COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1	ZINC000000670365	31/13/95/219311395	VVYBOPRFGIFZSH-UHFFFAOYSA-N	0	350.396	FE	2.463	1	Anodyne	mid	FEAAMN	COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1	aggregator
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1	ZINC000000670365	31/13/94/219311394	VVYBOPRFGIFZSH-UHFFFAOYSA-N	-1	350.396	FE	2.463	0	Anodyne	ref	FEAARM	COc1ccc(OC)c([N-]S(=O)(=O)c2ccc(NC(C)=O)cc2)c1	aggregator
COC(=O)CCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000000670547	33/24/17/539332417	QPYUXPFHBOENOJ-UHFFFAOYSA-N	0	368.455	FE	2.143	0	Anodyne	ref	FEAARN	COC(=O)CCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	 
COc1ccc(C(=O)NC[C@H]2CCCO2)cc1I	ZINC000000670840	94/09/61/203940961	XOJRNBXOEFLJCX-SNVBAGLBSA-N	0	361.179	FE	2.209	0	Anodyne	ref	FEAARN	COc1ccc(C(=O)NC[C@H]2CCCO2)cc1I	 
COc1ccc(C(=O)NC[C@@H]2CCCO2)cc1I	ZINC000000670842	26/11/36/210261136	XOJRNBXOEFLJCX-JTQLQIEISA-N	0	361.179	FE	2.209	0	Anodyne	ref	FEAARN	COc1ccc(C(=O)NC[C@@H]2CCCO2)cc1I	 
Cc1cccc(C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000000670936	33/21/94/539332194	HOSMYGTTWQJPRQ-UHFFFAOYSA-N	0	360.435	FE	2.268	0	Anodyne	ref	FEAARN	Cc1cccc(C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	 
Cc1ccccc1C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000000670938	33/20/77/539332077	BHZCTULLYLZNRH-UHFFFAOYSA-N	0	360.435	FE	2.268	0	Anodyne	ref	FEAARN	Cc1ccccc1C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	 
O=C(O)c1ccccc1C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000000671015	31/14/96/219311496	HFYPVJXWZFFJPG-UHFFFAOYSA-N	-1	374.418	FE	2.422	0	Anodyne	ref	FEAARM	O=C([O-])c1ccccc1C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	 
O=C(COc1ccccc1)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000000671019	31/16/10/219311610	WKJQDRYXHWXZCI-UHFFFAOYSA-N	0	360.435	FE	2.489	0	Anodyne	ref	FEAARN	O=C(COc1ccccc1)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	aggregator
CCCC(=O)Nc1ccc(C(=O)NN2C(=O)c3ccccc3C2=O)cc1	ZINC000000671461	33/23/93/539332393	HAUONJKKLIRVOI-UHFFFAOYSA-N	0	351.362	FE	2.366	0	Anodyne	ref	FEAARN	CCCC(=O)Nc1ccc(C(=O)NN2C(=O)c3ccccc3C2=O)cc1	 
COc1ccc(C(=O)N2CCN(C(=O)c3ccc(OC)cc3)CC2)cc1	ZINC000000671724	26/14/57/210261457	GKNXDHDZKCBZCO-UHFFFAOYSA-N	0	354.406	FE	2.302	0	Anodyne	ref	FEAARN	COc1ccc(C(=O)N2CCN(C(=O)c3ccc(OC)cc3)CC2)cc1	 
N#CC(C#N)=NNc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1	ZINC000000672235	31/13/17/219311317	ISAKPYHGYGZBBA-UHFFFAOYSA-N	0	351.391	FE	2.253	0	Mild	ref	FEEARN	N#CC(C#N)=NNc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1	 
CCOC(=O)/C(=N/Nc1ccc(I)cc1)C(C)=O	ZINC000000672260	33/21/10/539332110	HQMNXIAEGPJHLP-RVDMUPIBSA-N	0	360.151	FE	2.211	0	Mild	ref	FEEARN	CCOC(=O)C(=NNc1ccc(I)cc1)C(C)=O	 
