4)c[nH]c12	6959365	JVKGKIKEQXWQGY-CXUHLZMHSA-N	373.412	3.682	50	40	FHGB	
N#C/C(=C/c1ccccc1)C(=O)OCC(=O)c1cccc(Br)c1	3240661	WMMOBEKATZBGTF-DHDCSXOGSA-N	370.202	3.782	50	40	FHGB	
O=C(NNC(=O)C1CC1)c1ccc(-c2cc(Cl)cc(Cl)c2)s1	58356892	QCWNGMMPTHBXMH-UHFFFAOYSA-N	355.246	3.893	50	40	FHGB	
Cc1ccc2[nH]c(SCC(=O)C(C#N)=C3Nc4ccccc4N3)nc2c1	6536697	OQARUQBKWVESKF-UHFFFAOYSA-N	361.430	3.805	50	40	FHGB	
Cc1ccc([C@H]2C[C@H]2C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	8685696	KYMUYZDKPNXNDH-HZPDHXFCSA-N	359.882	3.770	50	40	FHGB	
CCN(CC)c1ccc(/C=N/NC(=O)CSCc2ccc(C)cc2)o1	408995064	IKLQHNBOZCTSDY-UDWIEESQSA-N	359.495	3.818	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(OCC#N)cc1	408832198	XDOWXXXSKAEHKP-XMOVILSBSA-N	373.865	3.873	50	40	FHGB	
CCOc1ccc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)cc1OCC	409386380	MYOVQCCDNFXJNJ-BOPFTXTBSA-N	353.422	3.580	50	40	FHGB	
COc1ccc(OC)c(/C=N/NC(=O)CSc2ccc(Cl)cc2)c1	40961692	QGWSVJMBVTZNMO-VXLYETTFSA-N	364.854	3.600	50	40	FHGB	
O=C(N/N=C/c1ccccc1O)c1ccc(/N=C/c2ccccc2O)cc1	3059487	NXODMKUIZJUFMN-MSKUYSOUSA-N	359.385	3.612	50	40	FHGB	
C[C@@H]1CCc2c(sc(NC(=O)/C(C#N)=C/c3ccccc3)c2C(N)=O)C1	941899	WLIHAFPYJZFQEF-HLVNSREUSA-N	365.458	3.517	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)c(F)c2)cc1	66255732	PVZIQKYDXDJAQV-ATVHPVEESA-N	365.408	3.516	50	40	FHGB	
C[C@H](Sc1ccccc1)C(=O)N/N=C/c1cccc(OC2CSC2)c1	408869965	UOEFYBZDCQBYFX-HXJASHHUSA-N	372.515	3.812	50	40	FHGB	
Cc1cccc(OCC(=O)NNC(=O)[C@@H](c2ccc(Cl)cc2)C(C)C)c1	5272866	FHYBLGAKWOYFQJ-LJQANCHMSA-N	374.868	3.614	50	40	FHGB	
Cc1ccc(C(=O)Nc2cccc(C(=O)N/N=C/c3ccccc3O)c2)cc1	1054464	CYJAARXHWQAFGK-OEAKJJBVSA-N	373.412	3.717	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccc2c(c1)OCO2	863209	USJJOLNQLVBCLF-WSDLNYQXSA-N	362.385	3.731	50	40	FHGB	
COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)c1	989063	ZDZVKBAFFONOIJ-HXUWFJFHSA-N	372.428	3.716	50	40	FHGB	
Cc1cccc(Oc2nc3c(C)cccn3c(=O)c2C=C(C#N)C#N)c1C	5577320	HTTAYFVRDOKRSW-UHFFFAOYSA-N	356.385	3.843	50	40	FHGB	
C/C(=N\NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1ccccn1	9218329	DSCHASDXHDFSKF-OEAKJJBVSA-N	350.397	3.782	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=N\NC(=O)c1ccc([N+](=O)[O-])cc1	38365731	NZTSZWBFFFTHOH-HMAPJEAMSA-N	373.368	3.524	50	40	FHGB	
C/C(=N\NC(=O)c1cc(C2CC2)nc2ccccc12)c1ccc(O)cc1O	100661653	JQXUPGQHWCPLBO-FSJBWODESA-N	361.401	3.677	50	40	FHGB	
Cn1ncc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c1-c1ccccc1	253399207	INSOTJLBXCVVIX-SFHVURJKSA-N	374.444	3.538	50	40	FHGB	
COc1c(Cl)cc(/C=C(/C#N)C(=O)NC(C)C)cc1Br	408779502	FRNXWYSUDRJXPM-WMZJFQQLSA-N	357.635	3.543	50	40	FHGB	
N#C/C(=C\c1cccc(OCC(=O)O)c1)C(=O)Nc1cccc2ccccc12	408923849	KPRLMKPXXQXUDO-GZTJUZNOSA-N	372.380	3.849	50	40	FHGB	
COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)c2cccc(C)c2)o1	409217684	FFHBOEFKSSPZMR-LPYMAVHISA-N	362.385	3.806	50	40	FHGB	
