smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(C)cc(C[C@H](CC(=O)[O-])C(=O)Nc2ccc([N+](=O)[O-])cc2)c1	ZINC000005170692	204196214	/nfs/dbraw/zinc/19/62/14/204196214.db2.gz	YLACXLFJEUHPSX-OAHLLOKOSA-N	-1	0	356.378	3.484	50	5		FGBARM
Cc1c(C(=O)[O-])sc2[nH]c(C=Cc3cccc([N+](=O)[O-])c3)nc(=O)c12	ZINC000006627995	204257757	/nfs/dbraw/zinc/25/77/57/204257757.db2.gz	CBWSPJQHFPJMLI-AATRIKPKSA-N	-1	0	357.347	3.070	50	5		FGBARM
O=C1NC(=Cc2ccc([O-])c([N+](=O)[O-])c2)C(=O)N1c1ccc(Cl)cc1	ZINC000033719189	494062845	/nfs/dbraw/zinc/06/28/45/494062845.db2.gz	RYIKFZUACYGPHD-KPKJPENVSA-N	-1	0	359.725	3.051	50	5		FGBARM
COc1ccc(CCCN(C)C(=O)c2ccc([N+](=O)[O-])c([O-])c2)cc1OC	ZINC000012890318	494267958	/nfs/dbraw/zinc/26/79/58/494267958.db2.gz	QJEAXPFICJPDOX-UHFFFAOYSA-N	-1	0	374.393	3.022	50	5		FGBARM
O=C([O-])[C@H]1CS[C@@H](c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)N1	ZINC000000871715	206225025	/nfs/dbraw/zinc/22/50/25/206225025.db2.gz	AATLPWJCAZWWPS-RNCFNFMXSA-N	-1	0	354.771	3.296	50	5		FGBARM
O=C([O-])[C@@H]1CS[C@@H](c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)N1	ZINC000004974174	206239342	/nfs/dbraw/zinc/23/93/42/206239342.db2.gz	AATLPWJCAZWWPS-ZANVPECISA-N	-1	0	354.771	3.296	50	5		FGBARM
COc1ccc(NC(=S)NC(=O)c2ccc(C)cc2C)c([N+](=O)[O-])c1	ZINC000004998604	263337849	/nfs/dbraw/zinc/33/78/49/263337849.db2.gz	QPCPMFPYXILTRK-UHFFFAOYSA-N	-1	0	359.407	3.347	50	5		FGBARM
O=C(Nc1nc(-c2cccc(O)c2)cs1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000173882772	495730352	/nfs/dbraw/zinc/73/03/52/495730352.db2.gz	OOUBPBRSQFBQAQ-UHFFFAOYSA-N	-1	0	357.347	3.382	50	5		FGBARM
Cc1ccc(OCC(=O)Nc2cc(Cl)ccc2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000013843289	204556841	/nfs/dbraw/zinc/55/68/41/204556841.db2.gz	BHDNTVRMAPOQDB-UHFFFAOYSA-N	-1	0	364.741	3.272	50	5		FGBARM
CCC(=O)Nc1cccc([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c1	ZINC000048355599	205160990	/nfs/dbraw/zinc/16/09/90/205160990.db2.gz	IYKPDFJRYNOLBA-UHFFFAOYSA-N	-1	0	363.395	3.053	50	5		FGBARM
O=C([O-])Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1	ZINC000095971410	205800172	/nfs/dbraw/zinc/80/01/72/205800172.db2.gz	SQUUMSSSXQGFSA-UHFFFAOYSA-N	-1	0	369.377	3.074	50	5		FGBARM
O=C([O-])c1ccc(N2CCN(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1	ZINC000004660461	132297647	/nfs/dbraw/zinc/29/76/47/132297647.db2.gz	ULOBGYCTJJNQFG-UHFFFAOYSA-N	-1	0	361.785	3.273	50	5		FGBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2cccc(Br)c2)cc1	ZINC000001187987	493789685	/nfs/dbraw/zinc/78/96/85/493789685.db2.gz	YPDBTGJSVASBPM-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
Cc1ccc(C(=O)NCc2n[n-]c(=S)n2-c2ccccc2)cc1[N+](=O)[O-]	ZINC000013571937	494289475	/nfs/dbraw/zinc/28/94/75/494289475.db2.gz	FRFVGVPPTQTSNA-UHFFFAOYSA-N	-1	0	369.406	3.077	50	5		FGBARM
O=C([O-])C[C@H](c1cc([N+](=O)[O-])ccc1Cl)N1C(=O)c2ccccc2C1=O	ZINC000001304636	203998391	/nfs/dbraw/zinc/99/83/91/203998391.db2.gz	CNGWHVBWTIIPBT-CQSZACIVSA-N	-1	0	374.736	3.060	50	5		FGBARM
CCC(C)(C)c1nnc([N-]C(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])s1	ZINC000002110505	204026708	/nfs/dbraw/zinc/02/67/08/204026708.db2.gz	WJOMETTULQBNOH-UHFFFAOYSA-N	-1	0	365.371	3.294	50	5		FGBARM
Cc1cc(F)ccc1[N-]c1c([N+](=O)[O-])nn(-c2ccc(Cl)cc2)[n+]1[O-]	ZINC000004923235	204176615	/nfs/dbraw/zinc/17/66/15/204176615.db2.gz	JGZOTWUHWPCUBJ-UHFFFAOYSA-N	-1	0	363.736	3.258	50	5		FGBARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000009503861	204372153	/nfs/dbraw/zinc/37/21/53/204372153.db2.gz	RINICWSAPKUZSV-UHFFFAOYSA-N	-1	0	360.750	3.197	50	5		FGBARM
COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ccccc1C(=O)[O-]	ZINC000004661197	206181980	/nfs/dbraw/zinc/18/19/80/206181980.db2.gz	LKNDRDNAYYTYPW-UHFFFAOYSA-N	-1	0	362.363	3.032	50	5		FGBARM
Cc1ccccc1[C@@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000164778343	206240794	/nfs/dbraw/zinc/24/07/94/206240794.db2.gz	ZPGPWOYHLQJKMG-ACJLOTCBSA-N	-1	0	356.378	3.211	50	5		FGBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)Cc1ccc(Cl)cc1	ZINC000002875382	204065240	/nfs/dbraw/zinc/06/52/40/204065240.db2.gz	FRHWDLIPUAUEQU-UHFFFAOYSA-N	-1	0	356.787	3.199	50	5		FGBARM
COc1ccccc1NC(=O)c1ccc(SCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000003020682	204073928	/nfs/dbraw/zinc/07/39/28/204073928.db2.gz	QOJUILDLHHIZEB-UHFFFAOYSA-N	-1	0	362.363	3.032	50	5		FGBARM
O=[N+]([O-])c1ccc([N-]S(=O)(=O)c2ccc(Br)s2)cc1	ZINC000004732703	204159086	/nfs/dbraw/zinc/15/90/86/204159086.db2.gz	XAKPASIXPSBWRB-UHFFFAOYSA-N	-1	0	363.214	3.220	50	5		FGBARM
CC(=O)c1cccc([N-]c2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])c1	ZINC000004757912	204161538	/nfs/dbraw/zinc/16/15/38/204161538.db2.gz	WOLAWRSEQLPQSV-UHFFFAOYSA-N	-1	0	373.756	3.014	50	5		FGBARM
O=C(NC(=S)Nc1cc([N+](=O)[O-])cc(Cl)c1[O-])c1ccccc1	ZINC000004954743	204179169	/nfs/dbraw/zinc/17/91/69/204179169.db2.gz	RIGXBXPAOGDDIG-UHFFFAOYSA-N	-1	0	351.771	3.081	50	5	in-vitro	FGBARM
COc1cc(CN2CCc3c4ccccc4[nH]c3C2)cc([N+](=O)[O-])c1[O-]	ZINC000004990922	204183387	/nfs/dbraw/zinc/18/33/87/204183387.db2.gz	QLYNKIDNQOCXNX-UHFFFAOYSA-N	-1	0	353.378	3.349	50	5		FGBARM
O=C(NC(=S)Nc1cc([N+](=O)[O-])cc(Cl)c1[O-])c1ccc(F)cc1	ZINC000005025259	204185136	/nfs/dbraw/zinc/18/51/36/204185136.db2.gz	HGFKEZHVIBRCLU-UHFFFAOYSA-N	-1	0	369.761	3.220	50	5		FGBARM
Cc1cc(C(=O)NC(=S)Nc2cccc(C(=O)[O-])c2C)ccc1[N+](=O)[O-]	ZINC000002827619	206231113	/nfs/dbraw/zinc/23/11/13/206231113.db2.gz	MGEJHNMCECUOOR-UHFFFAOYSA-N	-1	0	373.390	3.037	50	5		FGBARM
CCOc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C)c([N+](=O)[O-])c1	ZINC000095447949	494974790	/nfs/dbraw/zinc/97/47/90/494974790.db2.gz	UORFDDQZARAMTR-UHFFFAOYSA-N	-1	0	354.359	3.242	50	5		FGBARM
COc1cccc([C@@H](C[N+](=O)[O-])c2c(C)[n-]n(-c3ccccc3)c2=O)c1	ZINC000100848889	495066438	/nfs/dbraw/zinc/06/64/38/495066438.db2.gz	BZVMJEMSBNUIIM-QGZVFWFLSA-N	-1	0	353.378	3.304	50	5		FGBARM
Cc1ccc(-n2c3cc(Cl)ccc3cc3c(=O)[n-]c(=O)nc2-3)cc1C	ZINC000002240296	204030306	/nfs/dbraw/zinc/03/03/06/204030306.db2.gz	NFLYKVHWCZCSIL-UHFFFAOYSA-N	-1	0	351.793	3.449	50	5		FGBARM
O=C([O-])C[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)c1cccc([N+](=O)[O-])c1	ZINC000004580729	204148667	/nfs/dbraw/zinc/14/86/67/204148667.db2.gz	VHBCZRHHJMJHSR-ANCGMVAHSA-N	-1	0	372.421	3.443	50	5		FGBARM
Cc1ccc([N-]S(=O)(=O)c2ccc(Br)cc2)c([N+](=O)[O-])c1	ZINC000005260130	204199323	/nfs/dbraw/zinc/19/93/23/204199323.db2.gz	FOPBPYCNUNCYAU-UHFFFAOYSA-N	-1	0	371.212	3.467	50	5		FGBARM
COc1ccc(S(=O)(=O)[N-]c2ccccc2OC(F)F)cc1[N+](=O)[O-]	ZINC000005127088	206190550	/nfs/dbraw/zinc/19/05/50/206190550.db2.gz	AQNNYOFFTFJNHN-UHFFFAOYSA-N	-1	0	374.321	3.006	50	5		FGBARM
CCc1onc(C)c1[N-]S(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F	ZINC000253425873	497334026	/nfs/dbraw/zinc/33/40/26/497334026.db2.gz	FFMKNKIQGWFMTL-UHFFFAOYSA-N	-1	0	363.754	3.047	50	5		FGBARM
Cc1cccc2sc(NC(=O)c3c(C(=O)[O-])cccc3[N+](=O)[O-])nc21	ZINC000003670675	204110325	/nfs/dbraw/zinc/11/03/25/204110325.db2.gz	YTJYQLAQTUUDFR-UHFFFAOYSA-N	-1	0	357.347	3.463	50	5		FGBARM
CC(C)Oc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000004580848	204148430	/nfs/dbraw/zinc/14/84/30/204148430.db2.gz	YZFQEVJRECTQQB-KRWDZBQOSA-N	-1	0	372.377	3.328	50	5		FGBARM
Cc1cc(Cl)cc([N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1O	ZINC000072301049	205030409	/nfs/dbraw/zinc/03/04/09/205030409.db2.gz	FTILIDOQHMODNA-UHFFFAOYSA-N	-1	0	356.787	3.371	50	5		FGBARM
O=c1oc2ccccc2c([O-])c1[C@@H](C[N+](=O)[O-])c1c[nH]c2ccccc21	ZINC000006062632	206199830	/nfs/dbraw/zinc/19/98/30/206199830.db2.gz	XHXIFJBIZVTSSH-AWEZNQCLSA-N	-1	0	350.330	3.389	50	5		FGBARM
COc1cc(C(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)sc1Br	ZINC000155940106	206222993	/nfs/dbraw/zinc/22/29/93/206222993.db2.gz	DEBBQMAWAOVDMK-UHFFFAOYSA-N	-1	0	373.184	3.385	50	5		FGBARM
O=C(Cn1c2ccccc2c(=O)c2ccccc21)[N-]OCc1ccccc1	ZINC000023040132	206396983	/nfs/dbraw/zinc/39/69/83/206396983.db2.gz	NYTVNHQMQRXAPO-UHFFFAOYSA-N	-1	0	358.397	3.403	50	5		FGBARM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]c1ccc2c(c1)OC(F)(F)O2	ZINC000058381622	493847896	/nfs/dbraw/zinc/84/78/96/493847896.db2.gz	IMMHDHARMRHTNG-UHFFFAOYSA-N	-1	0	372.305	3.026	50	5		FGBARM
O=C([O-])c1cc([N+](=O)[O-])c(Sc2nc3ccccc3o2)c([N+](=O)[O-])c1	ZINC000016545285	494392908	/nfs/dbraw/zinc/39/29/08/494392908.db2.gz	ITZLBNVPHQRZNY-UHFFFAOYSA-N	-1	0	361.291	3.494	50	5		FGBARM
CCOc1ccccc1[N-]S(=O)(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21	ZINC000020491974	494474501	/nfs/dbraw/zinc/47/45/01/494474501.db2.gz	FQEGGWPBUYYMFX-UHFFFAOYSA-N	-1	0	361.379	3.276	50	5		FGBARM