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000000673714	31/20/47/219312047	TZSWKFDILSRYEF-UHFFFAOYSA-N	0	365.367	FE	2.363	1	Bother	mid	FEBAMN	COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(NC(C)=O)cc1	 
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000000673714	31/20/43/219312043	TZSWKFDILSRYEF-UHFFFAOYSA-N	-1	365.367	FE	2.363	0	Bother	ref	FEBARM	COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(NC(C)=O)cc1	 
CCC(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000000675623	33/21/96/539332196	MKCQSXQPZFPWFT-UHFFFAOYSA-N	0	369.512	FE	2.474	0	Anodyne	ref	FEAARN	CCC(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	 
COC(=O)CCC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1	ZINC000000676466	33/23/45/539332345	ZETRQADVANYVQF-UHFFFAOYSA-N	0	368.455	FE	2.189	0	Anodyne	ref	FEAARN	COC(=O)CCC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1	 
CC(=O)NC(=S)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1	ZINC000000677226	33/22/10/539332210	DHBIMAHHEZVXLX-UHFFFAOYSA-N	0	355.485	FE	2.13	0	Anodyne	ref	FEAARN	CC(=O)NC(=S)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1	 
CC(C)CC(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000000677241	33/23/38/539332338	UIPSCZODVCHHMY-UHFFFAOYSA-N	0	369.512	FE	2.33	0	Anodyne	ref	FEAARN	CC(C)CC(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	 
NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Br)cc1	ZINC000000704431	31/46/99/219314699	SNGDBDZKVUOQHR-UHFFFAOYSA-N	0	355.213	FE	2.349	0	Anodyne	ref	FEAARN	NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Br)cc1	 
COc1cc(/C=N/N2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])cc1OC	ZINC000000705245	33/22/83/539332283	CNHZVOIXPJPJEY-GIJQJNRQSA-N	0	355.306	FE	2.242	0	Mild	ref	FEEARN	COc1cc(/C=N/N2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])cc1OC	 
COc1ccccc1C(=O)N1CCN(C(=O)c2ccccc2OC)CC1	ZINC000000831040	27/77/06/210277706	RBJXGDPSZKCJAU-UHFFFAOYSA-N	0	354.406	FE	2.302	0	Anodyne	ref	FEAARN	COc1ccccc1C(=O)N1CCN(C(=O)c2ccccc2OC)CC1	 
O=C(NC[C@H]1CCCO1)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000000852568	33/52/17/539335217	ZQVIWXMFSHNVSR-OAHLLOKOSA-N	0	350.374	FE	2.396	0	Anodyne	ref	FEAARN	O=C(NC[C@H]1CCCO1)c1cccc(N2C(=O)c3ccccc3C2=O)c1	 
O=C(NC[C@@H]1CCCO1)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000000852569	28/07/18/210280718	ZQVIWXMFSHNVSR-HNNXBMFYSA-N	0	350.374	FE	2.396	0	Anodyne	ref	FEAARN	O=C(NC[C@@H]1CCCO1)c1cccc(N2C(=O)c3ccccc3C2=O)c1	 
Cc1cc(C)n(/N=C2/C(=O)Nc3ccc(Br)cc32)c(=O)c1C#N	ZINC000000936072	33/59/74/539335974	GNGHJEBLBIOYQO-UHFFFAOYSA-N	0	371.194	FE	2.304	0	Mild	ref	FEEARN	Cc1cc(C)n(/N=C2/C(=O)Nc3ccc(Br)cc32)c(=O)c1C#N	 
Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000000946450	33/63/26/539336326	LPTAMPXEWJNOPD-UHFFFAOYSA-N	0	354.815	FE	2.313	0	Anodyne	ref	FEAARN	Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(S(N)(=O)=O)cc1	 
CC(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000001003767	33/68/21/539336821	HEJQUCLKXXQNQG-UHFFFAOYSA-N	0	355.485	FE	2.084	0	Anodyne	ref	FEAARN	CC(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	 
O=C(NC(=S)Nc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCC1	ZINC000001003838	33/72/18/539337218	HTUAPMAGSJOKDQ-UHFFFAOYSA-N	0	367.496	FE	2.084	0	Anodyne	ref	FEAARN	O=C(NC(=S)Nc1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCC1	 
CN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)/C=C/C(=O)O)cc1	ZINC000001003990	33/72/00/539337200	XNHBAEMIWPWXAU-VAWYXSNFSA-N	-1	360.391	FE	2.091	0	Anodyne	ref	FEAARM	CN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)/C=C/C(=O)[O-])cc1	 
CC(C)C(=O)Nc1ccc(C(=O)NN2C(=O)c3ccccc3C2=O)cc1	ZINC000001049478	35/86/02/219358602	ZZGZKQOYUVLUQS-UHFFFAOYSA-N	0	351.362	FE	2.222	0	Anodyne	ref	FEAARN	CC(C)C(=O)Nc1ccc(C(=O)NN2C(=O)c3ccccc3C2=O)cc1	 
COc1cc(C(=O)NC(=S)NCc2ccco2)cc(OC)c1OC	ZINC000001057227	31/00/49/210310049	GVEHFRJJZJPJEI-UHFFFAOYSA-N	0	350.396	FE	2.11	0	Anodyne	ref	FEAARN	COc1cc(C(=O)NC(=S)NCc2ccco2)cc(OC)c1OC	 
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)cc1	ZINC000001063468	36/15/47/219361547	GFDNVPYRZKKDBP-LSDHHAIUSA-N	-1	368.455	FE	2.203	0	Anodyne	ref	FEAARM	CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])cc1	 
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)cc1	ZINC000001063469	36/17/27/219361727	GFDNVPYRZKKDBP-HUUCEWRRSA-N	-1	368.455	FE	2.203	0	Anodyne	ref	FEAARM	CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])cc1	 
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)O)cc1	ZINC000001063471	31/14/01/210311401	GFDNVPYRZKKDBP-GJZGRUSLSA-N	-1	368.455	FE	2.203	0	Anodyne	ref	FEAARM	CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])cc1	 
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)cc1	ZINC000001063472	36/14/18/219361418	GFDNVPYRZKKDBP-CABCVRRESA-N	-1	368.455	FE	2.203	0	Anodyne	ref	FEAARM	CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])cc1	 
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)CCC(=O)O)cc1	ZINC000001079146	31/52/31/210315231	RAKNRAFXLULLDH-UHFFFAOYSA-N	-1	368.455	FE	2.443	0	Anodyne	ref	FEAARM	CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)CCC(=O)[O-])cc1	 
O=C(O)/C=C/C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000001173102	34/01/17/539340117	DVCBXXKZTPMJQS-MDZDMXLPSA-N	-2	364.354	FE	2.206	3	Anodyne	high	FEAAHL	O=C([O-])/C=C/C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)cc1	 