CC(=O)Nc1ccc(/C(C)=N/NC(=O)CCSc2ccccc2)cc1	59473587	MFXTUIXGRHESIO-KGENOOAVSA-N	355.463	3.668	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)CSCc2ccc(OC)cc2)cc1	59473083	LNUVVRRPTSFIHA-FYJGNVAPSA-N	372.490	3.868	50	40	FHGB	
COc1cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])cc1OC	67189528	XNVKNQWOWIXTMZ-QPEQYQDCSA-N	355.306	3.584	50	40	FHGB	
COc1cc(C)ccc1C(=O)N/N=C/c1ccc(N2CCCC2)c(F)c1	409070744	LYUDEHKEWJITCU-LPYMAVHISA-N	355.413	3.507	50	40	FHGB	
N#C/C(=C/c1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	207813102	CFIHKSHMTUWUPI-JYRVWZFOSA-N	360.291	3.949	50	40	FHGB	
N#CC1=C(SCC(N)=O)N=C2CCCC(O)=C2[C@@H]1c1ccccc1Cl	100086694	SQEWZSWDUNFGQH-MRXNPFEDSA-N	373.865	3.828	50	40	FHGB	
Cc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)c(C)n1-c1cccnc1	824101	JSEMWXZSIIQJGW-UDWIEESQSA-N	356.429	3.713	50	40	FHGB	
O=C(N/N=C/c1ccsc1)C(Oc1ccccc1)Oc1ccccc1	1085436	JCWOGKPOETWOHM-DEDYPNTBSA-N	352.415	3.682	50	40	FHGB	
Cc1oc(C)c2c(=O)ccc3c(c12)OC(N)=C(C#N)[C@@H]3c1ccc(F)cc1	2408687	YCUAREVJXGUQIY-LJQANCHMSA-N	362.360	3.767	50	40	FHGB	
Cc1ccc(N2C(S)=C(C#N)C(=O)N[C@@H]2c2ccccc2Cl)cc1	4513587	VELRHYQCECLCPR-INIZCTEOSA-N	355.850	3.948	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)cc1OC	4724153	ZNZLLXLVXIMJIT-WSDLNYQXSA-N	370.449	3.548	50	40	FHGB	
CC(C)N(C[C@@H]1CCCN(C(=O)CCl)C1)C(=O)OCc1ccccc1	79412045	DFMLXMAHFFHGKC-QGZVFWFLSA-N	366.889	3.511	50	40	FHGB	
COc1cccc2cc(C(=O)N/N=C/c3ccc(N4CCCC4)cc3)oc12	408962576	ZKTTUKOAJSJTOA-HYARGMPZSA-N	363.417	3.806	50	40	FHGB	
O=C(N/N=C\c1ccc(Sc2ncccn2)o1)c1cccc(Cl)c1	409150057	ZGAQKYBAEWPFBL-JMIUGGIZSA-N	358.810	3.638	50	40	FHGB	
CCOc1ccc2ccccc2c1/C=N/NC(=O)[C@H](C#N)c1ccccc1	409204099	BBCCQKSAHFUULO-IERINAHZSA-N	357.413	3.996	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C/c1cccc(Cl)c1	1073929	RAPOPVNPZRQXBM-GIJQJNRQSA-N	367.630	3.875	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)c2ccccc2-n2cccc2)ccc1OC	7889986	KROXWXVDEPEUOG-PXLXIMEGSA-N	363.417	3.649	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)c2cc3c(s2)CC[C@H](C)C3)c(O)c1	3380774	NPLUNRJFMMORCP-DQAKUKQTSA-N	358.463	3.741	50	40	FHGB	
N#CCC(=O)N/N=C/c1ccc(-c2ccc(Br)c(Cl)c2)o1	4513432	KVONGBGOQHIOSP-QGMBQPNBSA-N	366.602	3.726	50	40	FHGB	
C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)N[C@@H](C)CC)cc1OCC	408812202	CQCTZNYVSOIPOD-NCPSJORJSA-N	360.841	3.572	50	40	FHGB	
COc1ccc2ccc(OC)c(/C=C(/C#N)C(=O)NC3CCCC3)c2c1	409192049	TXAADRRCOZKYSC-PTNGSMBKSA-N	350.418	3.823	50	40	FHGB	
CCOC(=O)c1c(C)[nH]c(C(=O)/C(C#N)=C/c2cc(F)ccc2F)c1C	40139678	CJTCJWZEWYOUEY-NTUHNPAUSA-N	358.344	3.876	50	40	FHGB	
O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1c[nH]c2ccccc12	3242040	GZCJDGRVJXNUQA-YSURURNPSA-N	360.339	3.749	50	40	FHGB	
CCOc1ccc(/C=N/NC(=O)[C@@H](C)Oc2cc(C)cc(C)c2)cc1OC	12412084	RBMSJJQFZBQKRO-QLPFJNHISA-N	370.449	3.628	50	40	FHGB	