CC(C)(C)c1cc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)no1	ZINC000225443375	497064089	/nfs/dbraw/zinc/06/40/89/497064089.db2.gz	LOVDONDYSQOJLA-UHFFFAOYSA-N	-1	0	359.791	3.335	50	5		FGBARM
Cc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1Br	ZINC000003991774	204116856	/nfs/dbraw/zinc/11/68/56/204116856.db2.gz	NXKKYTWNXWDBGT-UHFFFAOYSA-N	-1	0	371.212	3.467	50	5		FGBARM
O=C([O-])[C@H]1CC=C(Cl)C[C@H]1C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000004918914	204176005	/nfs/dbraw/zinc/17/60/05/204176005.db2.gz	XPYKNMWDXPRBSB-VHSXEESVSA-N	-1	0	359.165	3.420	50	5		FGBARM
CCOC(=O)c1sc(C)c2c1[n-]c(-c1ccc([N+](=O)[O-])cc1)nc2=O	ZINC000009041088	204351847	/nfs/dbraw/zinc/35/18/47/204351847.db2.gz	HDAXHMXNFJIUTE-UHFFFAOYSA-N	-1	0	359.363	3.045	50	5		FGBARM
Cc1cc([O-])c(C2=NCCS[C@H](c3cccc([N+](=O)[O-])c3)C2)c(=O)o1	ZINC000000754501	695535698	/nfs/dbraw/zinc/53/56/98/695535698.db2.gz	TVQTZRMUIMVVAQ-HNNXBMFYSA-N	-1	0	360.391	3.229	50	5		FGBARM
Cc1nc(Sc2c([N+](=O)[O-])cc(C(=O)[O-])cc2[N+](=O)[O-])nc(C)c1C	ZINC000003097269	206956361	/nfs/dbraw/zinc/95/63/61/206956361.db2.gz	MYSUHQMVBRJZAQ-UHFFFAOYSA-N	-1	0	364.339	3.068	50	5		FGBARM
CCc1ccc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])cc1	ZINC000004821951	207051117	/nfs/dbraw/zinc/05/11/17/207051117.db2.gz	QAWSESXDMGNXNA-UHFFFAOYSA-N	-1	0	359.773	3.373	50	5		FGBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])cc1C	ZINC000004822144	207052986	/nfs/dbraw/zinc/05/29/86/207052986.db2.gz	MQBHJMDSSRJKCW-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
CC[C@H](C(=O)[O-])n1cnc2scc(-c3cccc([N+](=O)[O-])c3)c2c1=O	ZINC000001925541	493800628	/nfs/dbraw/zinc/80/06/28/493800628.db2.gz	RVAQVKQUJYNXGA-GFCCVEGCSA-N	-1	0	359.363	3.069	50	5		FGBARM
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@@H](c2ccc(F)cc2)O1	ZINC000170644906	495544952	/nfs/dbraw/zinc/54/49/52/495544952.db2.gz	WGRLUVKWCZTLOL-DIFFPNOSSA-N	-1	0	360.341	3.042	50	5		FGBARM
Cc1c([N+](=O)[O-])cc([N+](=O)[O-])c(Nc2cccc(C(=O)[O-])c2)c1[N+](=O)[O-]	ZINC000100751675	209217134	/nfs/dbraw/zinc/21/71/34/209217134.db2.gz	MXECURMARHTMBM-UHFFFAOYSA-N	-1	0	362.254	3.161	50	5		FGBARM
COc1ccc(NC(=O)CSc2ccccc2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000004727919	207043612	/nfs/dbraw/zinc/04/36/12/207043612.db2.gz	HNEJERAUWLWNPG-UHFFFAOYSA-N	-1	0	362.363	3.032	50	5		FGBARM
Cc1cc(Br)ccc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000001214315	493790207	/nfs/dbraw/zinc/79/02/07/493790207.db2.gz	SFLZNAFCMLLWML-UHFFFAOYSA-N	-1	0	371.212	3.467	50	5		FGBARM
O=C([O-])c1ccc(Br)c(NC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000004499566	493879315	/nfs/dbraw/zinc/87/93/15/493879315.db2.gz	XOFAFTOKSBPRRK-UHFFFAOYSA-N	-1	0	365.139	3.308	50	5		FGBARM
Cc1c(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2C)cccc1C(=O)[O-]	ZINC000006265990	493956174	/nfs/dbraw/zinc/95/61/74/493956174.db2.gz	MDCJOOBWCRPXNK-UHFFFAOYSA-N	-1	0	373.390	3.037	50	5		FGBARM
COc1ccc([N+](=O)[O-])cc1NC(=O)CSc1ccccc1C(=O)[O-]	ZINC000012804361	494261710	/nfs/dbraw/zinc/26/17/10/494261710.db2.gz	PVTIJIBFUFJLMT-UHFFFAOYSA-N	-1	0	362.363	3.032	50	5		FGBARM
CCc1nc2sc([C@H](c3ccc([N+](=O)[O-])cc3)N3CCCC3)c([O-])n2n1	ZINC000022852962	494537982	/nfs/dbraw/zinc/53/79/82/494537982.db2.gz	YLECQBLIXIPPSB-AWEZNQCLSA-N	-1	0	373.438	3.152	50	5		FGBARM
O=C([O-])c1cccc(S(=O)(=O)Nc2cccc3c2cccc3[N+](=O)[O-])c1	ZINC000004980365	207068432	/nfs/dbraw/zinc/06/84/32/207068432.db2.gz	QWOCMXIWQDAIPS-UHFFFAOYSA-N	-1	0	372.358	3.247	50	5		FGBARM
COc1cc(/C=C2/SC(=O)N(CC(C)C)C2=O)cc([N+](=O)[O-])c1[O-]	ZINC000037369915	208178333	/nfs/dbraw/zinc/17/83/33/208178333.db2.gz	AQSCKPDYJRRBPX-WUXMJOGZSA-N	-1	0	352.368	3.001	50	5		FGBARM
O=C([O-])Cn1c(=O)c2ccc3sc4ccccc4c4ccc(c1=O)c2c34	ZINC000095471036	209057630	/nfs/dbraw/zinc/05/76/30/209057630.db2.gz	UGSDGRYLVPRXTM-UHFFFAOYSA-N	-1	0	361.378	3.405	50	5		FGBARM
O=[N+]([O-])c1ccc([N-]S(=O)(=O)c2ccc(Br)cc2)cc1	ZINC000003833027	493857883	/nfs/dbraw/zinc/85/78/83/493857883.db2.gz	BWLFUNQQASJFCD-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
Cc1ccccc1[C@@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000164778584	496632235	/nfs/dbraw/zinc/63/22/35/496632235.db2.gz	ZPGPWOYHLQJKMG-UGSOOPFHSA-N	-1	0	356.378	3.211	50	5		FGBARM
O=C([N-]c1nnc(C(F)(F)F)s1)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000001132111	219376794	/nfs/dbraw/zinc/37/67/94/219376794.db2.gz	GJZHYHATGFORGE-UHFFFAOYSA-N	-1	0	352.681	3.371	50	5		FGBARM
CC1(C)CO[C@@H](c2ccccc2)CN1C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000136876411	209376235	/nfs/dbraw/zinc/37/62/35/209376235.db2.gz	BZQQVSWIDYXCIM-MRXNPFEDSA-N	-1	0	356.378	3.293	50	5		FGBARM
CCc1ccc([N-]c2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])cc1	ZINC000004822845	207052332	/nfs/dbraw/zinc/05/23/32/207052332.db2.gz	IUIONYIBYFSINX-UHFFFAOYSA-N	-1	0	359.773	3.373	50	5		FGBARM
O=C([O-])[C@@H]1CC=C(Cl)C[C@H]1C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000004918920	207062544	/nfs/dbraw/zinc/06/25/44/207062544.db2.gz	XPYKNMWDXPRBSB-NXEZZACHSA-N	-1	0	359.165	3.420	50	5		FGBARM
Cc1ccc(-n2c3cc(Cl)ccc3cc3c(=O)[n-]c(=O)nc2-3)c(C)c1	ZINC000008738714	207246160	/nfs/dbraw/zinc/24/61/60/207246160.db2.gz	FURMOYFOWVMGJG-UHFFFAOYSA-N	-1	0	351.793	3.449	50	5		FGBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(-c3ccc(Cl)cc3)o2)[nH]1	ZINC000032687757	208036236	/nfs/dbraw/zinc/03/62/36/208036236.db2.gz	XAMSWZVALAACFI-ALCCZGGFSA-N	-1	0	359.725	3.468	50	5		FGBARM
COC(=O)[C@H](C)N(C(=O)c1cc([N+](=O)[O-])ccc1[O-])c1c(C)cccc1C	ZINC000055562799	208483877	/nfs/dbraw/zinc/48/38/77/208483877.db2.gz	WLZWMHIKUITGTA-ZDUSSCGKSA-N	-1	0	372.377	3.126	50	5		FGBARM
C[C@@H]1CN(c2ccccc2NC(=O)c2cccc([O-])c2[N+](=O)[O-])C[C@@H](C)O1	ZINC000253419366	132293904	/nfs/dbraw/zinc/29/39/04/132293904.db2.gz	KIDVMPGUTDMFGC-CHWSQXEVSA-N	-1	0	371.393	3.166	50	5		FGBARM
CC(=O)c1ccc([N-]S(=O)(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)cc1	ZINC000020491889	494474636	/nfs/dbraw/zinc/47/46/36/494474636.db2.gz	OEWGODHLFIINFY-UHFFFAOYSA-N	-1	0	359.363	3.080	50	5		FGBARM
COc1ccc([C@@H](C[N+](=O)[O-])c2c(C)[n-]n(-c3ccccc3)c2=O)cc1	ZINC000100848841	495066502	/nfs/dbraw/zinc/06/65/02/495066502.db2.gz	VPFIMAOVCZSZFO-QGZVFWFLSA-N	-1	0	353.378	3.304	50	5		FGBARM
O=c1nc2n(-c3ccc(Cl)c(Cl)c3)c3ccccc3cc-2c(=O)[n-]1	ZINC000000707473	219315216	/nfs/dbraw/zinc/31/52/16/219315216.db2.gz	TZSWIBKXNDTMOW-UHFFFAOYSA-N	-1	0	358.184	3.486	50	5		FGBARM
CCOc1ccc(-c2ccc(C=Cc3[nH]c(=O)[n-]c(=O)c3[N+](=O)[O-])o2)cc1	ZINC000004502397	207022127	/nfs/dbraw/zinc/02/21/27/207022127.db2.gz	PXFWSVNNGGWBOP-VQHVLOKHSA-N	-1	0	369.333	3.213	50	5		FGBARM
CC(=O)c1ccc(-c2ccc(C=Cc3[nH]c(=O)[n-]c(=O)c3[N+](=O)[O-])o2)cc1	ZINC000032690732	208035974	/nfs/dbraw/zinc/03/59/74/208035974.db2.gz	DTIRTOFHTRIFEG-VURMDHGXSA-N	-1	0	367.317	3.017	50	5		FGBARM
Cc1cc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)ccc1Br	ZINC000000805404	493773507	/nfs/dbraw/zinc/77/35/07/493773507.db2.gz	LYVJPHZGXAVXSN-UHFFFAOYSA-N	-1	0	371.212	3.467	50	5		FGBARM
COc1ccccc1[N-]S(=O)(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C	ZINC000003876332	493859255	/nfs/dbraw/zinc/85/92/55/493859255.db2.gz	NKOSCKZDNVRORL-UHFFFAOYSA-N	-1	0	350.396	3.329	50	5		FGBARM
COc1ccc(C(=O)Nc2cc(Cl)ccc2C(=O)[O-])cc1[N+](=O)[O-]	ZINC000004546282	493881687	/nfs/dbraw/zinc/88/16/87/493881687.db2.gz	HQPVEFVCUZVSSE-UHFFFAOYSA-N	-1	0	350.714	3.207	50	5		FGBARM
O=C1c2ccccc2N[C@H](c2ccc([O-])c([N+](=O)[O-])c2)N1C[C@H]1CCCO1	ZINC000022313321	494519349	/nfs/dbraw/zinc/51/93/49/494519349.db2.gz	GHCHVSIOARYUCN-ACJLOTCBSA-N	-1	0	369.377	3.046	50	5		FGBARM
O=C([O-])c1ccccc1Nc1c([N+](=O)[O-])cc([N+](=O)[O-])c2cccnc21	ZINC000004428014	207020153	/nfs/dbraw/zinc/02/01/53/207020153.db2.gz	LEIKYVWGTYCYEB-UHFFFAOYSA-N	-1	0	354.278	3.493	50	5		FGBARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000007708260	207202932	/nfs/dbraw/zinc/20/29/32/207202932.db2.gz	CJPXPXZXAVVREQ-UHFFFAOYSA-N	-1	0	372.786	3.066	50	5		FGBARM
Cc1ccc(-c2cc([N-]S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)n[nH]2)cc1	ZINC000009912687	207289378	/nfs/dbraw/zinc/28/93/78/207289378.db2.gz	SDVKXAPCXXKCHF-UHFFFAOYSA-N	-1	0	372.406	3.403	50	5		FGBARM
O=c1nc2n(-c3cccc(Cl)c3)c3cccc(Cl)c3cc-2c(=O)[n-]1	ZINC000002246077	493803498	/nfs/dbraw/zinc/80/34/98/493803498.db2.gz	BCAQZMZNHADOKP-UHFFFAOYSA-N	-1	0	358.184	3.486	50	5		FGBARM
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000003876417	493859360	/nfs/dbraw/zinc/85/93/60/493859360.db2.gz	DXKLFVCMHQPLSS-UHFFFAOYSA-N	-1	0	369.786	3.007	50	5		FGBARM