O=C(O)/C=C/C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000001173102	34/01/14/539340114	DVCBXXKZTPMJQS-MDZDMXLPSA-N	-1	364.354	FE	2.206	0	Anodyne	ref	FEAARM	O=C([O-])/C=C/C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	 
O=C(/C=C/c1ccccc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000001204883	86/82/18/206868218	HMTIRYWZBAFZDT-IZZDOVSWSA-N	0	372.446	FE	2.359	0	Anodyne	ref	FEAARN	O=C(/C=C/c1ccccc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	 
CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1	ZINC000001211902	34/00/44/539340044	DRYUUYJVTKSESH-UHFFFAOYSA-N	-1	361.423	FE	2.429	1	Anodyne	mid	FEAAMM	CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(N(C)C(C)=O)cc2)cc1	 
CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1	ZINC000001211902	34/00/42/539340042	DRYUUYJVTKSESH-UHFFFAOYSA-N	0	361.423	FE	2.429	0	Anodyne	ref	FEAARN	CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1	 
CN(C)S(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000001298473	34/09/09/539340909	DXRTYDJLMIPUNP-UHFFFAOYSA-N	-1	374.871	FE	2.391	1	Anodyne	mid	FEAAMM	CN(C)S(=O)(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1	 
CN(C)S(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000001298473	34/09/03/539340903	DXRTYDJLMIPUNP-UHFFFAOYSA-N	0	374.871	FE	2.391	0	Anodyne	ref	FEAARN	CN(C)S(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1	 
O=C(C[C@H]1C(=O)NCCN1C(=O)C1CCCCC1)OCc1ccccc1	ZINC000001460655	34/22/47/539342247	MIHNUVAZRIQCQR-KRWDZBQOSA-N	0	358.438	FE	2.027	0	Anodyne	ref	FEAARN	O=C(C[C@H]1C(=O)NCCN1C(=O)C1CCCCC1)OCc1ccccc1	 
O=C(C[C@@H]1C(=O)NCCN1C(=O)C1CCCCC1)OCc1ccccc1	ZINC000001460656	00/82/17/204008217	MIHNUVAZRIQCQR-QGZVFWFLSA-N	0	358.438	FE	2.027	0	Anodyne	ref	FEAARN	O=C(C[C@@H]1C(=O)NCCN1C(=O)C1CCCCC1)OCc1ccccc1	 
Cc1cccc(OCC(=O)NC[C@@H](C)NC(=O)COc2cccc(C)c2)c1	ZINC000002132240	37/95/72/210379572	PKDUUNZTDFETQP-QGZVFWFLSA-N	0	370.449	FE	2.382	0	Anodyne	ref	FEAARN	Cc1cccc(OCC(=O)NC[C@@H](C)NC(=O)COc2cccc(C)c2)c1	 
Cc1cccc(OCC(=O)NC[C@H](C)NC(=O)COc2cccc(C)c2)c1	ZINC000002132242	34/48/68/539344868	PKDUUNZTDFETQP-KRWDZBQOSA-N	0	370.449	FE	2.382	0	Anodyne	ref	FEAARN	Cc1cccc(OCC(=O)NC[C@H](C)NC(=O)COc2cccc(C)c2)c1	 
CCC(=O)NC(=S)Nc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1	ZINC000002135652	34/50/81/539345081	SINIWXRQPOLLQC-UHFFFAOYSA-N	0	368.44	FE	2.007	2	Anodyne	low	FEAALN	CCC(=O)NC(=S)Nc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1	 
CCC(=O)NC(=S)Nc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1	ZINC000002135652	34/50/76/539345076	SINIWXRQPOLLQC-UHFFFAOYSA-N	-1	368.44	FE	2.007	0	Anodyne	ref	FEAARM	CCC(=O)NC(=S)Nc1ccc(S(=O)(=O)[N-]c2cc(C)on2)cc1	 