N#CCOc1ccc(/C=N/NC(=O)CSCc2ccccc2Cl)cc1	59472802	OIGDHEIXVXJGFY-SRZZPIQSSA-N	373.865	3.626	50	40	FHGB	
Cc1ccc(C(=O)NNC(=O)c2sccc2-c2ccc(F)cc2)s1	65897287	PYMQXWMVUVEAJE-UHFFFAOYSA-N	360.435	3.999	50	40	FHGB	
CCOc1ccc(NC(=O)CCC(=O)N/N=C(/C)CCc2ccco2)cc1	5953645	IKEMXVKUUJUQAG-JCMHNJIXSA-N	371.437	3.522	50	40	FHGB	
CCCCOc1ccc(-c2cc(C(=O)N/N=C/c3ccco3)[nH]n2)cc1	18148535	RSMLPRVEIVGEKW-DEDYPNTBSA-N	352.394	3.613	50	40	FHGB	
CCOc1ccc(Cl)cc1/C=N/NC(=O)COc1c(C)cccc1C	408916037	TZKCTASIQGRFPJ-SRZZPIQSSA-N	360.841	3.885	50	40	FHGB	
CCOc1c(Cl)cc(/C=N\NC(=O)Cc2ccc(F)cc2)cc1OC	409231588	LMGSBGHCVASUKU-NHDPSOOVSA-N	364.804	3.579	50	40	FHGB	
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1cc([N+](=O)[O-])ccc1Cl	2603427	TZLPCXJHSZSNTD-OAHLLOKOSA-N	373.796	3.699	50	40	FHGB	
Cc1cc(OCC(=O)N/N=C/c2cn(C)c3ccccc23)cc(C)c1Cl	30937401	YBFYJLJSUOXJKH-LSHDLFTRSA-N	369.852	3.978	50	40	FHGB	
COc1ccc(N2C(S)=C(C#N)C(=O)N[C@@H]2c2ccccc2Cl)cc1	818296	LJZBJRJEKSGVBL-INIZCTEOSA-N	371.849	3.649	50	40	FHGB	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	727797	KZRNUDBSEWVHCN-UHFFFAOYSA-N	360.841	3.612	50	40	FHGB	
COCCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1	34888316	ASQQNIGCSADYRZ-JXAWBTAJSA-N	373.412	3.636	50	40	FHGB	
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]	59473274	PAIZWAIKHFUDDZ-VDCVXVNISA-N	363.826	3.879	50	40	FHGB	
C/C(=N\NC(=O)Cc1cn2ccsc2n1)c1ccc(C(C)(C)C)cc1	5070640	QRQNHBWPTNGGLG-FYJGNVAPSA-N	354.479	3.776	50	40	FHGB	
CC[C@@H](C)Oc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1OC	4544642	LMVOLFGGGBYNQW-GHONEHJGSA-N	369.396	3.647	50	40	FHGB	
C=CCc1cc(/C=N\NC(=O)c2cc3ccccc3o2)ccc1OCC#N	408853342	RGCPXXWDTVBUFS-UCQKPKSFSA-N	359.385	3.828	50	40	FHGB	
CS/C(=C(\C#N)S(=O)(=O)c1cc(C)ccc1C)N1CCCCC1	40478943	HWRINOBYZHPHDC-WUKNDPDISA-N	350.509	3.619	50	40	FHGB	
CCOc1cccc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)c1OC	3617405	QIGNDBWSDAKYFT-SFQUDFHCSA-N	357.431	3.741	50	40	FHGB	
O=C(CCCC[C@@H]1CCSS1)Nc1cnn(CC2CCOCC2)c1	218230705	ITUDGMKPDIGQRN-MRXNPFEDSA-N	369.556	3.962	50	40	FHGB	
O=C(NNC(=O)c1cc2c(F)cccc2s1)c1cc2c(s1)CCC2	21781984	LAPMMXGEYAYPBG-UHFFFAOYSA-N	360.435	3.665	50	40	FHGB	
Cc1n[nH]c2c1[C@@H](c1ccccc1OCc1ccccc1)C(C#N)=C(N)O2	857444	ZGYRYSRQEIBTRQ-IBGZPJMESA-N	358.401	3.515	50	40	FHGB	
O=C(N/N=C/c1cn[nH]c1-c1ccccc1)NC12CC3CC(CC(C3)C1)C2	8973083	MWNKONMTGUODKM-YDZHTSKRSA-N	363.465	3.679	50	40	FHGB	
Cn1nc(-c2ccccc2)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2	253406837	VBNXIVVZKXRYEE-IBGZPJMESA-N	374.444	3.538	50	40	FHGB	
CCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(N(CC)CC)cc2)C1=O	16638802	OBSUGBUYJLDTFT-RGEXLXHISA-N	365.477	3.925	50	40	FHGB	
CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccco2)sc2c1CCCC2	904414	UKLKUOOMRZWLPR-ZRDIBKRKSA-N	370.430	3.942	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(Cl)cc1	3270740	LUVUONSIJGSPBP-SSZFMOIBSA-N	367.836	3.722	50	40	FHGB	