O=C([O-])[C@@H]1CS[C@H](c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)N1	ZINC000004974173	493905024	/nfs/dbraw/zinc/90/50/24/493905024.db2.gz	AATLPWJCAZWWPS-TVQRCGJNSA-N	-1	0	354.771	3.296	50	5		FGBARM
Cc1nc2sc([C@H](c3ccc([N+](=O)[O-])cc3)N3CCCCC3)c([O-])n2n1	ZINC000023157568	494554888	/nfs/dbraw/zinc/55/48/88/494554888.db2.gz	VNDHTYIMOZSQQY-AWEZNQCLSA-N	-1	0	373.438	3.288	50	5		FGBARM
CC(C)Oc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000004580847	207029260	/nfs/dbraw/zinc/02/92/60/207029260.db2.gz	YZFQEVJRECTQQB-QGZVFWFLSA-N	-1	0	372.377	3.328	50	5		FGBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)Cc1ccccc1Cl	ZINC000004742290	207044818	/nfs/dbraw/zinc/04/48/18/207044818.db2.gz	ZBDJZDNTZHRFCP-UHFFFAOYSA-N	-1	0	356.787	3.199	50	5		FGBARM
Cc1cccc(NC(=O)c2nc[n-]c2C(=O)Nc2ccccc2[N+](=O)[O-])c1	ZINC000008683311	207240062	/nfs/dbraw/zinc/24/00/62/207240062.db2.gz	UJLWFZLSSCSBHX-UHFFFAOYSA-N	-1	0	365.349	3.131	50	5		FGBARM
C[C@@H]1CN(c2ccccc2NC(=O)c2cccc([O-])c2[N+](=O)[O-])C[C@H](C)O1	ZINC000253419363	132293708	/nfs/dbraw/zinc/29/37/08/132293708.db2.gz	KIDVMPGUTDMFGC-BETUJISGSA-N	-1	0	371.393	3.166	50	5		FGBARM
CC(=O)c1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1ccc2c(c1)CCC2	ZINC000253428033	497333709	/nfs/dbraw/zinc/33/37/09/497333709.db2.gz	GNKBZQNSJRZDFZ-UHFFFAOYSA-N	-1	0	360.391	3.087	50	5		FGBARM
O=[N+]([O-])c1ccc(COP(=O)([O-])OCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000001594293	206889417	/nfs/dbraw/zinc/88/94/17/206889417.db2.gz	JSPSCIMSQMTXFU-UHFFFAOYSA-N	-1	0	368.238	3.337	50	5	in-vitro	FGBARM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C)c(Cl)c1	ZINC000007708223	207203789	/nfs/dbraw/zinc/20/37/89/207203789.db2.gz	BLGMPHZDLQXMDO-UHFFFAOYSA-N	-1	0	356.787	3.366	50	5		FGBARM
CN(C)c1c(Cl)cccc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000045774095	208337711	/nfs/dbraw/zinc/33/77/11/208337711.db2.gz	FRWXLJXZBBNBGU-UHFFFAOYSA-N	-1	0	355.803	3.115	50	5		FGBARM
O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CCN(CC2CC2)c2ccccc21	ZINC000170599193	132264527	/nfs/dbraw/zinc/26/45/27/132264527.db2.gz	GHEFZHAGENGRPQ-UHFFFAOYSA-N	-1	0	353.378	3.177	50	5		FGBARM
O=C([O-])c1cccc(Nc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc32)c1	ZINC000004428013	219574970	/nfs/dbraw/zinc/57/49/70/219574970.db2.gz	YLZGNCPGJRPFQG-UHFFFAOYSA-N	-1	0	354.278	3.493	50	5		FGBARM
O=[N+]([O-])c1ccc([O-])cc1CN1CCN(C/C=C/c2ccccc2)CC1	ZINC000019609095	211239375	/nfs/dbraw/zinc/23/93/75/211239375.db2.gz	BHJQZKDVSRCJAS-QPJJXVBHSA-N	-1	0	353.422	3.131	50	5		FGBARM
COc1cc([C@@H]2Nc3ccccc3C(=O)N2C2CC2)cc([N+](=O)[O-])c1[O-]	ZINC000022130628	220377320	/nfs/dbraw/zinc/37/73/20/220377320.db2.gz	UTBOOHJGVUODTP-QGZVFWFLSA-N	-1	0	355.350	3.038	50	5		FGBARM
O=c1c2sc3ccc([N+](=O)[O-])cc3c2[n-]c(=S)n1C[C@H]1CCCO1	ZINC000102724888	570836554	/nfs/dbraw/zinc/83/65/54/570836554.db2.gz	UJOJMEUNUPRFLZ-SECBINFHSA-N	-1	0	363.420	3.361	50	5		FGBARM
COc1cc([N+](=O)[O-])ccc1NC(=O)CC1(CC(=O)[O-])CCCCC1	ZINC000005505104	210106596	/nfs/dbraw/zinc/10/65/96/210106596.db2.gz	IFZBXUYOJDWVJF-UHFFFAOYSA-N	-1	0	350.371	3.357	50	5		FGBARM
Cc1cccc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])c1C	ZINC000004822116	210567238	/nfs/dbraw/zinc/56/72/38/210567238.db2.gz	SIFJQRSFOZENNI-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
O=C(NCCCSc1ccc(F)cc1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000095427667	494974710	/nfs/dbraw/zinc/97/47/10/494974710.db2.gz	IQFWBEMXKZHZPM-UHFFFAOYSA-N	-1	0	350.371	3.352	50	5		FGBARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000004517299	210536286	/nfs/dbraw/zinc/53/62/86/210536286.db2.gz	LAPUOPKWYOOCKL-OAHLLOKOSA-N	-1	0	370.321	3.092	50	5	biogenic,in-vitro	FGBARM
O=C([O-])CCC(=O)N1N=C(c2ccccc2)C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000000867588	210284904	/nfs/dbraw/zinc/28/49/04/210284904.db2.gz	WFOSEASVKFXYAB-QGZVFWFLSA-N	-1	0	367.361	3.137	50	5		FGBARM
O=C([O-])CSc1nnc(-c2ccc([N+](=O)[O-])cc2)n1-c1ccccc1	ZINC000002661400	493815241	/nfs/dbraw/zinc/81/52/41/493815241.db2.gz	PJISSMDVXZIZEW-UHFFFAOYSA-N	-1	0	356.363	3.019	50	5		FGBARM
O=[N+]([O-])c1cccc([N-]S(=O)(=O)c2cccc(Br)c2)c1	ZINC000006315821	493958510	/nfs/dbraw/zinc/95/85/10/493958510.db2.gz	IKXXAPZIFWACAI-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
Cc1ccc(F)c(S(=O)(=O)[N-]c2ccc3cc([N+](=O)[O-])ccc3n2)c1	ZINC000084147570	494052131	/nfs/dbraw/zinc/05/21/31/494052131.db2.gz	HXAKJBPDQDXWSZ-UHFFFAOYSA-N	-1	0	361.354	3.391	50	5		FGBARM
CCOC(=O)c1ccc(NC(=O)/C=C/c2cc([N+](=O)[O-])ccc2[O-])cc1	ZINC000035349217	494075167	/nfs/dbraw/zinc/07/51/67/494075167.db2.gz	RWCUBAQSCUKCPO-BJMVGYQFSA-N	-1	0	356.334	3.129	50	5		FGBARM
O=C([O-])c1cc(Br)ccc1NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000004833845	219611598	/nfs/dbraw/zinc/61/15/98/219611598.db2.gz	QHMSZJAYSOQYNX-UHFFFAOYSA-N	-1	0	365.139	3.308	50	5		FGBARM
Cc1c(Cl)cc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1[N+](=O)[O-]	ZINC000013195095	220061029	/nfs/dbraw/zinc/06/10/29/220061029.db2.gz	YWCLAHZMMKOMBQ-UHFFFAOYSA-N	-1	0	370.770	3.056	50	5		FGBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ccc(Cc3ccncc3)cc2)cc1	ZINC000002817964	493820955	/nfs/dbraw/zinc/82/09/55/493820955.db2.gz	FOTOPSAFOYISDD-UHFFFAOYSA-N	-1	0	369.402	3.381	50	5		FGBARM
Cc1cc(C)cc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])c1	ZINC000004822387	493894522	/nfs/dbraw/zinc/89/45/22/493894522.db2.gz	BZDYLTMEJNLAGS-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
O=[N+]([O-])c1nn(-c2ccc(Cl)cc2)[n+]([O-])c1[N-]c1ccccc1Cl	ZINC000004922963	493901014	/nfs/dbraw/zinc/90/10/14/493901014.db2.gz	YSHKDOBPPMHZKN-UHFFFAOYSA-N	-1	0	366.164	3.464	50	5		FGBARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000005126399	493914227	/nfs/dbraw/zinc/91/42/27/493914227.db2.gz	MEIBIYQQCDWZNP-UHFFFAOYSA-N	-1	0	372.786	3.066	50	5		FGBARM
Cc1ccc([N+](=O)[O-])cc1[N-]c1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000104229303	210107413	/nfs/dbraw/zinc/10/74/13/210107413.db2.gz	WPBZUGDUFCXWPV-UHFFFAOYSA-N	-1	0	363.242	3.371	50	5		FGBARM
O=C([O-])[C@H]1CCCN1c1nc2ccc([N+](=O)[O-])cc2c(-c2ccccc2)n1	ZINC000000889800	210286811	/nfs/dbraw/zinc/28/68/11/210286811.db2.gz	KHZHXXAKYKPGCN-MRXNPFEDSA-N	-1	0	364.361	3.258	50	5		FGBARM
CCC(=O)N(C(=O)c1c(C(=O)[O-])cccc1[N+](=O)[O-])c1ccccc1C	ZINC000005710650	493940326	/nfs/dbraw/zinc/94/03/26/493940326.db2.gz	MLPZONWKSYSIED-UHFFFAOYSA-N	-1	0	356.334	3.185	50	5		FGBARM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1ccc(Br)cc1	ZINC000001226890	210337313	/nfs/dbraw/zinc/33/73/13/210337313.db2.gz	SOHBTEQKNABZAP-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
O=C([O-])c1ccccc1N1C(=O)c2cccc3c([N+](=O)[O-])ccc(c32)C1=O	ZINC000003045356	132384773	/nfs/dbraw/zinc/38/47/73/132384773.db2.gz	MVCXDTPJHCXZOR-UHFFFAOYSA-N	-1	0	362.297	3.247	50	5		FGBARM
O=C([O-])C[C@H](NC(=O)Cc1cccs1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686995	493886765	/nfs/dbraw/zinc/88/67/65/493886765.db2.gz	WLMPUGNHHVMOTG-ZDUSSCGKSA-N	-1	0	368.798	3.184	50	5		FGBARM
COc1ccc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2OC)cc1Cl	ZINC000005051231	493910593	/nfs/dbraw/zinc/91/05/93/493910593.db2.gz	MVVZSFONKHEODJ-UHFFFAOYSA-N	-1	0	372.786	3.066	50	5		FGBARM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1OC(F)F	ZINC000007708723	494037500	/nfs/dbraw/zinc/03/75/00/494037500.db2.gz	LYTDLDKUGKBEHD-UHFFFAOYSA-N	-1	0	374.321	3.006	50	5		FGBARM
CN(Cc1nc(=O)c2sccc2[n-]1)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000024868210	494673212	/nfs/dbraw/zinc/67/32/12/494673212.db2.gz	WYOBHRWRLLUPET-UHFFFAOYSA-N	-1	0	364.814	3.178	50	5		FGBARM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]c2cnn(C(C)(C)C)c2)c1	ZINC000095460475	494976911	/nfs/dbraw/zinc/97/69/11/494976911.db2.gz	UQSQRZSXXILVFB-UHFFFAOYSA-N	-1	0	372.834	3.309	50	5		FGBARM
O=C(NCc1nc(-c2ccccc2)cs1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000096013676	494996256	/nfs/dbraw/zinc/99/62/56/494996256.db2.gz	IRLAYVQJIMIVOL-UHFFFAOYSA-N	-1	0	355.375	3.354	50	5		FGBARM
COc1ccc(S(=O)(=O)[N-]c2nc3ccccc3s2)cc1[N+](=O)[O-]	ZINC000005090906	539402178	/nfs/dbraw/zinc/40/21/78/539402178.db2.gz	OMKLMZWHGOYMLY-UHFFFAOYSA-N	-1	0	365.392	3.014	50	5		FGBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])cc1F	ZINC000004922569	210580117	/nfs/dbraw/zinc/58/01/17/210580117.db2.gz	ZNCWZFXRYVRBON-UHFFFAOYSA-N	-1	0	363.736	3.258	50	5		FGBARM
CCCOc1ccc([C@H](CC(=O)[O-])NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000003623675	210489856	/nfs/dbraw/zinc/48/98/56/210489856.db2.gz	QEECJLZUJMANSG-KRWDZBQOSA-N	-1	0	372.377	3.329	50	5		FGBARM