Cc1ccc(OCC(=O)NCCCNC(=O)COc2ccc(C)cc2)cc1	ZINC000002136097	37/99/71/210379971	GPCQHZFSGHEHHO-UHFFFAOYSA-N	0	370.449	FE	2.384	0	Anodyne	ref	FEAARN	Cc1ccc(OCC(=O)NCCCNC(=O)COc2ccc(C)cc2)cc1	 
Cc1cccc(OCC(=O)NCCCNC(=O)COc2cccc(C)c2)c1	ZINC000002136100	37/94/55/210379455	LCYBAGLCYZCKAA-UHFFFAOYSA-N	0	370.449	FE	2.384	0	Anodyne	ref	FEAARN	Cc1cccc(OCC(=O)NCCCNC(=O)COc2cccc(C)c2)c1	 
Cc1ccccc1OCC(=O)NCCCNC(=O)COc1ccccc1C	ZINC000002136104	02/74/11/204027411	VPQQWJFMQYQZNI-UHFFFAOYSA-N	0	370.449	FE	2.384	0	Anodyne	ref	FEAARN	Cc1ccccc1OCC(=O)NCCCNC(=O)COc1ccccc1C	 
CCN(CC)S(=O)(=O)c1ccc(NC(=S)NC(=O)C2CCC2)cc1	ZINC000002136367	37/95/40/210379540	ANGUYRQKNMEYQC-UHFFFAOYSA-N	0	369.512	FE	2.33	0	Anodyne	ref	FEAARN	CCN(CC)S(=O)(=O)c1ccc(NC(=S)NC(=O)C2CCC2)cc1	 
CC(C)(C)NS(=O)(=O)c1ccc(NC(=S)NC(=O)C2CCC2)cc1	ZINC000002136375	34/50/62/539345062	IRIZOPHLYJUKDA-UHFFFAOYSA-N	0	369.512	FE	2.377	0	Anodyne	ref	FEAARN	CC(C)(C)NS(=O)(=O)c1ccc(NC(=S)NC(=O)C2CCC2)cc1	 
C=CCN(CC=C)C(=S)NC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000002136584	34/61/35/539346135	CCCDTDVJMPPVCG-UHFFFAOYSA-N	0	350.44	FE	2.401	0	Mild	ref	FEEARN	C=CCN(CC=C)C(=S)NC(=O)c1cc(OC)c(OC)c(OC)c1	 
CC(C)C(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000002137053	42/87/07/219428707	JSLHNEPCBNTHIN-UHFFFAOYSA-N	0	369.512	FE	2.33	0	Anodyne	ref	FEAARN	CC(C)C(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	 
CCN(CC)S(=O)(=O)c1ccc(NC(=S)NC(=O)C(C)C)cc1	ZINC000002137063	34/60/75/539346075	WBKTWLBGICMJFU-UHFFFAOYSA-N	0	357.501	FE	2.186	0	Anodyne	ref	FEAARN	CCN(CC)S(=O)(=O)c1ccc(NC(=S)NC(=O)C(C)C)cc1	 
CC(C)C(=O)NC(=S)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1	ZINC000002137081	38/07/92/210380792	DVAVXIYVPULRRE-UHFFFAOYSA-N	0	357.501	FE	2.232	0	Anodyne	ref	FEAARN	CC(C)C(=O)NC(=S)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1	 
C=CCN(CC=C)S(=O)(=O)c1ccc(NC(=S)NC(=O)CC)cc1	ZINC000002137147	34/57/31/539345731	PSTOTUMTQOQYSS-UHFFFAOYSA-N	0	367.496	FE	2.272	0	Mild	ref	FEEARN	C=CCN(CC=C)S(=O)(=O)c1ccc(NC(=S)NC(=O)CC)cc1	 
O=C(COc1ccc([N+](=O)[O-])cc1)NC(=S)NCCc1ccccc1	ZINC000002546317	34/87/73/539348773	NUXBVRKMIOCPRL-UHFFFAOYSA-N	0	359.407	FE	2.207	0	Bother	ref	FEBARN	O=C(COc1ccc([N+](=O)[O-])cc1)NC(=S)NCCc1ccccc1	 
O=C(COc1ccccc1)Nc1nonc1NC(=O)COc1ccccc1	ZINC000002697847	05/23/98/204052398	VHPAAFSLZFXBJZ-UHFFFAOYSA-N	0	368.349	FE	2.105	0	Anodyne	ref	FEAARN	O=C(COc1ccccc1)Nc1nonc1NC(=O)COc1ccccc1	aggregator
CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)c2cccs2)cc1	ZINC000002700614	05/23/29/204052329	VORHNHLKAWILNF-UHFFFAOYSA-N	0	369.493	FE	2.125	0	Anodyne	ref	FEAARN	CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)c2cccs2)cc1	 