CCOc1cccc(/C=N/NC(=O)c2c(-c3ccccc3)noc2C)c1O	4721580	UQKVRCNOKQRDFE-CIAFOILYSA-N	365.389	3.518	50	40	FHGB	
Cc1ccc(/C(=N/NC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1	30831103	LBYPITTZUPRCDO-ZHZULCJRSA-N	351.284	3.600	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@H]1C[C@H]1c1ccccc1	84525432	RWLQMNWECRZJKB-XJPUKHNYSA-N	352.478	3.544	50	40	FHGB	
O=C(O)c1ccc(Cl)c(-c2ccc(/C=N\NC(=O)c3ccco3)o2)c1	409067472	YFWPNPFAFNLMCU-OCKHKDLRSA-N	358.737	3.655	50	40	FHGB	
FC(F)(Br)C(F)(F)[C@H](Br)CBr	2555209	CUYGTVOLVMBWLF-UWTATZPHSA-N	366.772	3.768	50	40	FHGB	
CCOC(=O)C(C#N)=C1C=C(C)N(c2ccc(OC)cc2[N+](=O)[O-])C(C)=C1	4188391	NGOSEVLXLAPQBX-UHFFFAOYSA-N	369.377	3.614	50	40	FHGB	
CC(C)Cc1ccc(-c2n[nH]c3c2[C@H](c2cccnc2)C(C#N)=C(N)O3)cc1	5130101	NQKDGPIQGRZZNH-GOSISDBHSA-N	371.444	3.888	50	40	FHGB	
CCOc1cc(/C=N\NC(=O)c2ccc(Cl)cc2)cc(Cl)c1O	30817643	SSBJIUABDHXSIE-OCKHKDLRSA-N	353.205	3.862	50	40	FHGB	
CCOc1ccc(/C=N\NC(=O)c2c(C)n(C)c3ccc(OC)cc23)cc1	33350907	FLCFDRASWJPVHY-XKZIYDEJSA-N	365.433	3.658	50	40	FHGB	
CCCCc1sc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1[N+](=O)[O-]	5421422	RGWHIXHIXYZUKQ-QGZVFWFLSA-N	371.418	3.923	50	40	FHGB	
C/C(=N\NC(=O)c1ccc(N(C)C)cc1)c1cccc(Br)c1	5893862	WLIHGLOAGBOLAW-XDHOZWIPSA-N	360.255	3.669	50	40	FHGB	
CCc1n[nH]c2c1[C@H](c1ccc(OCc3ccccc3)cc1)C(C#N)=C(N)O2	987538	IPWGJESHUYTYHQ-LJQANCHMSA-N	372.428	3.769	50	40	FHGB	
C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1	59473741	VQOKHENGULTBMR-HPAYWCODSA-N	363.826	3.879	50	40	FHGB	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C1=C(Cl)CCCC1	73271394	BSZZTXMZJFQWGD-UHFFFAOYSA-N	350.890	3.807	50	40	FHGB	
Cc1cc(C)c(OCC(=O)N/N=C\c2cccs2)c(Br)c1	20100977	UWNHQRDSDXEUGM-IUXPMGMMSA-N	367.268	3.657	50	40	FHGB	
COc1ccccc1NC(=O)N/N=C\c1cccc(OC)c1OC(C)C	409009099	BJBIIAJLZBNPDV-NDENLUEZSA-N	357.410	3.647	50	40	FHGB	
C#CCOc1ccc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc1OCC	409051987	HMBSQPDWQJRYKE-LPYMAVHISA-N	370.836	3.823	50	40	FHGB	
O=C(N/N=C\C=C\c1ccccc1)C(O)(c1ccccc1)c1ccccc1	33918654	VPINZUCWRRSDEY-JBNYACDMSA-N	356.425	3.738	50	40	FHGB	
CCc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC#N)c(OC)c2)cc1	3570437	YOUZPAJWQPQWMF-SFQUDFHCSA-N	361.401	3.706	50	40	FHGB	
Cc1ccc(N(N=Cc2cccc(C(=O)O)c2)C(=O)C(F)(F)F)c(C)c1	575241118	YPCOBSWQCXGVEZ-UHFFFAOYSA-N	364.323	3.931	50	40	FHGB	
COc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)ccc1OC(C)C	4576185	CEEYDADIAIEQAZ-CPNJWEJPSA-N	364.445	3.748	50	40	FHGB	
O=C(CCSc1ccc(Cl)cc1)N/N=C/c1ccccc1C(=O)O	4519828	DLBXDRYHMDOYCW-YBFXNURJSA-N	362.838	3.671	50	40	FHGB	
CC(=O)N/N=C/c1c(Br)c(C)n(-c2c(C)cccc2C)c1C	20243817	HNBUEZRAWCOPPT-DJKKODMXSA-N	362.271	3.943	50	40	FHGB	
Cc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc(N2CCOCC2)o1	408794168	HTLPVXFIVQLRGR-GXDHUFHOSA-N	371.824	3.624	50	40	FHGB	
C[C@]12CCCC[C@H]1[C@@H]2C(=O)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1	408869870	ULOGQHROLVIHKQ-LAGLJQQHSA-N	366.417	3.921	50	40	FHGB	
CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(O)c(OCC)c2)c1	408741939	OIMBOLYFEDRZQR-XNTDXEJSSA-N	352.390	3.735	50	40	FHGB	
Cc1cc(SCC(=O)N/N=C/c2ccccc2O)nc2c(C)cccc12	871036	WPRKPUMOHSAYJB-SRZZPIQSSA-N	365.458	3.800	50	40	FHGB	
C/C(CC(=O)Nc1cccc2c1CCCC2)=N\NC(=O)Cc1ccccc1	100522887	NAPWRBYOAMCPJD-LFVJCYFKSA-N	363.461	3.629	50	40	FHGB	
S=c1nc[nH]c2c1ncn2-c1ccc(N(CCCl)CCCl)cc1	1657440	GEAXDNOMRGDWSA-UHFFFAOYSA-N	368.293	3.762	50	40	FHGB	
COc1cc(C(=O)[C@@H](C)Br)ccc1OC(=O)c1ccccc1	2044992	RNWCQJRROAWTEQ-LLVKDONJSA-N	363.207	3.881	50	40	FHGB	
N#C/C(=C\c1ccc(O)c(Br)c1)C(=O)Nc1ccccc1F	23723625	XOQLQQYWPWKIBX-YRNVUSSQSA-N	361.170	3.839	50	40	FHGB	
COc1cccc(/C=C(\C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1	408891374	PPEDTDVCXJQTTQ-KPKJPENVSA-N	357.753	3.802	50	40	FHGB	
Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2)cc1C	211257227	SZLBKVLSCXBKAU-RGEXLXHISA-N	361.445	3.686	50	40	FHGB	
Cn1nc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1-c1ccccc1	253395312	BTSHKRSEUIKGED-IBGZPJMESA-N	374.444	3.538	50	40	FHGB	
O=C(CCl)N1N=C(c2ccccc2)C[C@H]1c1cccc2nccnc12	72314721	DGVUQOIRXYABFV-KRWDZBQOSA-N	350.809	3.546	50	40	FHGB	
Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1-c1cccc(Cl)c1	3335332	SODDPRWQPWMJFF-WSDLNYQXSA-N	352.825	3.906	50	40	FHGB	
Cc1c(C(=O)Nc2ccc(SC#N)cc2)nnn1-c1ccccc1F	4938649	CHOSTYYIEYTGOS-UHFFFAOYSA-N	353.382	3.540	50	40	FHGB	
CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccs4)c32)cc1	5408577	JGJQYLVNXZZSAV-OAHLLOKOSA-N	364.430	3.755	50	40	FHGB	
C[C@H](NC(=O)CCCC[C@@H]1CCSS1)c1nnc2ccccn12	52971990	HVAWQCMGQSSHOC-QWHCGFSZSA-N	350.513	3.621	50	40	FHGB	biogenic
CCn1cc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)c2ccccc21	96476598	CHHJEKCXSAREOQ-ATVHPVEESA-N	359.429	3.893	50	40	FHGB	
Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2/CCc3ccccc32)c1Cl	105484909	NEFJTYCRILMVAR-NKVSQWTQSA-N	369.639	3.704	50	40	FHGB	
N#C/C(=C/c1ccc(N2CCCC2)c(F)c1)C(=O)Nc1ccc(O)cc1	107897851	VIOPYLFTBIOFBO-PTNGSMBKSA-N	351.381	3.677	50	40	FHGB	
N#C/C(=C/c1cccn1-c1cccc(C(=O)O)c1)c1ccc(C(=O)O)cc1	408542233	IKHGMAQXAGWLAW-ATVHPVEESA-N	358.353	3.938	50	40	FHGB	
Cc1ccc(CC(=O)N/N=C/c2ccc(OC(=O)c3ccccc3)cc2)cc1	408736994	FYKBEFOZYACMRL-LFVJCYFKSA-N	372.424	3.907	50	40	FHGB	
Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)CNc2ccccc2)c1C	409376147	VCCZBSVIYNNTCC-ZVHZXABRSA-N	360.461	3.965	50	40	FHGB	
Cc1ccccc1N1C(S)=C(C#N)C(=O)N[C@@H]1c1ccc(Cl)cc1	645036	VDZDLSMDZPGBEV-INIZCTEOSA-N	355.850	3.948	50	40	FHGB	
N#C/C(=C/c1ccc(Sc2ccc(Cl)cc2)c([N+](=O)[O-])c1)C(N)=O	6883435	AOHPJMANSYBACF-XFFZJAGNSA-N	359.794	3.792	50	40	FHGB	
COc1ccc(C2=C/C(=C(\C#N)C(=O)NC3CC3)c3cc(C)ccc3O2)cc1	35681496	WIVAHCRBSIZZFT-ZZEZOPTASA-N	372.424	3.993	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CCCC[C@@H]1C(F)(F)F	44835744	WMMVCUUZWLBFQR-NJVMCNKBSA-N	372.431	3.719	50	40	FHGB	