Cc1cccc(-n2c3cc(Cl)ccc3cc3c(=O)[n-]c(=O)nc2-3)c1C	ZINC000002253137	210386500	/nfs/dbraw/zinc/38/65/00/210386500.db2.gz	ZDBXHBMRCYNQLT-UHFFFAOYSA-N	-1	0	351.793	3.449	50	5		FGBARM
CCCn1c2ccccc2c([O-])c(C(=O)Nc2ccc([N+](=O)[O-])cc2)c1=O	ZINC000100502081	222245473	/nfs/dbraw/zinc/24/54/73/222245473.db2.gz	FKYXWJQKOLPECU-UHFFFAOYSA-N	-1	0	367.361	3.278	50	5		FGBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(SC)cc1	ZINC000002874641	493823173	/nfs/dbraw/zinc/82/31/73/493823173.db2.gz	ICZMCQCPGHUZRH-UHFFFAOYSA-N	-1	0	354.409	3.126	50	5		FGBARM
O=C(c1ccc([N+](=O)[O-])cc1)c1nc(=O)c2c3c(sc2[n-]1)CCCC3	ZINC000003353250	493839942	/nfs/dbraw/zinc/83/99/42/493839942.db2.gz	NQFLZRDONKSYNF-UHFFFAOYSA-N	-1	0	355.375	3.415	50	5		FGBARM
Cc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000004014258	493860708	/nfs/dbraw/zinc/86/07/08/493860708.db2.gz	BWGYBZYCDCUHEO-UHFFFAOYSA-N	-1	0	351.702	3.423	50	5		FGBARM
Cc1cccc(-n2nc([N+](=O)[O-])c([N-]c3ccc(C)cc3Cl)[n+]2[O-])c1	ZINC000004922485	493900885	/nfs/dbraw/zinc/90/08/85/493900885.db2.gz	ZSZBVDDKAONXSI-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
O=C(c1cc(Cl)c2nc3ccccc3c(=O)n2c1)c1ccccc1[O-]	ZINC000006558882	493968455	/nfs/dbraw/zinc/96/84/55/493968455.db2.gz	LZTLNRPLGJWOFW-UHFFFAOYSA-N	-1	0	350.761	3.438	50	5		FGBARM
CC(C)(C)OC(=O)Nc1c(Br)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000725374706	722420977	/nfs/dbraw/zinc/42/09/77/722420977.db2.gz	FPQPTEUGLVPZNA-UHFFFAOYSA-N	-1	0	361.148	3.403	50	5		FGBARM
O=[N+]([O-])c1nn(-c2ccc(Cl)cc2)[n+]([O-])c1[N-]c1cccc(Cl)c1	ZINC000004809051	210565712	/nfs/dbraw/zinc/56/57/12/210565712.db2.gz	XBHBFLKAQVZZDG-UHFFFAOYSA-N	-1	0	366.164	3.464	50	5		FGBARM
COc1cc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c(OC)cc1Cl	ZINC000001229875	210338532	/nfs/dbraw/zinc/33/85/32/210338532.db2.gz	YSMIVPNFXZVBOV-UHFFFAOYSA-N	-1	0	372.786	3.066	50	5		FGBARM
O=C(c1cnc2cc(-c3ccccc3)nn2c1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000096901382	222136304	/nfs/dbraw/zinc/13/63/04/222136304.db2.gz	DHPPOMOTTIKPND-UHFFFAOYSA-N	-1	0	360.329	3.241	50	5		FGBARM
O=C1c2cccc([N+](=O)[O-])c2C(=O)N1c1ccc2[n-]c(=S)sc2c1	ZINC000002909169	493824022	/nfs/dbraw/zinc/82/40/22/493824022.db2.gz	XZCFYWWZCCVGFB-UHFFFAOYSA-N	-1	0	357.372	3.294	50	5		FGBARM
O=[N+]([O-])c1cc(Cl)c([O-])c(NS(=O)(=O)/C=C/c2ccccc2)c1	ZINC000005047688	493910910	/nfs/dbraw/zinc/91/09/10/493910910.db2.gz	KBZRWERDGYCIEE-VOTSOKGWSA-N	-1	0	354.771	3.366	50	5		FGBARM
CC(C)(C)OC(=O)Nc1c(C(=O)[O-])cc(Br)cc1[N+](=O)[O-]	ZINC000725376883	722421056	/nfs/dbraw/zinc/42/10/56/722421056.db2.gz	YEOAYRDWLFRDEQ-UHFFFAOYSA-N	-1	0	361.148	3.403	50	5		FGBARM
Cc1ccc(C(=O)[O-])c(C(=O)Nc2nc3ccc([N+](=O)[O-])cc3s2)c1	ZINC000004891899	493899081	/nfs/dbraw/zinc/89/90/81/493899081.db2.gz	GMZLLDCQCLRWQE-UHFFFAOYSA-N	-1	0	357.347	3.463	50	5		FGBARM
Cc1cccc(-n2nc([N+](=O)[O-])c([N-]c3cc(Cl)ccc3C)[n+]2[O-])c1	ZINC000004923242	493900742	/nfs/dbraw/zinc/90/07/42/493900742.db2.gz	GEPSTKFFSPCBDV-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3ccccc3C)[n+]2[O-])c(Cl)c1	ZINC000004971327	493904593	/nfs/dbraw/zinc/90/45/93/493904593.db2.gz	GVKGPSSXDDAZMP-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
Cc1cc(NC2CCC(C(=O)[O-])CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000263547576	497798945	/nfs/dbraw/zinc/79/89/45/497798945.db2.gz	IENVUQOHCVRFCD-UHFFFAOYSA-N	-1	0	356.382	3.416	50	5		FGBARM
O=C([O-])c1ccc(N2C(=O)c3cccc4c([N+](=O)[O-])ccc(c43)C2=O)cc1	ZINC000002027104	132382521	/nfs/dbraw/zinc/38/25/21/132382521.db2.gz	CKZZWONCAWOIKG-UHFFFAOYSA-N	-1	0	362.297	3.247	50	5		FGBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2nnc(C3CCCCC3)s2)cc1	ZINC000002819082	493821090	/nfs/dbraw/zinc/82/10/90/493821090.db2.gz	ZYZYAMCRTULXFT-UHFFFAOYSA-N	-1	0	368.440	3.295	50	5		FGBARM
COc1ccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c([N+](=O)[O-])c1	ZINC000003833473	493857841	/nfs/dbraw/zinc/85/78/41/493857841.db2.gz	IKVUKWFTBAOSFP-UHFFFAOYSA-N	-1	0	350.396	3.329	50	5		FGBARM
C[C@H](On1c2cc([N+](=O)[O-])ccc2nc1-c1ccc(Cl)cc1)C(=O)[O-]	ZINC000004001985	493861129	/nfs/dbraw/zinc/86/11/29/493861129.db2.gz	VJCRNBJHJVWPDU-VIFPVBQESA-N	-1	0	361.741	3.167	50	5		FGBARM
Cc1nc2cc([N-]S(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)ccc2o1	ZINC000008109878	494068444	/nfs/dbraw/zinc/06/84/44/494068444.db2.gz	VHKYVHFFWFNVND-UHFFFAOYSA-N	-1	0	367.770	3.499	50	5		FGBARM
O=[N+]([O-])c1sccc1S(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1	ZINC000225698192	497071598	/nfs/dbraw/zinc/07/15/98/497071598.db2.gz	KYDGMXSXAHODRZ-UHFFFAOYSA-N	-1	0	352.315	3.476	50	5		FGBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ccc(Br)cc2)cc1	ZINC000000754126	219318191	/nfs/dbraw/zinc/31/81/91/219318191.db2.gz	WBTZBJZKJMXSIE-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
Cc1ccc(C(=O)[O-])cc1NC(=S)NC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000002832361	219469322	/nfs/dbraw/zinc/46/93/22/219469322.db2.gz	YXMUOGWHGVVYDE-UHFFFAOYSA-N	-1	0	373.390	3.037	50	5		FGBARM
O=[N+]([O-])c1cc(CN2CCN(C/C=C/c3ccccc3)CC2)ccc1[O-]	ZINC000019608879	220280753	/nfs/dbraw/zinc/28/07/53/220280753.db2.gz	UNFHJXDHLGBIBD-QPJJXVBHSA-N	-1	0	353.422	3.131	50	5		FGBARM
Cc1ccc(C)c(-n2c3cccc(Cl)c3cc3c(=O)[n-]c(=O)nc2-3)c1	ZINC000002211234	493803464	/nfs/dbraw/zinc/80/34/64/493803464.db2.gz	XUVODLHELVWMMC-UHFFFAOYSA-N	-1	0	351.793	3.449	50	5		FGBARM
O=C([N-]c1nnc(-c2ccc3c(c2)CCCC3)o1)c1ccc([N+](=O)[O-])o1	ZINC000004107368	493865144	/nfs/dbraw/zinc/86/51/44/493865144.db2.gz	VKZONGPEACBBCW-UHFFFAOYSA-N	-1	0	354.322	3.369	50	5		FGBARM
COc1cc([N+](=O)[O-])c(Cl)cc1[N-]S(=O)(=O)c1ccc(C)cc1	ZINC000004582446	493883593	/nfs/dbraw/zinc/88/35/93/493883593.db2.gz	BKQPCLFPOKGRLL-UHFFFAOYSA-N	-1	0	356.787	3.366	50	5		FGBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1c(C)cc(C)cc1C	ZINC000000805412	219323482	/nfs/dbraw/zinc/32/34/82/219323482.db2.gz	HCGUIMZYAXVBGU-UHFFFAOYSA-N	-1	0	350.396	3.329	50	5		FGBARM
O=C([O-])c1cc2nc(-c3ccc([N+](=O)[O-])cc3)cc(C(F)(F)F)n2n1	ZINC000000845300	219329702	/nfs/dbraw/zinc/32/97/02/219329702.db2.gz	BNHYZIKHNVKZQJ-UHFFFAOYSA-N	-1	0	352.228	3.022	50	5		FGBARM
O=C([O-])c1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Br)cc1	ZINC000001233018	219392005	/nfs/dbraw/zinc/39/20/05/219392005.db2.gz	UPPAGPASVVFPKL-UHFFFAOYSA-N	-1	0	365.139	3.308	50	5		FGBARM
CCCOc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000004593216	219590059	/nfs/dbraw/zinc/59/00/59/219590059.db2.gz	SINFOIRGFRCLIG-MRXNPFEDSA-N	-1	0	372.377	3.329	50	5		FGBARM
COc1cc([C@H]2Nc3ccccc3C(=O)N2C2CC2)cc([N+](=O)[O-])c1[O-]	ZINC000022130630	220377106	/nfs/dbraw/zinc/37/71/06/220377106.db2.gz	UTBOOHJGVUODTP-KRWDZBQOSA-N	-1	0	355.350	3.038	50	5		FGBARM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1ccc(OC(F)(F)F)cc1	ZINC000007055966	493998088	/nfs/dbraw/zinc/99/80/88/493998088.db2.gz	ISUXZXPXQYLAAC-UHFFFAOYSA-N	-1	0	362.285	3.294	50	5		FGBARM
O=C([O-])c1cc([N+](=O)[O-])c(Sc2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000008385610	494088895	/nfs/dbraw/zinc/08/88/95/494088895.db2.gz	ZANXKUYWOKRINS-UHFFFAOYSA-N	-1	0	360.307	3.229	50	5		FGBARM
Cc1cc(NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)n(-c2ccccc2)n1	ZINC000008849476	494106392	/nfs/dbraw/zinc/10/63/92/494106392.db2.gz	JBRGJTHOSYBWGQ-UHFFFAOYSA-N	-1	0	366.333	3.039	50	5		FGBARM
Cc1ccc(S(=O)(=O)[N-][C@H](C(C)(C)C)C(F)(F)F)c([N+](=O)[O-])c1	ZINC000072307394	494149704	/nfs/dbraw/zinc/14/97/04/494149704.db2.gz	WFRGTMVCXAZGPG-LLVKDONJSA-N	-1	0	354.350	3.159	50	5		FGBARM
O=C([O-])CCC(=O)N1N=C(c2ccccc2)C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000000867589	219332728	/nfs/dbraw/zinc/33/27/28/219332728.db2.gz	WFOSEASVKFXYAB-KRWDZBQOSA-N	-1	0	367.361	3.137	50	5		FGBARM
O=[N+]([O-])c1cccc([N-]S(=O)(=O)c2ccccc2Br)c1	ZINC000016101114	220178980	/nfs/dbraw/zinc/17/89/80/220178980.db2.gz	XXZPALGOCXVGLG-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
O=c1nc2n(-c3ccccc3Cl)c3cc(Cl)ccc3cc-2c(=O)[n-]1	ZINC000002235941	493803439	/nfs/dbraw/zinc/80/34/39/493803439.db2.gz	KGYAZOYAYRSQIE-UHFFFAOYSA-N	-1	0	358.184	3.486	50	5		FGBARM
O=C([O-])c1ccc(N2CCN(c3ccccc3Cl)CC2)c([N+](=O)[O-])c1	ZINC000003913778	493861246	/nfs/dbraw/zinc/86/12/46/493861246.db2.gz	HQFFJFYCEIJFJA-UHFFFAOYSA-N	-1	0	361.785	3.273	50	5		FGBARM
O=[N+]([O-])c1nn(-c2cccc(C(F)(F)F)c2)[n+]([O-])c1[N-]c1ccccc1	ZINC000004757628	493891868	/nfs/dbraw/zinc/89/18/68/493891868.db2.gz	MBYLTMGZUDSDBH-UHFFFAOYSA-N	-1	0	365.271	3.176	50	5		FGBARM
CCOc1ccc2ccccc2c1C=Cc1[nH]c(=O)[n-]c(=O)c1[N+](=O)[O-]	ZINC000004954658	493903533	/nfs/dbraw/zinc/90/35/33/493903533.db2.gz	QDHSEVDEAMFYJN-CMDGGOBGSA-N	-1	0	353.334	3.106	50	5		FGBARM