CCCCC(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000002869253	06/42/36/204064236	YVYJSZBRTAGNIZ-UHFFFAOYSA-N	0	369.512	FE	2.474	0	Anodyne	ref	FEAARN	CCCCC(=O)NC(=S)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	 
CCOC(=O)CNC(=O)COc1ccc(Cl)cc1Br	ZINC000002872185	35/58/20/539355820	VVDGDKKOBQKBAD-UHFFFAOYSA-N	0	350.596	FE	2.161	0	Anodyne	ref	FEAARN	CCOC(=O)CNC(=O)COc1ccc(Cl)cc1Br	 
O=C(Nc1ccc(S(=O)(=O)NCc2ccco2)cc1)c1ccncc1	ZINC000003373533	36/42/89/539364289	YXLVYQLWZTXCJO-UHFFFAOYSA-N	0	357.391	FE	2.405	0	Anodyne	ref	FEAARN	O=C(Nc1ccc(S(=O)(=O)NCc2ccco2)cc1)c1ccncc1	 
O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1	ZINC000004019339	53/46/36/219534636	TUGXODAQEQOHAK-UHFFFAOYSA-N	-1	354.428	FE	2.101	0	Anodyne	ref	FEAARM	O=C([O-])CCC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1	 
CCOC(=O)CCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000004170628	37/84/34/539378434	YZYXWVHNMVXFEJ-UHFFFAOYSA-N	0	368.455	FE	2.143	0	Anodyne	ref	FEAARN	CCOC(=O)CCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	 
CN1CCN(C(=O)c2ccccc2NC(=O)COc2ccccc2)CC1	ZINC000004195842	37/82/90/539378290	PIJOSIUIXDLINX-UHFFFAOYSA-N	1	353.422	FE	2.092	2	Anodyne	low	FEAALO	C[NH+]1CCN(C(=O)c2ccccc2NC(=O)COc2ccccc2)CC1	 
CN1CCN(C(=O)c2ccccc2NC(=O)COc2ccccc2)CC1	ZINC000004195842	37/82/84/539378284	PIJOSIUIXDLINX-UHFFFAOYSA-N	0	353.422	FE	2.092	0	Anodyne	ref	FEAARN	CN1CCN(C(=O)c2ccccc2NC(=O)COc2ccccc2)CC1	 
C[C@@H](CNC(=O)c1ccccc1[N+](=O)[O-])NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000004523829	58/33/32/219583332	KRVQXPSXJYPOQM-NSHDSACASA-N	0	372.337	FE	2.051	0	Bother	ref	FEBARN	C[C@@H](CNC(=O)c1ccccc1[N+](=O)[O-])NC(=O)c1ccccc1[N+](=O)[O-]	 
C[C@H](CNC(=O)c1ccccc1[N+](=O)[O-])NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000004523831	38/73/62/539387362	KRVQXPSXJYPOQM-LLVKDONJSA-N	0	372.337	FE	2.051	0	Bother	ref	FEBARN	C[C@H](CNC(=O)c1ccccc1[N+](=O)[O-])NC(=O)c1ccccc1[N+](=O)[O-]	 
O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000004523833	14/39/25/204143925	UYXFMZOYTZMHFC-UHFFFAOYSA-N	-2	366.37	FE	2.43	3	Anodyne	high	FEAAHL	O=C([O-])CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)cc1	 
O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000004523833	14/39/21/204143921	UYXFMZOYTZMHFC-UHFFFAOYSA-N	-1	366.37	FE	2.43	0	Anodyne	ref	FEAARM	O=C([O-])CCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	 
COc1ccccc1OCC(=O)NC(=S)Nc1cccc([N+](=O)[O-])c1	ZINC000004676149	55/05/66/210550566	YWZXRJOWVRVCEK-UHFFFAOYSA-N	0	361.379	FE	2.495	0	Bother	ref	FEBARN	COc1ccccc1OCC(=O)NC(=S)Nc1cccc([N+](=O)[O-])c1	 