O=C(N/N=C/C(c1ccccc1)c1ccccc1)[C@@H]1COc2ccccc2O1	5752485	VNFRXQVSBAIFIJ-NMWDDECMSA-N	372.424	3.761	50	40	FHGB	
CCc1ccc(NC(=O)/C(C#N)=C\c2ccc(O[C@@H](C)C(=O)O)cc2)cc1	408853461	TVPDDJWOMOCNJM-VMOJBDSFSA-N	364.401	3.647	50	40	FHGB	
COc1cccc2cc(C(=O)N/N=C/c3ccc(Br)o3)oc12	408971782	QGJRLBAVLXGGOV-CAOOACKPSA-N	363.167	3.561	50	40	FHGB	
CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(CCC[C@H]2C)[C@H]1c1ccccc1	35193576	BECKUTVKDLBRRL-JSVDNDDVSA-N	361.445	3.710	50	40	FHGB	
O=C(N/N=C/c1ccc(OCc2ccc(F)cc2)cc1)c1ccccc1O	3112638	WSBLZGSXWSZKGU-YDZHTSKRSA-N	364.376	3.874	50	40	FHGB	
O=C(N/N=C/c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1ccccc1	5128148	NZYZBCIPTOQESX-CIAFOILYSA-N	362.345	3.546	50	40	FHGB	
Cc1ccc([C@H]2CC(=O)NC(SCC(=O)c3ccccc3)=C2C#N)cc1	8973435	FCACBQDWZZWVGY-QGZVFWFLSA-N	362.454	3.950	50	40	FHGB	
C[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3F)[C@H]2C1	13739055	QBQKOQFOCNSULL-GEWABHDNSA-N	350.372	3.804	50	40	FHGB	
COc1cc(/C=N/NC(C)=O)cc(Cl)c1OCc1ccc(F)cc1	58822674	CGZCIGMIVHXEKB-AWQFTUOYSA-N	350.777	3.537	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C\c1cccc(Br)n1)c1ccccc1	96306264	VFUAJMPDXIRPKO-XTCQQWIJSA-N	356.223	3.628	50	40	FHGB	in-vitro
COc1ccc(OC)c(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)c1	409118847	OQAZLVSUMYFERX-PVGUKEHMSA-N	358.463	3.643	50	40	FHGB	
N#Cc1ccccc1-c1ccc(/C=N/NC(=O)CNc2ccc(F)cc2)o1	409347217	NHBRGXUQYNEGNN-WYMPLXKRSA-N	362.364	3.520	50	40	FHGB	
O=C(CSCc1cccc(Br)c1)N/N=C/c1ccccc1	4714605	LUAUFZBNTMCVJH-VCHYOVAHSA-N	363.280	3.833	50	40	FHGB	
CC(C)CC(=O)N/N=C1/C(=O)N(Cc2ccc(Cl)cc2)c2ccccc21	5444109	IBOWHTFTCGDRIR-FCDQGJHFSA-N	369.852	3.753	50	40	FHGB	
O=C(N[C@@H](NC(=O)c1ccc(Cl)cc1)C(Cl)Cl)c1ccccc1	5601651	WKEHNTLDEGHCEY-AWEZNQCLSA-N	371.651	3.630	50	40	FHGB	
CCCOc1ccc(/C=N/NC(=O)c2ccc(OC)cc2)cc1OCC	8228932	WJHCBTLVBNIICX-KGENOOAVSA-N	356.422	3.647	50	40	FHGB	
COc1ccc(NC(=O)/C(C#N)=C/c2c(Cl)nc3ccccn23)cc1	13141426	CMCNZAZKSXQZKW-ZRDIBKRKSA-N	352.781	3.542	50	40	FHGB	
CCOc1cc(C=C(C#N)C#N)c(Br)c(Br)c1O	59109659	UXENYRAALFXMOE-UHFFFAOYSA-N	372.016	3.746	50	40	FHGB	
O=C(COc1cccc(Cl)c1)N/N=C/c1ccc(Br)cc1	711161	CGXFFMUCDFCVBU-GIJQJNRQSA-N	367.630	3.632	50	40	FHGB	
CCOc1cc(/C=C(\C#N)C(=O)Nc2cccc(OC)c2)cc(Cl)c1O	4704908	RBFIGXHMGPGNQZ-NTUHNPAUSA-N	372.808	3.999	50	40	FHGB	
CCn1c(SCC(=O)N/N=C(/C)c2cccs2)nc2ccccc21	4869624	QVJRYEBNSNSLMS-UNOMPAQXSA-N	358.492	3.750	50	40	FHGB	
N#CC1=C2Nc3ccccc3N2C(=O)N[C@]1(c1ccccc1)C(F)(F)F	4932613	IJZJQLKOTXYARZ-KRWDZBQOSA-N	356.307	3.835	50	40	FHGB	aggregator
O=C(NNc1cccc(Cl)c1)c1nn(-c2ccccc2)c2c1CCC2	30614907	GVMMOBXOGDOUSU-UHFFFAOYSA-N	352.825	3.771	50	40	FHGB	
O=C(CCC(=O)Nc1ccccc1Cl)N/N=C1\CCCc2ccccc21	100008750	MXXZFFBNVSACKE-HAVVHWLPSA-N	369.852	3.916	50	40	FHGB	
COc1ccc(/C=N/NC(=O)[C@H]2[C@@H]3CCCC[C@]32C)cc1Br	100182273	KBHIRKVXQIODMK-XGWXEGNJSA-N	365.271	3.734	50	40	FHGB	