COc1cccc([N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(Cl)c2F)c1	ZINC000225554112	497067156	/nfs/dbraw/zinc/06/71/56/497067156.db2.gz	NTRDGBFBOAJKAU-UHFFFAOYSA-N	-1	0	360.750	3.197	50	5		FGBARM
O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1	ZINC000037183534	494102438	/nfs/dbraw/zinc/10/24/38/494102438.db2.gz	AKBVJYMJLHNUDJ-CYBMUJFWSA-N	-1	0	366.377	3.197	50	5		FGBARM
O=C([O-])CCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000004950909	219630218	/nfs/dbraw/zinc/63/02/18/219630218.db2.gz	MVWOYLBXRJDFRS-AWEZNQCLSA-N	-1	0	373.390	3.199	50	5		FGBARM
Cn1c(Cc2ccccc2)nnc1Sc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000001158556	493786760	/nfs/dbraw/zinc/78/67/60/493786760.db2.gz	CMLPATXOTMEUPX-UHFFFAOYSA-N	-1	0	370.390	3.164	50	5		FGBARM
O=C([O-])C[C@@H](NC(=O)C1CCCCC1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000003856173	493857824	/nfs/dbraw/zinc/85/78/24/493857824.db2.gz	PCSNPUVSQRIDSB-CQSZACIVSA-N	-1	0	354.790	3.461	50	5		FGBARM
Cc1nc2sc([C@@H](c3ccc([N+](=O)[O-])cc3)N3CCCCC3)c([O-])n2n1	ZINC000023157571	494554426	/nfs/dbraw/zinc/55/44/26/494554426.db2.gz	VNDHTYIMOZSQQY-CQSZACIVSA-N	-1	0	373.438	3.288	50	5		FGBARM
COc1cc([N+](=O)[O-])ccc1NC(=S)Nc1ccc(CC(=O)[O-])cc1	ZINC000004999127	263337602	/nfs/dbraw/zinc/33/76/02/263337602.db2.gz	KSAOESXAQMWRHN-UHFFFAOYSA-N	-1	0	361.379	3.039	50	5		FGBARM
Cc1ccc(C(=O)[O-])cc1NC(=S)NC(=O)c1cccc([N+](=O)[O-])c1C	ZINC000002226107	493803568	/nfs/dbraw/zinc/80/35/68/493803568.db2.gz	NMSATPDBGZLMFQ-UHFFFAOYSA-N	-1	0	373.390	3.037	50	5		FGBARM
O=c1nc2n(-c3ccc(Cl)cc3)c3cc(Cl)ccc3cc-2c(=O)[n-]1	ZINC000002247977	493803630	/nfs/dbraw/zinc/80/36/30/493803630.db2.gz	FQCKGCLJKFRCJP-UHFFFAOYSA-N	-1	0	358.184	3.486	50	5		FGBARM
CCCOc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000004593218	204149875	/nfs/dbraw/zinc/14/98/75/204149875.db2.gz	SINFOIRGFRCLIG-INIZCTEOSA-N	-1	0	372.377	3.329	50	5		FGBARM
Cc1cccc(-n2nc([N+](=O)[O-])c([N-]c3cccc(Cl)c3C)[n+]2[O-])c1	ZINC000004922446	204177544	/nfs/dbraw/zinc/17/75/44/204177544.db2.gz	QHKQZFVWBUZBSI-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1[O-])c1cc(=O)c2ccccc2o1	ZINC000004935232	204178530	/nfs/dbraw/zinc/17/85/30/204178530.db2.gz	BBXDDUIUENEIJQ-UHFFFAOYSA-N	-1	0	360.709	3.313	50	5		FGBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3ccccc3C)[n+]2[O-])cc1Cl	ZINC000004971324	204180749	/nfs/dbraw/zinc/18/07/49/204180749.db2.gz	DLABWTNEOJMUNS-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
CCOc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1OCC	ZINC000007050884	206206626	/nfs/dbraw/zinc/20/66/26/206206626.db2.gz	ICAXWYKJOJYLOE-UHFFFAOYSA-N	-1	0	366.395	3.193	50	5		FGBARM
COc1cc(Cl)c(C)cc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000007158985	206206816	/nfs/dbraw/zinc/20/68/16/206206816.db2.gz	IPBAQPWZUSMVBA-UHFFFAOYSA-N	-1	0	356.787	3.366	50	5		FGBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(-c3ccc(F)cc3F)o2)[nH]1	ZINC000004502400	263333684	/nfs/dbraw/zinc/33/36/84/263333684.db2.gz	JUEIOLTWCYMWNL-GORDUTHDSA-N	-1	0	361.260	3.092	50	5		FGBARM
CCOc1ccc([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000004884945	493898789	/nfs/dbraw/zinc/89/87/89/493898789.db2.gz	VYBRQRCDOWUMLJ-UHFFFAOYSA-N	-1	0	356.787	3.448	50	5		FGBARM
COc1cc(-c2nc(=O)c3c4c(sc3[nH]2)CCCC4)cc([N+](=O)[O-])c1[O-]	ZINC000019787659	494460306	/nfs/dbraw/zinc/46/03/06/494460306.db2.gz	IWIZKRIMMZFCOT-UHFFFAOYSA-N	-1	0	373.390	3.153	50	5		FGBARM
COc1ccc([N-]S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2Cl)cc1	ZINC000095460472	494977114	/nfs/dbraw/zinc/97/71/14/494977114.db2.gz	XZKLZYBACYMMPX-UHFFFAOYSA-N	-1	0	356.787	3.366	50	5		FGBARM
O=C(Cc1ccc(F)c(Br)c1)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000096012017	494996184	/nfs/dbraw/zinc/99/61/84/494996184.db2.gz	UWCDZGVCGRFLIL-UHFFFAOYSA-N	-1	0	369.146	3.383	50	5		FGBARM
COc1cccc(C2=CCN(C(=O)c3ccc([N+](=O)[O-])c([O-])c3)CC2)c1	ZINC000170601042	495532370	/nfs/dbraw/zinc/53/23/70/495532370.db2.gz	CJLYUKHNPDAGJP-UHFFFAOYSA-N	-1	0	354.362	3.239	50	5		FGBARM
COc1ccc(OC)c([N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c1	ZINC000007323452	204295558	/nfs/dbraw/zinc/29/55/58/204295558.db2.gz	ZMTKRDCILZFNBH-UHFFFAOYSA-N	-1	0	366.395	3.030	50	5		FGBARM
O=[N+]([O-])c1ccc([O-])c(CSc2nc3c4ccccc4ncn3n2)c1	ZINC000058180667	205256126	/nfs/dbraw/zinc/25/61/26/205256126.db2.gz	DATVTCWCTVRBJX-UHFFFAOYSA-N	-1	0	353.363	3.184	50	5		FGBARM
COc1cc(CN2CCN(c3cccc(C)c3C)CC2)cc([N+](=O)[O-])c1[O-]	ZINC000001227083	132381353	/nfs/dbraw/zinc/38/13/53/132381353.db2.gz	OFPZQUYTOADUGC-UHFFFAOYSA-N	-1	0	371.437	3.248	50	5		FGBARM
Cn1c(Sc2ccc(C(=O)[O-])cc2[N+](=O)[O-])nnc1-c1ccccc1	ZINC000001158718	493787443	/nfs/dbraw/zinc/78/74/43/493787443.db2.gz	AISKWKVMKYLMGA-UHFFFAOYSA-N	-1	0	356.363	3.240	50	5		FGBARM
Cc1[n-]n(-c2ccc([N+](=O)[O-])cc2)c(=O)c1-c1cc(=O)c2ccccc2[nH]1	ZINC000100429080	495065192	/nfs/dbraw/zinc/06/51/92/495065192.db2.gz	LDOUFUNGKUPOLW-UHFFFAOYSA-N	-1	0	362.345	3.303	50	5		FGBARM
Cc1cc(C)cc([N-]c2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])c1	ZINC000004757661	204161360	/nfs/dbraw/zinc/16/13/60/204161360.db2.gz	KCPZWQWRPZDEDM-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5	aggregator	FGBARM
Cc1ccc(S(=O)(=O)[N-]c2nc3cc(C)c([N+](=O)[O-])cc3s2)cc1	ZINC000005557791	204214870	/nfs/dbraw/zinc/21/48/70/204214870.db2.gz	LYQBOAYAPLJETB-UHFFFAOYSA-N	-1	0	363.420	3.044	50	5		FGBARM
CCOc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1OCC	ZINC000007050872	204287417	/nfs/dbraw/zinc/28/74/17/204287417.db2.gz	OFUDOLNFJZDRTM-UHFFFAOYSA-N	-1	0	366.395	3.193	50	5		FGBARM
O=C1N=C(SCc2ccc([N+](=O)[O-])cc2)N=C([O-])C1Cc1ccccc1	ZINC000016448451	204635901	/nfs/dbraw/zinc/63/59/01/204635901.db2.gz	LMWCPULJNNDLLJ-UHFFFAOYSA-N	-1	0	369.402	3.267	50	5		FGBARM
Cc1cc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])ccc1Br	ZINC000000805410	206225013	/nfs/dbraw/zinc/22/50/13/206225013.db2.gz	IJOGJMLEYZYNDI-UHFFFAOYSA-N	-1	0	371.212	3.467	50	5		FGBARM
COc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1c(C)cc(C)cc1C	ZINC000003893888	204113410	/nfs/dbraw/zinc/11/34/10/204113410.db2.gz	CMBIPEVSFCCOKA-UHFFFAOYSA-N	-1	0	350.396	3.329	50	5		FGBARM
Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1[N-]S(=O)(=O)c1ccccc1	ZINC000003464034	204102894	/nfs/dbraw/zinc/10/28/94/204102894.db2.gz	LIWLURVONIHXNV-UHFFFAOYSA-N	-1	0	372.406	3.198	50	5		FGBARM
CC(C)(C)OC(=O)N1CCC(Nc2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000044842026	205112214	/nfs/dbraw/zinc/11/22/14/205112214.db2.gz	VKJNSVCRRUWXBG-UHFFFAOYSA-N	-1	0	365.386	3.104	50	5		FGBARM
O=C([O-])c1cccc(N2C(=O)c3cccc4c([N+](=O)[O-])ccc(c43)C2=O)c1	ZINC000001209109	132381117	/nfs/dbraw/zinc/38/11/17/132381117.db2.gz	MBWNROSGDJVDBX-UHFFFAOYSA-N	-1	0	362.297	3.247	50	5		FGBARM
COc1ccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)c([N+](=O)[O-])c1	ZINC000001115767	493784925	/nfs/dbraw/zinc/78/49/25/493784925.db2.gz	CFHVLNVQXFGSPJ-UHFFFAOYSA-N	-1	0	350.396	3.329	50	5		FGBARM
Cc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000005218445	493920433	/nfs/dbraw/zinc/92/04/33/493920433.db2.gz	UWPMHQUVJWBKIY-UHFFFAOYSA-N	-1	0	371.758	3.266	50	5		FGBARM
O=C(NCCCc1nc2ccccc2s1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000012696842	494250613	/nfs/dbraw/zinc/25/06/13/494250613.db2.gz	NHBCMIULUPRECC-UHFFFAOYSA-N	-1	0	357.391	3.273	50	5		FGBARM
Cc1cc([O-])c(C2=NCCS[C@H](c3ccccc3[N+](=O)[O-])C2)c(=O)o1	ZINC000000754499	695535782	/nfs/dbraw/zinc/53/57/82/695535782.db2.gz	CFKZJJIXFWTWON-HNNXBMFYSA-N	-1	0	360.391	3.229	50	5		FGBARM
CC(C)COC(=O)N=c1[n-]nc(COc2ccc([N+](=O)[O-])cc2)s1	ZINC000002848151	204062201	/nfs/dbraw/zinc/06/22/01/204062201.db2.gz	JZDDKZPUVKUBDE-UHFFFAOYSA-N	-1	0	352.372	3.230	50	5		FGBARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000004517297	204142648	/nfs/dbraw/zinc/14/26/48/204142648.db2.gz	LAPUOPKWYOOCKL-HNNXBMFYSA-N	-1	0	370.321	3.092	50	5	biogenic,in-vitro	FGBARM
Cc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(Br)cc1	ZINC000005260114	204199793	/nfs/dbraw/zinc/19/97/93/204199793.db2.gz	LYXUVYKDRVUTEZ-UHFFFAOYSA-N	-1	0	371.212	3.467	50	5		FGBARM
Cc1ccc(-n2c3cccc(Cl)c3cc3c(=O)[n-]c(=O)nc2-3)cc1C	ZINC000008743486	204342048	/nfs/dbraw/zinc/34/20/48/204342048.db2.gz	FDOGYUCVFKJAQQ-UHFFFAOYSA-N	-1	0	351.793	3.449	50	5		FGBARM
COc1ccc(Cl)cc1NC(=O)c1c(C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000004263117	206172019	/nfs/dbraw/zinc/17/20/19/206172019.db2.gz	OWWNQQGLGIWUSK-UHFFFAOYSA-N	-1	0	350.714	3.207	50	5		FGBARM
COc1ccc2nc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)sc2c1	ZINC000001182914	493789599	/nfs/dbraw/zinc/78/95/99/493789599.db2.gz	ZFMNZUKIKFNNPV-UHFFFAOYSA-N	-1	0	365.392	3.014	50	5		FGBARM