COc1ccccc1/C=C/C(=O)NC(=S)Nc1ccccc1C(N)=O	ZINC000004734397	39/10/49/539391049	ROSUIDQWZNIQRN-ZHACJKMWSA-N	0	355.419	FE	2.32	0	Anodyne	ref	FEAARN	COc1ccccc1/C=C/C(=O)NC(=S)Nc1ccccc1C(N)=O	 
O=C(c1ccco1)N1CCN(C(=O)c2ccc(Br)o2)CC1	ZINC000004810694	39/30/92/539393092	CXWXNJJAPSZXBJ-UHFFFAOYSA-N	0	353.172	FE	2.233	0	Anodyne	ref	FEAARN	O=C(c1ccco1)N1CCN(C(=O)c2ccc(Br)o2)CC1	 
C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000006182942	42/28/80/539422880	NXSDYYVEWVZUAL-NSHDSACASA-N	0	372.337	FE	2.051	0	Bother	ref	FEBARN	C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)NC(=O)c1cccc([N+](=O)[O-])c1	 
C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000006183546	42/28/53/539422853	NXSDYYVEWVZUAL-LLVKDONJSA-N	0	372.337	FE	2.051	0	Bother	ref	FEBARN	C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)NC(=O)c1cccc([N+](=O)[O-])c1	 
CC(=O)NC(=S)Nc1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	ZINC000006511094	25/10/93/204251093	IDGOHOMPHCKRLM-UHFFFAOYSA-N	0	369.512	FE	2.473	0	Anodyne	ref	FEAARN	CC(=O)NC(=S)Nc1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	 
CC(C)(C)C(=O)NC(=S)Nc1ccccc1C(=O)NC[C@@H]1CCCO1	ZINC000006857294	17/32/51/207173251	BHRHBTWCIMVZSR-LBPRGKRZSA-N	0	363.483	FE	2.455	0	Anodyne	ref	FEAARN	CC(C)(C)C(=O)NC(=S)Nc1ccccc1C(=O)NC[C@@H]1CCCO1	 
CC(C)(C)C(=O)NC(=S)Nc1ccccc1C(=O)NC[C@H]1CCCO1	ZINC000006857295	43/95/80/539439580	BHRHBTWCIMVZSR-GFCCVEGCSA-N	0	363.483	FE	2.455	0	Anodyne	ref	FEAARN	CC(C)(C)C(=O)NC(=S)Nc1ccccc1C(=O)NC[C@H]1CCCO1	 
O=C(NC(=S)NCCCO)c1ccccc1OCCOc1ccccc1	ZINC000008158643	47/86/06/539478606	YQNUTNGLMFKHBB-UHFFFAOYSA-N	0	374.462	FE	2.131	0	Anodyne	ref	FEAARN	O=C(NC(=S)NCCCO)c1ccccc1OCCOc1ccccc1	 
O=C(NC(=S)Nc1ccccc1C(=O)N1CCOCC1)c1ccccc1	ZINC000008435941	23/43/81/207234381	GVZIEXMLWZBRTR-UHFFFAOYSA-N	0	369.446	FE	2.286	0	Anodyne	ref	FEAARN	O=C(NC(=S)Nc1ccccc1C(=O)N1CCOCC1)c1ccccc1	 
CS(=O)(=O)c1ccc2nc(NC(=O)Cc3cccs3)sc2c1	ZINC000008974224	49/55/77/539495577	QMMLTHKTPGAOFU-UHFFFAOYSA-N	0	352.462	FE	2.943	0	Anodyne	ref	FEAARN	CS(=O)(=O)c1ccc2[nH]c(=NC(=O)Cc3cccs3)sc2c1	 
O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	ZINC000009268481	49/92/43/539499243	CYSUIINROVMDJX-KRWDZBQOSA-N	0	374.462	FE	2.325	0	Anodyne	ref	FEAARN	O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	 
O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	ZINC000009268483	49/97/00/539499700	CYSUIINROVMDJX-QGZVFWFLSA-N	0	374.462	FE	2.325	0	Anodyne	ref	FEAARN	O=C(Cc1ccccc1)Nc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	 
COC(=O)c1ccc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1	ZINC000010454369	30/09/50/207300950	RMSOQTLSROAMSH-UHFFFAOYSA-N	0	368.389	FE	2.198	0	Anodyne	ref	FEAARN	COC(=O)c1ccc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1	 