O=C(NNC(=O)[C@@H]1CC1(c1ccccc1)c1ccccc1)C1[C@H]2CCCC[C@H]12	103116862	AZKGMFBPXAUNBU-UFYCRDLUSA-N	374.484	3.576	50	40	FHGB	
N#C/C(=C\c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(C(=O)O)cc1	4508762	VHHIEWPPFFJHAQ-MDWZMJQESA-N	360.291	3.949	50	40	FHGB	
O=C(NN=Cc1c[nH]c2ccccc12)C(O)(c1ccccc1)c1ccccc1	245318942	XSJDNXSXFZDZMT-UHFFFAOYSA-N	369.424	3.554	50	40	FHGB	
C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1ccc(C(C)(C)C)cc1	5288762	BKICEGYVFYSNHX-KWJZBXMYSA-N	352.434	3.664	50	40	FHGB	
Cc1ccc([C@H](Br)[C@@H](Br)C(=O)[C@@]2(C)CO2)cc1	102700605	PQHOXCGXAACSQA-DMDPSCGWSA-N	362.061	3.553	50	40	FHGB	
NNC(=O)c1cc(-c2ccccc2)nc2nc(NC3CCCCC3)sc12	2631697	MYRIOOCTTJKQMW-UHFFFAOYSA-N	367.478	3.706	50	40	FHGB	
C/C(=N\NC(=O)Cc1csc(C)n1)c1ccc(N2CCCCCC2)cc1	6831446	CVFZNBSBVCEHOJ-PXLXIMEGSA-N	370.522	3.915	50	40	FHGB	
CCN1CC=C2[C@H](C1)[C@@H](c1ccc(C(C)C)cc1)C(C#N)=C(N)C2(C#N)C#N	19853253	YAPQBNGFTOKIEC-FPOVZHCZSA-N	371.488	3.555	50	40	FHGB	
Cc1ccc(Cc2ccc(C(=O)NN)n2Cc2ccc(Cl)cc2)cc1	226030036	CDDICJLVDVAWGQ-UHFFFAOYSA-N	353.853	3.693	50	40	FHGB	
C=CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC)cc2)cc1	408795111	KZMCLBUIXXLXIE-GHRIWEEISA-N	362.385	3.584	50	40	FHGB	
COc1ccc(Br)cc1C(=O)N/N=C/c1ccc(Cl)s1	408968258	XPYBGVGYPQMZBX-FRKPEAEDSA-N	373.659	3.937	50	40	FHGB	
CCCCOc1ccc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)cc1OC	409198556	HUOIUIJSXNOKDW-MMTNMYCKSA-N	365.433	3.632	50	40	FHGB	
C#CCOc1ccc([N+](=O)[O-])cc1/C=C(/C#N)Cn1cnc2ccccc21	408691651	KJTYXTRCYBAEEB-GDNBJRDFSA-N	358.357	3.564	50	40	FHGB	
O=C(CCl)Nc1ccc(CCc2ccc(NC(=O)CCl)cc2)cc1	670430463	NBOAUYSIKMMIAP-UHFFFAOYSA-N	365.260	3.826	50	40	FHGB	
CCc1ccc(OCC(=O)N/N=C/c2cccs2)c(Br)c1	1280985	ODSGCFMFGYKODV-RQZCQDPDSA-N	367.268	3.602	50	40	FHGB	
COc1ccc(CC(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc1OC	4735409	NJZZSHZAIRHLJJ-KEBDBYFISA-N	367.232	3.703	50	40	FHGB	
C=CCNC(=O)/C(C#N)=C/c1c(C)nn(-c2ccc(Cl)cc2)c1Cl	5860122	WYWWNEKHUPOBTJ-FMIVXFBMSA-N	361.232	3.697	50	40	FHGB	
COc1ccc(/C=C/C(=O)N/N=C/c2cccc(Br)c2)cc1	1098707	IZQKHBOZRVUZGA-PFPWIQQFSA-N	359.223	3.621	50	40	FHGB	
C/C=C1/C[N+]2(CCCC)CC[C@]34C(=C(C=O)[C@H]1C[C@@H]32)Nc1c(O)cccc14	12654274	PMVPZDGAMARLPF-XPBYFYITSA-O	365.497	3.878	50	40	FHGB	
CCOc1cc(/C=N/NC(=O)Cc2cccc3ccccc23)ccc1OC	5464280	HGITWZPUMLYFRM-HZHRSRAPSA-N	362.429	3.940	50	40	FHGB	
CN(C)c1ccc(-n2cccc2/C=C(\C#N)C(=O)NC2CCCCC2)cc1	4083536	FRXJILQMZQRSCR-BMRADRMJSA-N	362.477	3.899	50	40	FHGB	
Cc1nc2ccccc2n1CC(=O)NN=C1c2ccccc2-c2ccccc21	7993505	OZLXVPXRMCEAJX-UHFFFAOYSA-N	366.424	3.894	50	40	FHGB	
COc1ccc(/C(C)=N/NC(=O)[C@H](C)SCc2ccccc2)cc1OC	20249062	ZPJPUCKVDIMNID-HBBMIWKISA-N	372.490	3.866	50	40	FHGB	
C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1OCC	409132236	PBHNWLWSFSMXNE-HXUWFJFHSA-N	364.401	3.574	50	40	FHGB	
O=C(CCC(=O)c1ccc2c(c1)OCCCO2)NNc1cccc(Cl)c1	30613856	WLWIBPHMTKHUBO-UHFFFAOYSA-N	374.824	3.608	50	40	FHGB	