O=[N+]([O-])c1cccc([N-]S(=O)(=O)c2ccc(Br)s2)c1	ZINC000002843447	204061699	/nfs/dbraw/zinc/06/16/99/204061699.db2.gz	ZPBHEIYFGSVANR-UHFFFAOYSA-N	-1	0	363.214	3.220	50	5		FGBARM
CCC(=O)N(C(=O)c1ccccc1C(=O)[O-])c1ccc([N+](=O)[O-])cc1C	ZINC000004187368	204126120	/nfs/dbraw/zinc/12/61/20/204126120.db2.gz	CUNXKLKRARPUTB-UHFFFAOYSA-N	-1	0	356.334	3.185	50	5		FGBARM
O=C([O-])c1cc(NC(=O)CSc2ccc([N+](=O)[O-])cn2)ccc1Cl	ZINC000004821289	204166251	/nfs/dbraw/zinc/16/62/51/204166251.db2.gz	BFBDJUONVROQPK-UHFFFAOYSA-N	-1	0	367.770	3.072	50	5		FGBARM
O=C([O-])C[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N1C(=O)c2ccccc2C1=O	ZINC000001304635	493791609	/nfs/dbraw/zinc/79/16/09/493791609.db2.gz	CNGWHVBWTIIPBT-AWEZNQCLSA-N	-1	0	374.736	3.060	50	5		FGBARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000017073108	494406946	/nfs/dbraw/zinc/40/69/46/494406946.db2.gz	NYUOMMWJPPILNO-OQULHBPMSA-N	-1	0	352.774	3.324	50	5		FGBARM
Cn1c(Sc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)nnc1-c1ccccc1	ZINC000004565385	204148311	/nfs/dbraw/zinc/14/83/11/204148311.db2.gz	KPJJCESLVXJSBF-UHFFFAOYSA-N	-1	0	356.363	3.240	50	5		FGBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(OCc3ccccc3)cc2)[nH]1	ZINC000005050043	204188668	/nfs/dbraw/zinc/18/86/68/204188668.db2.gz	PXJPJGWBKXPMPQ-DHZHZOJOSA-N	-1	0	365.345	3.133	50	5		FGBARM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1C	ZINC000007708294	204303075	/nfs/dbraw/zinc/30/30/75/204303075.db2.gz	RFZXJBPWEXUFMD-UHFFFAOYSA-N	-1	0	356.787	3.366	50	5		FGBARM
COC(=O)[C@@H](C)N(C(=O)c1cc([N+](=O)[O-])ccc1[O-])c1c(C)cccc1C	ZINC000055562800	205220596	/nfs/dbraw/zinc/22/05/96/205220596.db2.gz	WLZWMHIKUITGTA-CYBMUJFWSA-N	-1	0	372.377	3.126	50	5		FGBARM
Cc1ccc(S(=O)(=O)[N-]c2ccc(Br)cc2[N+](=O)[O-])cc1	ZINC000005260166	206191561	/nfs/dbraw/zinc/19/15/61/206191561.db2.gz	CMPGTCGIODQYGU-UHFFFAOYSA-N	-1	0	371.212	3.467	50	5		FGBARM
Cc1ccccc1[C@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000164778694	206241026	/nfs/dbraw/zinc/24/10/26/206241026.db2.gz	ZPGPWOYHLQJKMG-SCLBCKFNSA-N	-1	0	356.378	3.211	50	5		FGBARM
Cc1nc(-c2ccc(CNC(=O)c3ccc([N+](=O)[O-])c([O-])c3)o2)cs1	ZINC000012619982	494247590	/nfs/dbraw/zinc/24/75/90/494247590.db2.gz	WRCZFDWXAQMVSR-UHFFFAOYSA-N	-1	0	359.363	3.255	50	5		FGBARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000017073106	494406786	/nfs/dbraw/zinc/40/67/86/494406786.db2.gz	NYUOMMWJPPILNO-YYRBMLDISA-N	-1	0	352.774	3.324	50	5		FGBARM
COC(=O)c1ccc2cc(-c3nc4ccc([N+](=O)[O-])cc4[n-]3)c(=O)oc2c1	ZINC000020615316	494477895	/nfs/dbraw/zinc/47/78/95/494477895.db2.gz	VULXGLQBTCECPQ-UHFFFAOYSA-N	-1	0	365.301	3.031	50	5		FGBARM
O=C1c2ccccc2N[C@@H](c2ccc([O-])c([N+](=O)[O-])c2)N1C[C@@H]1CCCO1	ZINC000022313309	494519415	/nfs/dbraw/zinc/51/94/15/494519415.db2.gz	GHCHVSIOARYUCN-SCLBCKFNSA-N	-1	0	369.377	3.046	50	5		FGBARM
O=C([O-])C[C@@H](NC(=O)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686329	204155607	/nfs/dbraw/zinc/15/56/07/204155607.db2.gz	LHVDAMJHBYPGAU-CQSZACIVSA-N	-1	0	366.732	3.333	50	5		FGBARM
Cc1ccc(F)cc1[N-]c1c([N+](=O)[O-])nn(-c2ccc(Cl)cc2)[n+]1[O-]	ZINC000004828356	207053342	/nfs/dbraw/zinc/05/33/42/207053342.db2.gz	VKNFYBNHXQJSRV-UHFFFAOYSA-N	-1	0	363.736	3.258	50	5		FGBARM
O=C([O-])C[C@@H](NC(=O)Cc1ccccc1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686325	493886680	/nfs/dbraw/zinc/88/66/80/493886680.db2.gz	LMCIJGFPFDTQFA-OAHLLOKOSA-N	-1	0	362.769	3.123	50	5		FGBARM
CCc1nc2sc([C@@H](c3ccc([N+](=O)[O-])cc3)N3CCCC3)c([O-])n2n1	ZINC000022852964	494539137	/nfs/dbraw/zinc/53/91/37/494539137.db2.gz	YLECQBLIXIPPSB-CQSZACIVSA-N	-1	0	373.438	3.152	50	5		FGBARM
COc1ccc([C@H](C[N+](=O)[O-])c2c(C)[n-]n(-c3ccccc3)c2=O)cc1	ZINC000100848840	495066368	/nfs/dbraw/zinc/06/63/68/495066368.db2.gz	VPFIMAOVCZSZFO-KRWDZBQOSA-N	-1	0	353.378	3.304	50	5		FGBARM
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@H](c2ccc(F)cc2)O1	ZINC000170644904	495544742	/nfs/dbraw/zinc/54/47/42/495544742.db2.gz	WGRLUVKWCZTLOL-APPDUMDISA-N	-1	0	360.341	3.042	50	5		FGBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])cc1F	ZINC000004923616	207062620	/nfs/dbraw/zinc/06/26/20/207062620.db2.gz	HVFQRWZGEVYQSA-UHFFFAOYSA-N	-1	0	363.736	3.258	50	5		FGBARM
O=[N+]([O-])c1ccc([N-]c2ccn(CCc3ccccn3)n2)c([N+](=O)[O-])c1	ZINC000057265440	221086367	/nfs/dbraw/zinc/08/63/67/221086367.db2.gz	BFGVWFFDAVSUFF-UHFFFAOYSA-N	-1	0	354.326	3.081	50	5		FGBARM
CC(C)c1noc([C@@]23CCC[C@@H]2C[N@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C3)n1	ZINC000241124397	497352406	/nfs/dbraw/zinc/35/24/06/497352406.db2.gz	JHYREGUZMADZTA-AUUYWEPGSA-N	-1	0	372.425	3.361	50	5		FGBARM
O=C([O-])C[C@H](NC(=O)Cc1ccccc1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686324	219595298	/nfs/dbraw/zinc/59/52/98/219595298.db2.gz	LMCIJGFPFDTQFA-HNNXBMFYSA-N	-1	0	362.769	3.123	50	5		FGBARM
O=[N+]([O-])c1cccc(CSC2=Nc3ccc(F)cc3S(=O)(=O)[N-]2)c1	ZINC000004853693	207055804	/nfs/dbraw/zinc/05/58/04/207055804.db2.gz	RAIJLBOAIVZMBA-UHFFFAOYSA-N	-1	0	367.383	3.138	50	5		FGBARM
COc1ccc(C(=O)c2coc3cc([N+](=O)[O-])c([O-])c([N+](=O)[O-])c23)cc1	ZINC000013758395	207483358	/nfs/dbraw/zinc/48/33/58/207483358.db2.gz	OATOPPLVCRCPHZ-UHFFFAOYSA-N	-1	0	358.262	3.194	50	5		FGBARM
Cc1nn(C(C)(C)C)c(C)c1S(=O)(=O)[N-]c1ccc([N+](=O)[O-])c(F)c1	ZINC000095444321	209051518	/nfs/dbraw/zinc/05/15/18/209051518.db2.gz	LKFMFVBDWGEWQY-UHFFFAOYSA-N	-1	0	370.406	3.103	50	5		FGBARM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1cccc(Br)c1	ZINC000000805408	493773690	/nfs/dbraw/zinc/77/36/90/493773690.db2.gz	YETJCURINQNGDG-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
O=C([O-])C[C@H](NC(=O)C1CCCCC1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000003856174	493857833	/nfs/dbraw/zinc/85/78/33/493857833.db2.gz	PCSNPUVSQRIDSB-AWEZNQCLSA-N	-1	0	354.790	3.461	50	5		FGBARM
O=C([O-])[C@@H]1CCCN1c1nc2ccc([N+](=O)[O-])cc2c(-c2ccccc2)n1	ZINC000000889798	493778377	/nfs/dbraw/zinc/77/83/77/493778377.db2.gz	KHZHXXAKYKPGCN-INIZCTEOSA-N	-1	0	364.361	3.258	50	5		FGBARM
Cc1cc2sc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)nc2c(C)c1	ZINC000003268347	493835179	/nfs/dbraw/zinc/83/51/79/493835179.db2.gz	OYQMIMFRHCUDBT-UHFFFAOYSA-N	-1	0	363.420	3.044	50	5		FGBARM
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@H](c2ccc(F)cc2)O1	ZINC000170644902	495544724	/nfs/dbraw/zinc/54/47/24/495544724.db2.gz	WGRLUVKWCZTLOL-PIGZYNQJSA-N	-1	0	360.341	3.042	50	5		FGBARM
O=c1c2sc3ccc([N+](=O)[O-])cc3c2[n-]c(=S)n1C[C@@H]1CCCO1	ZINC000102724886	570836585	/nfs/dbraw/zinc/83/65/85/570836585.db2.gz	UJOJMEUNUPRFLZ-VIFPVBQESA-N	-1	0	363.420	3.361	50	5		FGBARM
Cc1ccc(S(=O)(=O)[N-]c2nc3c(cc([N+](=O)[O-])cc3C)s2)cc1	ZINC000005557786	207106299	/nfs/dbraw/zinc/10/62/99/207106299.db2.gz	HHQDRGOXXCKFGD-UHFFFAOYSA-N	-1	0	363.420	3.044	50	5		FGBARM
O=C([O-])C[C@@H](NC(=O)c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686807	493886979	/nfs/dbraw/zinc/88/69/79/493886979.db2.gz	YIFLJUCDPYDSSB-CQSZACIVSA-N	-1	0	366.732	3.333	50	5		FGBARM
Cc1cc(C)n(-c2ccccc2[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	ZINC000032086639	493973832	/nfs/dbraw/zinc/97/38/32/493973832.db2.gz	NFEZGCFECIUAKK-UHFFFAOYSA-N	-1	0	372.406	3.198	50	5		FGBARM
O=C([O-])[C@H]1C2CCC(CC2)[C@@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000017073107	494406514	/nfs/dbraw/zinc/40/65/14/494406514.db2.gz	NYUOMMWJPPILNO-FPFWAFECSA-N	-1	0	352.774	3.324	50	5		FGBARM
O=C([O-])C[C@H](NC(=O)c1cccs1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686332	219595387	/nfs/dbraw/zinc/59/53/87/219595387.db2.gz	KYCAXEBTCBHBDR-NSHDSACASA-N	-1	0	354.771	3.256	50	5		FGBARM
O=C([O-])CCC(=O)Nc1ccc(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	ZINC000008672952	207240828	/nfs/dbraw/zinc/24/08/28/207240828.db2.gz	LJTZVHCZFMSLJB-UHFFFAOYSA-N	-1	0	374.309	3.050	50	5		FGBARM
O=C(Nc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])c1)c1ccco1	ZINC000035867452	208137165	/nfs/dbraw/zinc/13/71/65/208137165.db2.gz	WPYKARHJSUGXTA-UHFFFAOYSA-N	-1	0	367.317	3.398	50	5		FGBARM
CC(C)[C@H](Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000003878094	493859136	/nfs/dbraw/zinc/85/91/36/493859136.db2.gz	NOJKUUNUGNDWAE-VIFPVBQESA-N	-1	0	351.237	3.043	50	5		FGBARM
O=C([O-])c1cc(Br)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000004902020	493900137	/nfs/dbraw/zinc/90/01/37/493900137.db2.gz	WMPNYXAFYAGSID-UHFFFAOYSA-N	-1	0	365.139	3.308	50	5		FGBARM
COc1cc(/C=C/c2nc(C(=O)[O-])c(C)s2)c([N+](=O)[O-])cc1OC	ZINC000225792846	209835810	/nfs/dbraw/zinc/83/58/10/209835810.db2.gz	ZWTQVZGMFSNJLN-SNAWJCMRSA-N	-1	0	350.352	3.246	50	5		FGBARM