CCOC(=O)CCC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000012137280	34/12/70/207341270	XDLGAYDTMIOJOD-UHFFFAOYSA-N	0	359.791	FE	2.404	0	Bother	ref	FEBARN	CCOC(=O)CCC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1Cl	 
CCCOC(=O)CCC(=O)NC(=S)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000012137461	34/16/67/207341667	BSCHGLRJHDNOHW-UHFFFAOYSA-N	-1	369.399	FE	2.15	3	Bother	high	FEBAHM	CCCOC(=O)CCC(=O)NC(=S)[N-]c1ccc(OC)cc1[N+](=O)[O-]	 
CCCOC(=O)CCC(=O)NC(=S)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000012137461	34/16/63/207341663	BSCHGLRJHDNOHW-UHFFFAOYSA-N	0	369.399	FE	2.15	0	Bother	ref	FEBARN	CCCOC(=O)CCC(=O)NC(=S)Nc1ccc(OC)cc1[N+](=O)[O-]	 
O=C(CCC(=O)OCCc1ccccc1)NC(=S)NCc1ccco1	ZINC000012137508	54/62/05/539546205	FYOBBYZGOHSKSG-UHFFFAOYSA-N	0	360.435	FE	2.336	0	Anodyne	ref	FEAARN	O=C(CCC(=O)OCCc1ccccc1)NC(=S)NCc1ccco1	 
Cc1ccc(OCC(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1	ZINC000012138275	54/59/12/539545912	BFVAKQUDABVIPD-UHFFFAOYSA-N	0	354.406	FE	2.485	0	Anodyne	ref	FEAARN	Cc1ccc(OCC(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1	 
COCCNC(=O)c1cccc(NC(=O)COc2ccccc2OC)c1	ZINC000012138471	54/56/77/539545677	IUGBEQWWJPAHDX-UHFFFAOYSA-N	0	358.394	FE	2.089	0	Anodyne	ref	FEAARN	COCCNC(=O)c1cccc(NC(=O)COc2ccccc2OC)c1	 
COCCNC(=O)c1ccc(NC(=O)COc2ccccc2OC)cc1	ZINC000012138473	54/61/19/539546119	OLHXHBCKARXAGH-UHFFFAOYSA-N	0	358.394	FE	2.089	0	Anodyne	ref	FEAARN	COCCNC(=O)c1ccc(NC(=O)COc2ccccc2OC)cc1	 
COCCCNC(=O)c1ccc(NC(=O)c2ccccc2C(=O)O)cc1	ZINC000012138590	54/55/92/539545592	MAAGKEWXPQRFAH-UHFFFAOYSA-N	-1	356.378	FE	2.403	0	Anodyne	ref	FEAARM	COCCCNC(=O)c1ccc(NC(=O)c2ccccc2C(=O)[O-])cc1	 
O=C(NC[C@@H]1CCCO1)c1ccc(NC(=S)NC(=O)c2ccco2)cc1	ZINC000012138694	95/79/02/219957902	HZHYHEUQQHFRCV-AWEZNQCLSA-N	0	373.434	FE	2.315	0	Anodyne	ref	FEAARN	O=C(NC[C@@H]1CCCO1)c1ccc(NC(=S)NC(=O)c2ccco2)cc1	 
O=C(NC[C@H]1CCCO1)c1ccc(NC(=S)NC(=O)c2ccco2)cc1	ZINC000012138695	54/58/87/539545887	HZHYHEUQQHFRCV-CQSZACIVSA-N	0	373.434	FE	2.315	0	Anodyne	ref	FEAARN	O=C(NC[C@H]1CCCO1)c1ccc(NC(=S)NC(=O)c2ccco2)cc1	 
O=C(NC(=S)Nc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1	ZINC000012138696	54/59/08/539545908	OEPHFERUCSNESM-UHFFFAOYSA-N	0	369.446	FE	2.286	0	Anodyne	ref	FEAARN	O=C(NC(=S)Nc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1	 
COCCNC(=O)c1ccc(NC(=S)NC(=O)c2cccc(C)c2)cc1	ZINC000012138704	54/55/67/539545567	RSCYTLFOODFXEO-UHFFFAOYSA-N	0	371.462	FE	2.498	0	Anodyne	ref	FEAARN	COCCNC(=O)c1ccc(NC(=S)NC(=O)c2cccc(C)c2)cc1	 
O=C(NC[C@@H]1CCCO1)c1cccc(NC(=S)NC(=O)c2ccco2)c1	ZINC000012138705	54/55/83/539545583	IGYCVDYXJLADJP-AWEZNQCLSA-N	0	373.434	FE	2.315	0	Anodyne	ref	FEAARN	O=C(NC[C@@H]1CCCO1)c1cccc(NC(=S)NC(=O)c2ccco2)c1