COc1ccccc1NC(=O)/C(C#N)=C\c1cc([N+](=O)[O-])ccc1Cl	207865029	CKYOACIVGUBNNS-WQLSENKSSA-N	357.753	3.802	50	40	FHGB	
C=CCOc1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc1OC	409055503	ZAQKNFQFEHMIKQ-CIAFOILYSA-N	358.825	3.986	50	40	FHGB	
O=C(CSSCC(=O)Nc1ccccc1F)Nc1ccccc1F	1806511	HQZPKYATTRFOQU-UHFFFAOYSA-N	368.430	3.923	50	40	FHGB	
O=C(Cc1coc2ccc3ccccc3c12)NNC(=O)c1ccccc1F	3410180	AEASTCGHZOPAOI-UHFFFAOYSA-N	362.360	3.729	50	40	FHGB	
C#CCOc1ccc2ccccc2c1/C=C(\C#N)C(=O)NCc1ccco1	4506732	MCSKUWSPCXSRQA-GHRIWEEISA-N	356.381	3.668	50	40	FHGB	
O=C(N/N=C/c1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1)c1ccco1	14407606	MGMUIIXLLKKFPO-UDWIEESQSA-N	365.345	3.531	50	40	FHGB	
COc1cc(/C=N\NC(=O)c2ccco2)ccc1OCc1ccccc1	100314037	QFHPRIZRMDDZFE-BKUYFWCQSA-N	350.374	3.631	50	40	FHGB	
O=C(NN=C(c1ccccc1)c1ccccc1)/C(O)=C/C(=O)c1ccccc1	100670987	KNMVSFBQVJEQGT-PGMHBOJBSA-N	370.408	3.880	50	40	FHGB	
C[C@]12CCCC[C@@H]1[C@@H]2C(=O)N/N=C\c1ccc(-c2cccc(C(=O)O)c2)o1	408718723	BUZLFKLDRLRPRL-NOCFGBSFSA-N	366.417	3.921	50	40	FHGB	
C#CCOc1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc1OCC	409052712	JFUXEFCEEWEEFG-LPYMAVHISA-N	370.836	3.823	50	40	FHGB	
O=C(CCSc1ccccc1)NN=C1CCN(Cc2ccccc2)CC1	409339654	KCKUOCRCJPQYNS-UHFFFAOYSA-N	367.518	3.937	50	40	FHGB	
COc1ccc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)cc1Br	409379603	YJPBENCCIYCGEM-ZSOIEALJSA-N	374.238	3.553	50	40	FHGB	
Cc1oc(C)c2c(=O)ccc3c(c12)OC(N)=C(C#N)[C@@H]3c1cccs1	5427564	VAKAKLFHKPVLAG-QGZVFWFLSA-N	350.399	3.690	50	40	FHGB	
Cc1ccc(/C(C#N)=C/c2cc(Br)ccc2OCC(N)=O)cc1	408580932	SMJSOFDWCNEJDZ-OVCLIPMQSA-N	371.234	3.686	50	40	FHGB	
Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(C(C)(C)C)cc2)n1	8336681	FINGKUSKFOOBLK-RGVLZGJSSA-N	356.495	3.633	50	40	FHGB	
O=C1/C(=N/NC(=O)c2ccccc2[N+](=O)[O-])c2ccccc2-c2ccccc21	101414691	PRRUPFQGRWBXHV-ZBJSNUHESA-N	371.352	3.592	50	40	FHGB	
C/C(=N\NC(=O)c1c(-c2ccccc2)noc1C)c1ccc(C(=O)O)s1	1005649	YMEPTRDFVLTCCT-VXLYETTFSA-N	369.402	3.564	50	40	FHGB	
COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccc(C)cc1	989065	SJAFVYBCNOVBEO-HXUWFJFHSA-N	372.428	3.716	50	40	FHGB	
O=C(OC[C@@H](Br)CBr)c1ccccc1Cl	1676102	LLYXWJQLCPTCNB-ZETCQYMHSA-N	356.441	3.655	50	40	FHGB	
C[C@@H](NC(=O)/C(C#N)=C/c1cc2c(cc1Cl)OCO2)c1ccccc1	2759547	PMJBWHGRKYYKAJ-IWTIEGKHSA-N	354.793	3.853	50	40	FHGB	
CC[C@H](Br)C(=O)NCCC(=O)Nc1ccc(C(C)(C)C)cc1	8733157	UJMPXUQYRWVJDB-AWEZNQCLSA-N	369.303	3.602	50	40	FHGB	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CCCC[C@H]1C(F)(F)F	44835747	WMMVCUUZWLBFQR-JWINVHKUSA-N	372.431	3.719	50	40	FHGB	
O=C(COc1ccccc1)N/N=C\c1ccccc1OCc1ccccc1	95935872	IGLFWXKXOCQKFZ-HAHDFKILSA-N	360.413	3.795	50	40	FHGB	
COc1ccccc1C(=O)C(Br)C(=O)c1ccccc1OC	100784189	TVHHEOOATVXOLP-UHFFFAOYSA-N	363.207	3.533	50	40	FHGB	
CC1(C)[C@]2(C)CC[C@]1(C(=O)NC1CCCCC1)[C@H](Br)C2=O	100834613	VKMWSCRLAWWBDN-CSMYWGQOSA-N	356.304	3.594	50	40	FHGB