O=C([O-])c1cc(Br)ccc1NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000005555567	206708789	/nfs/dbraw/zinc/70/87/89/206708789.db2.gz	NCTGDRUDAUEUHF-UHFFFAOYSA-N	-1	0	365.139	3.308	50	5		FGBARM
Cc1ccc(S(=O)(=O)[N-]c2nc3cc([N+](=O)[O-])c(C)cc3s2)cc1	ZINC000005557789	207106549	/nfs/dbraw/zinc/10/65/49/207106549.db2.gz	BKKNGJYVSKMYIQ-UHFFFAOYSA-N	-1	0	363.420	3.044	50	5		FGBARM
Cc1c(C(=O)[O-])sc2[nH]c(C=Cc3ccc(C)c([N+](=O)[O-])c3)nc(=O)c12	ZINC000007738674	207204844	/nfs/dbraw/zinc/20/48/44/207204844.db2.gz	LEPNVICBLWVZKF-AATRIKPKSA-N	-1	0	371.374	3.378	50	5		FGBARM
O=c1oc2ccc([N+](=O)[O-])cc2cc1-c1nc2ccc([N+](=O)[O-])cc2[n-]1	ZINC000004016405	493861202	/nfs/dbraw/zinc/86/12/02/493861202.db2.gz	YGVHIDRFIUMDBK-UHFFFAOYSA-N	-1	0	352.262	3.153	50	5		FGBARM
O=C([O-])[C@H]1CS[C@H](c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)N1	ZINC000004974175	493904920	/nfs/dbraw/zinc/90/49/20/493904920.db2.gz	AATLPWJCAZWWPS-NOZJJQNGSA-N	-1	0	354.771	3.296	50	5		FGBARM
O=C1Nc2ccc(S(=O)(=O)[N-]c3ccccc3[N+](=O)[O-])c3cccc1c23	ZINC000004865509	207056967	/nfs/dbraw/zinc/05/69/67/207056967.db2.gz	RKDYFJHBWTXEGC-UHFFFAOYSA-N	-1	0	369.358	3.115	50	5		FGBARM
COc1ccc(-n2nc([N+](=O)[O-])c([N-]c3ccc(C(C)C)cc3)[n+]2[O-])cc1	ZINC000004919890	207063133	/nfs/dbraw/zinc/06/31/33/207063133.db2.gz	KYVKXFGMGUYVTL-UHFFFAOYSA-N	-1	0	369.381	3.290	50	5		FGBARM
O=c1nc2n(-c3cccc(C(F)(F)F)c3)c3ccccc3cc-2c(=O)[n-]1	ZINC000001024325	493782239	/nfs/dbraw/zinc/78/22/39/493782239.db2.gz	ZWPHJWGNKCTUOD-UHFFFAOYSA-N	-1	0	357.291	3.198	50	5		FGBARM
Cc1cc(Br)ccc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000001214631	493790445	/nfs/dbraw/zinc/79/04/45/493790445.db2.gz	YVOQQMKKABZDHX-UHFFFAOYSA-N	-1	0	371.212	3.467	50	5		FGBARM
COc1c(Br)c([O-])c(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000048523963	493835462	/nfs/dbraw/zinc/83/54/62/493835462.db2.gz	NWHXBBKAMBJPAK-UHFFFAOYSA-N	-1	0	352.140	3.303	50	5		FGBARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(Cl)c([N+](=O)[O-])c2)c1	ZINC000005126980	493914651	/nfs/dbraw/zinc/91/46/51/493914651.db2.gz	JJSTVLFVOVSVQE-UHFFFAOYSA-N	-1	0	372.786	3.066	50	5		FGBARM
Cc1ccccc1-c1cc([N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)n[nH]1	ZINC000079015931	494392987	/nfs/dbraw/zinc/39/29/87/494392987.db2.gz	ZIDZEKFCJXMFFI-UHFFFAOYSA-N	-1	0	372.406	3.403	50	5		FGBARM
COc1cc([C@@H]2CC(c3cccs3)=NN2C(C)=O)cc([N+](=O)[O-])c1[O-]	ZINC000253433446	497333717	/nfs/dbraw/zinc/33/37/17/497333717.db2.gz	XABCOIBIIAVGOX-LBPRGKRZSA-N	-1	0	361.379	3.068	50	5		FGBARM
O=[N+]([O-])c1ccc(C([O-])=CS(=O)(=O)c2ccc3ccccc3c2)cc1	ZINC000001111539	219371237	/nfs/dbraw/zinc/37/12/37/219371237.db2.gz	BUXVGZCFTOQICB-UHFFFAOYSA-N	-1	0	355.371	3.405	50	5		FGBARM
O=C1c2ccccc2N[C@@H](c2ccc([O-])c([N+](=O)[O-])c2)N1C[C@H]1CCCO1	ZINC000022313317	211345962	/nfs/dbraw/zinc/34/59/62/211345962.db2.gz	GHCHVSIOARYUCN-FZKQIMNGSA-N	-1	0	369.377	3.046	50	5		FGBARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000004310080	493872498	/nfs/dbraw/zinc/87/24/98/493872498.db2.gz	ZGOIVAYPWCHXCN-UHFFFAOYSA-N	-1	0	356.787	3.366	50	5		FGBARM
COc1cc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(OC)cc1Cl	ZINC000000723657	210265938	/nfs/dbraw/zinc/26/59/38/210265938.db2.gz	NEHRMHOJLVXHPS-UHFFFAOYSA-N	-1	0	372.786	3.066	50	5		FGBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(-c3ccc(Cl)cc3)o2)[nH]1	ZINC000013943425	211065461	/nfs/dbraw/zinc/06/54/61/211065461.db2.gz	XAMSWZVALAACFI-FNORWQNLSA-N	-1	0	359.725	3.468	50	5		FGBARM
Nc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2Cl)cc1[N+](=O)[O-]	ZINC000005602311	493936365	/nfs/dbraw/zinc/93/63/65/493936365.db2.gz	OISOUIRJGWQODE-UHFFFAOYSA-N	-1	0	362.194	3.285	50	5		FGBARM
O=c1oc2ccccc2c([O-])c1[C@H](C[N+](=O)[O-])c1c[nH]c2ccccc21	ZINC000006062630	493949930	/nfs/dbraw/zinc/94/99/30/493949930.db2.gz	XHXIFJBIZVTSSH-CQSZACIVSA-N	-1	0	350.330	3.389	50	5		FGBARM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2nc3ccc(F)cc3s2)c1	ZINC000033048537	494039918	/nfs/dbraw/zinc/03/99/18/494039918.db2.gz	POXHXRGLORMDON-UHFFFAOYSA-N	-1	0	353.356	3.144	50	5		FGBARM
COc1cc(OC)c(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)cc1Cl	ZINC000035310599	494074017	/nfs/dbraw/zinc/07/40/17/494074017.db2.gz	LUEXESISLPXSCY-UHFFFAOYSA-N	-1	0	352.730	3.223	50	5		FGBARM
COc1cc([C@H]2CC(c3cccs3)=NN2C(C)=O)cc([N+](=O)[O-])c1[O-]	ZINC000253433445	497333954	/nfs/dbraw/zinc/33/39/54/497333954.db2.gz	XABCOIBIIAVGOX-GFCCVEGCSA-N	-1	0	361.379	3.068	50	5		FGBARM
CC[C@@H](C(=O)[O-])n1cnc2scc(-c3cccc([N+](=O)[O-])c3)c2c1=O	ZINC000001925540	210375255	/nfs/dbraw/zinc/37/52/55/210375255.db2.gz	RVAQVKQUJYNXGA-LBPRGKRZSA-N	-1	0	359.363	3.069	50	5		FGBARM
O=C([O-])[C@@H]1CC=C(Cl)C[C@@H]1C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000004918921	493900967	/nfs/dbraw/zinc/90/09/67/493900967.db2.gz	XPYKNMWDXPRBSB-ZJUUUORDSA-N	-1	0	359.165	3.420	50	5		FGBARM
O=C1N=C(SCc2ccc([N+](=O)[O-])cc2)N=C([O-])C1c1ccccc1	ZINC000010059013	494141620	/nfs/dbraw/zinc/14/16/20/494141620.db2.gz	SOZLLFSKQNPBJM-UHFFFAOYSA-N	-1	0	355.375	3.343	50	5		FGBARM
Cc1cc([O-])c(C2=NCCS[C@@H](c3ccccc3[N+](=O)[O-])C2)c(=O)o1	ZINC000000754498	210267748	/nfs/dbraw/zinc/26/77/48/210267748.db2.gz	CFKZJJIXFWTWON-OAHLLOKOSA-N	-1	0	360.391	3.229	50	5		FGBARM
CCOC(=O)c1nc2ccccc2c(Nc2cc([N+](=O)[O-])ccc2[O-])n1	ZINC000019691353	211244952	/nfs/dbraw/zinc/24/49/52/211244952.db2.gz	VLKGHQOUINWHIB-UHFFFAOYSA-N	-1	0	354.322	3.164	50	5		FGBARM
O=C([O-])[C@H]1C2CCC(CC2)[C@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000017073109	211178198	/nfs/dbraw/zinc/17/81/98/211178198.db2.gz	NYUOMMWJPPILNO-YJBSTTGXSA-N	-1	0	352.774	3.324	50	5		FGBARM
O=c1nc2n(-c3cccc(Cl)c3)c3cc(Cl)ccc3cc-2c(=O)[n-]1	ZINC000002245863	210386703	/nfs/dbraw/zinc/38/67/03/210386703.db2.gz	RQMPEPGVTKGQDB-UHFFFAOYSA-N	-1	0	358.184	3.486	50	5		FGBARM
Cc1ccc(N2CCN(c3ccc(C(=O)[O-])cc3[N+](=O)[O-])[C@H](C)C2)cc1	ZINC000004660458	132823768	/nfs/dbraw/zinc/82/37/68/132823768.db2.gz	LRYAEICZVQXEAB-CQSZACIVSA-N	-1	0	355.394	3.317	50	5		FGBARM
COc1ccc(/C([O-])=C/c2nc3ccc([N+](=O)[O-])cc3oc2=O)cc1OC	ZINC000102861836	222312330	/nfs/dbraw/zinc/31/23/30/222312330.db2.gz	YUPNANUWLBIWNX-ZROIWOOFSA-N	-1	0	370.317	3.170	50	5		FGBARM
Cc1cc(S(=O)(=O)[N-]c2ccc3cc([N+](=O)[O-])ccc3n2)ccc1F	ZINC000084090251	494048132	/nfs/dbraw/zinc/04/81/32/494048132.db2.gz	HSMGFJAVCUGWRD-UHFFFAOYSA-N	-1	0	361.354	3.391	50	5		FGBARM
O=C([O-])CCC(=O)N1N=C(c2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1	ZINC000225848114	222874104	/nfs/dbraw/zinc/87/41/04/222874104.db2.gz	MHPNYDPZLRSUIH-QGZVFWFLSA-N	-1	0	367.361	3.137	50	5		FGBARM
O=C(Nc1cccc(Oc2cnccn2)c1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000079064782	221685486	/nfs/dbraw/zinc/68/54/86/221685486.db2.gz	PGEMZIVPUMVAJE-UHFFFAOYSA-N	-1	0	352.306	3.135	50	5		FGBARM
O=C1Nc2ccc(S(=O)(=O)[N-]c3ccc([N+](=O)[O-])cc3)c3cccc1c23	ZINC000003876312	493858781	/nfs/dbraw/zinc/85/87/81/493858781.db2.gz	LFCLFZFCLVWNJI-UHFFFAOYSA-N	-1	0	369.358	3.115	50	5		FGBARM
Cc1cc(C)cc(C[C@@H](CC(=O)[O-])C(=O)Nc2ccc([N+](=O)[O-])cc2)c1	ZINC000005170689	493917494	/nfs/dbraw/zinc/91/74/94/493917494.db2.gz	YLACXLFJEUHPSX-HNNXBMFYSA-N	-1	0	356.378	3.484	50	5		FGBARM
CCC(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1C	ZINC000044331009	494351300	/nfs/dbraw/zinc/35/13/00/494351300.db2.gz	AVIAGLOKVHBZQQ-UHFFFAOYSA-N	-1	0	363.395	3.053	50	5		FGBARM
Cc1ccc(N2CCN(c3ccc(C(=O)[O-])cc3[N+](=O)[O-])[C@@H](C)C2)cc1	ZINC000020664463	494478866	/nfs/dbraw/zinc/47/88/66/494478866.db2.gz	LRYAEICZVQXEAB-AWEZNQCLSA-N	-1	0	355.394	3.317	50	5		FGBARM
Cc1ccc(-n2c3cccc(Cl)c3cc3c(=O)[n-]c(=O)nc2-3)c(C)c1	ZINC000017194810	211180551	/nfs/dbraw/zinc/18/05/51/211180551.db2.gz	YVNKQXNAWSEMMX-UHFFFAOYSA-N	-1	0	351.793	3.449	50	5		FGBARM
CCOc1ccc([N-]S(=O)(=O)c2ccc(OCC)cc2[N+](=O)[O-])cc1	ZINC000005150626	210604096	/nfs/dbraw/zinc/60/40/96/210604096.db2.gz	LMPWZXWCESOIBI-UHFFFAOYSA-N	-1	0	366.395	3.193	50	5		FGBARM
CC(C)(C)Cc1nnc([N-]C(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])s1	ZINC000002110232	210380006	/nfs/dbraw/zinc/38/00/06/210380006.db2.gz	PTXCSSZYUURWNR-UHFFFAOYSA-N	-1	0	365.371	3.195	50	5		FGBARM
Cc1c([N+](=O)[O-])cc([N+](=O)[O-])c(Nc2ccc(C(=O)[O-])cc2)c1[N+](=O)[O-]	ZINC000100569070	222247092	/nfs/dbraw/zinc/24/70/92/222247092.db2.gz	MMPNRHDQNISXQX-UHFFFAOYSA-N	-1	0	362.254	3.161	50	5		FGBARM
O=C([O-])C[C@H](NC(=O)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686328	493886664	/nfs/dbraw/zinc/88/66/64/493886664.db2.gz	LHVDAMJHBYPGAU-AWEZNQCLSA-N	-1	0	366.732	3.333	50	5		FGBARM
O=C(NCCOc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000034858350	494068698	/nfs/dbraw/zinc/06/86/98/494068698.db2.gz	KTUNPRHIFCQPOW-UHFFFAOYSA-N	-1	0	352.346	3.262	50	5		FGBARM
O=C1c2ccccc2N[C@H](c2ccc([O-])c([N+](=O)[O-])c2)N1C[C@@H]1CCCO1	ZINC000022313312	211345765	/nfs/dbraw/zinc/34/57/65/211345765.db2.gz	GHCHVSIOARYUCN-UGSOOPFHSA-N	-1	0	369.377	3.046	50	5		FGBARM
Cc1ccc(C(=O)[O-])c(C(=O)Nc2nc3cc([N+](=O)[O-])ccc3s2)c1	ZINC000004892954	493899248	/nfs/dbraw/zinc/89/92/48/493899248.db2.gz	PLEIQLGTYJHHCL-UHFFFAOYSA-N	-1	0	357.347	3.463	50	5		FGBARM
O=C([O-])CCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000004950911	493903969	/nfs/dbraw/zinc/90/39/69/493903969.db2.gz	MVWOYLBXRJDFRS-CQSZACIVSA-N	-1	0	373.390	3.199	50	5		FGBARM
O=[N+]([O-])c1nn(-c2ccc(Cl)cc2)[n+]([O-])c1[N-]c1ccc(Cl)cc1	ZINC000004922970	210580803	/nfs/dbraw/zinc/58/08/03/210580803.db2.gz	XTZHAESGFQICEC-UHFFFAOYSA-N	-1	0	366.164	3.464	50	5		FGBARM
O=C([O-])CSc1c(=O)[nH]c2ccc([N+](=O)[O-])cc2c1-c1ccccc1	ZINC000004619185	210545739	/nfs/dbraw/zinc/54/57/39/210545739.db2.gz	CQBJWXJQRHHGET-UHFFFAOYSA-N	-1	0	356.359	3.280	50	5		FGBARM
Cc1ccc(C)c(N2CCN(c3ccc(C(=O)[O-])cc3[N+](=O)[O-])CC2)c1	ZINC000004660462	132387073	/nfs/dbraw/zinc/38/70/73/132387073.db2.gz	NFMKACYXIZYAFZ-UHFFFAOYSA-N	-1	0	355.394	3.236	50	5		FGBARM
COc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000004015655	493860929	/nfs/dbraw/zinc/86/09/29/493860929.db2.gz	IINYSQLJGNSHSP-UHFFFAOYSA-N	-1	0	367.701	3.123	50	5		FGBARM
CCc1cccc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])c1	ZINC000004757634	493892427	/nfs/dbraw/zinc/89/24/27/493892427.db2.gz	UNXPAEPVFQNYGF-UHFFFAOYSA-N	-1	0	359.773	3.373	50	5		FGBARM
O=[N+]([O-])c1nn(-c2cccc(Cl)c2)[n+]([O-])c1[N-]c1ccc(Cl)cc1	ZINC000004923573	493900836	/nfs/dbraw/zinc/90/08/36/493900836.db2.gz	JGCVGQWGGAQXJM-UHFFFAOYSA-N	-1	0	366.164	3.464	50	5		FGBARM
Cc1ccc(S(=O)(=O)[N-][C@@H](C(C)(C)C)C(F)(F)F)c([N+](=O)[O-])c1	ZINC000072307393	494149668	/nfs/dbraw/zinc/14/96/68/494149668.db2.gz	WFRGTMVCXAZGPG-NSHDSACASA-N	-1	0	354.350	3.159	50	5		FGBARM
COc1cc(/C=C\c2nc(C(=O)[O-])c(C)s2)c([N+](=O)[O-])cc1OC	ZINC000576484800	506169864	/nfs/dbraw/zinc/16/98/64/506169864.db2.gz	ZWTQVZGMFSNJLN-PLNGDYQASA-N	-1	0	350.352	3.246	50	5		FGBARM
Cc1cc([O-])c(C2=NCCS[C@@H](c3cccc([N+](=O)[O-])c3)C2)c(=O)o1	ZINC000000754500	219317763	/nfs/dbraw/zinc/31/77/63/219317763.db2.gz	TVQTZRMUIMVVAQ-OAHLLOKOSA-N	-1	0	360.391	3.229	50	5		FGBARM
O=C([O-])CCC(=O)N1N=C(c2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000225848131	222874583	/nfs/dbraw/zinc/87/45/83/222874583.db2.gz	MHPNYDPZLRSUIH-KRWDZBQOSA-N	-1	0	367.361	3.137	50	5		FGBARM
O=C([N-]c1c(Cl)cc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1	ZINC000100495067	222244835	/nfs/dbraw/zinc/24/48/35/222244835.db2.gz	YCODKZJFEQWCMB-UHFFFAOYSA-N	-1	0	366.673	3.317	50	5		FGBARM
Cc1cccc([N+](=O)[O-])c1[N-]S(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000048546203	493836720	/nfs/dbraw/zinc/83/67/20/493836720.db2.gz	HVWYKNFJHJGDOD-SJCJKPOMSA-N	-1	0	366.439	3.040	50	5		FGBARM
COc1cc(CN2CCN(c3cc(C)ccc3C)CC2)cc([N+](=O)[O-])c1[O-]	ZINC000004980481	493905505	/nfs/dbraw/zinc/90/55/05/493905505.db2.gz	XSWKMCXVYYEOON-UHFFFAOYSA-N	-1	0	371.437	3.248	50	5		FGBARM
Cc1c(C(=O)[O-])sc2[nH]c(C=Cc3cccc([N+](=O)[O-])c3)nc(=O)c12	ZINC000033502490	494061091	/nfs/dbraw/zinc/06/10/91/494061091.db2.gz	CBWSPJQHFPJMLI-WAYWQWQTSA-N	-1	0	357.347	3.070	50	5		FGBARM
CCc1ccc(-n2c3cccc(Cl)c3cc3c(=O)[n-]c(=O)nc2-3)cc1	ZINC000009312755	494120340	/nfs/dbraw/zinc/12/03/40/494120340.db2.gz	URCSWHIMTZTOAT-UHFFFAOYSA-N	-1	0	351.793	3.395	50	5		FGBARM
O=C([O-])CCC(=O)N1N=C(c2ccccc2)C[C@H]1c1ccccc1[N+](=O)[O-]	ZINC000170620215	495537308	/nfs/dbraw/zinc/53/73/08/495537308.db2.gz	IUFUFSQITZTWIW-KRWDZBQOSA-N	-1	0	367.361	3.137	50	5		FGBARM
Cc1ccccc1[C@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000164778448	496632450	/nfs/dbraw/zinc/63/24/50/496632450.db2.gz	ZPGPWOYHLQJKMG-FZKQIMNGSA-N	-1	0	356.378	3.211	50	5		FGBARM
O=[N+]([O-])c1ccc2nc([N-]S(=O)(=O)c3ccc(F)cc3)sc2c1	ZINC000000898072	219337747	/nfs/dbraw/zinc/33/77/47/219337747.db2.gz	CLDXLRRETAFXDQ-UHFFFAOYSA-N	-1	0	353.356	3.144	50	5		FGBARM
CCOc1ccc([N-]S(=O)(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)cc1	ZINC000020491922	220329150	/nfs/dbraw/zinc/32/91/50/220329150.db2.gz	BPEKAGUOQGPZEW-UHFFFAOYSA-N	-1	0	361.379	3.276	50	5		FGBARM
O=c1nc2n(-c3ccc(Cl)cc3)c3cccc(Cl)c3cc-2c(=O)[n-]1	ZINC000002255438	493804575	/nfs/dbraw/zinc/80/45/75/493804575.db2.gz	HNMRXJZYGHPHMZ-UHFFFAOYSA-N	-1	0	358.184	3.486	50	5		FGBARM
O=C([O-])C[C@@H](NC(=O)c1cccs1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686333	493886433	/nfs/dbraw/zinc/88/64/33/493886433.db2.gz	KYCAXEBTCBHBDR-LLVKDONJSA-N	-1	0	354.771	3.256	50	5		FGBARM
Cc1nn(CCc2n[n-]c(=S)n2-c2cccc(C)c2)c(C)c1[N+](=O)[O-]	ZINC000005427265	493929552	/nfs/dbraw/zinc/92/95/52/493929552.db2.gz	VRRDUIBPADYHAW-UHFFFAOYSA-N	-1	0	358.427	3.203	50	5		FGBARM
Cc1csc(-c2nonc2[N-]C(=O)c2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000012599029	220012445	/nfs/dbraw/zinc/01/24/45/220012445.db2.gz	KPGHZCNKMFVHNA-UHFFFAOYSA-N	-1	0	365.758	3.315	50	5		FGBARM
O=C1NC(=S)SC1=Cc1cc(Br)c([O-])c([N+](=O)[O-])c1	ZINC000013785927	220094352	/nfs/dbraw/zinc/09/43/52/220094352.db2.gz	QYAAPVNJOCDHGC-XVNBXDOJSA-N	-1	0	361.198	3.392	50	5		FGBARM
CC(C)[C@@H](Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000003878095	493858815	/nfs/dbraw/zinc/85/88/15/493858815.db2.gz	NOJKUUNUGNDWAE-SECBINFHSA-N	-1	0	351.237	3.043	50	5		FGBARM
O=C([O-])C[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)c1cccc([N+](=O)[O-])c1	ZINC000004580730	493883407	/nfs/dbraw/zinc/88/34/07/493883407.db2.gz	VHBCZRHHJMJHSR-UTNBAMHJSA-N	-1	0	372.421	3.443	50	5		FGBARM
O=C([O-])C[C@H](NC(=O)c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686805	493887025	/nfs/dbraw/zinc/88/70/25/493887025.db2.gz	YIFLJUCDPYDSSB-AWEZNQCLSA-N	-1	0	366.732	3.333	50	5		FGBARM
O=C([O-])[C@H]1CC=C(Cl)C[C@@H]1C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000004918917	493900767	/nfs/dbraw/zinc/90/07/67/493900767.db2.gz	XPYKNMWDXPRBSB-UWVGGRQHSA-N	-1	0	359.165	3.420	50	5		FGBARM
O=[N+]([O-])c1ccccc1[N-]S(=O)(=O)c1ccc(Br)cc1	ZINC000005249554	493921163	/nfs/dbraw/zinc/92/11/63/493921163.db2.gz	FKEUOMHHALIXJJ-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
Cc1nc2cc([N-]S(=O)(=O)c3cc([N+](=O)[O-])cc(C)c3C)ccc2o1	ZINC000007325406	494015423	/nfs/dbraw/zinc/01/54/23/494015423.db2.gz	GZGLWEQSNPPYJC-UHFFFAOYSA-N	-1	0	361.379	3.462	50	5		FGBARM
COc1cc(C=C(Cl)c2nc3ccccc3c(=O)[nH]2)cc([N+](=O)[O-])c1[O-]	ZINC000007503430	494025617	/nfs/dbraw/zinc/02/56/17/494025617.db2.gz	PNNYNVSGDOZKRY-WDZFZDKYSA-N	-1	0	373.752	3.282	50	5		FGBARM
CN(CCCOc1cccc(Cl)c1)C(=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000225704785	497072041	/nfs/dbraw/zinc/07/20/41/497072041.db2.gz	SLOCSQTYVGVCJB-UHFFFAOYSA-N	-1	0	364.785	3.495	50	5		FGBARM
COc1ccc2[nH]c(C(=O)[O-])c(NC(=O)c3ccccc3[N+](=O)[O-])c2c1	ZINC000002319929	493805555	/nfs/dbraw/zinc/80/55/55/493805555.db2.gz	KBCDHWKGQZTNTH-UHFFFAOYSA-N	-1	0	355.306	3.035	50	5		FGBARM
CCCCO[P@](=O)([O-])c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000003122145	493830707	/nfs/dbraw/zinc/83/07/07/493830707.db2.gz	XGNJXJMCWVIGCK-UHFFFAOYSA-N	-1	0	372.192	3.149	50	5		FGBARM
CC1(C)CO[C@H](c2ccccc2)CN1C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000136876363	495407600	/nfs/dbraw/zinc/40/76/00/495407600.db2.gz	BZQQVSWIDYXCIM-INIZCTEOSA-N	-1	0	356.378	3.293	50	5		FGBARM
CCCOc1ccc([C@@H](CC(=O)[O-])NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000003623673	219522772	/nfs/dbraw/zinc/52/27/72/219522772.db2.gz	QEECJLZUJMANSG-QGZVFWFLSA-N	-1	0	372.377	3.329	50	5		FGBARM
O=c1oc2ccccc2c([O-])c1Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000006455077	219731450	/nfs/dbraw/zinc/73/14/50/219731450.db2.gz	LRCRURZYBBNMMW-UHFFFAOYSA-N	-1	0	360.303	3.466	50	5		FGBARM
O=C([O-])c1ccc(N2CCN(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1	ZINC000004054082	132266514	/nfs/dbraw/zinc/26/65/14/132266514.db2.gz	INNGSPPTVLBOGQ-UHFFFAOYSA-N	-1	0	361.785	3.273	50	5		FGBARM
C[C@H]1CN(c2ccccc2NC(=O)c2cccc([O-])c2[N+](=O)[O-])C[C@H](C)O1	ZINC000253419367	132293823	/nfs/dbraw/zinc/29/38/23/132293823.db2.gz	KIDVMPGUTDMFGC-STQMWFEESA-N	-1	0	371.393	3.166	50	5		FGBARM
COc1cccc([C@H](C[N+](=O)[O-])c2c(C)[n-]n(-c3ccccc3)c2=O)c1	ZINC000100848887	222255721	/nfs/dbraw/zinc/25/57/21/222255721.db2.gz	BZVMJEMSBNUIIM-KRWDZBQOSA-N	-1	0	353.378	3.304	50	5		FGBARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NSc1ccccc1[N+](=O)[O-]	ZINC000028640874	493795129	/nfs/dbraw/zinc/79/51/29/493795129.db2.gz	VJQMAIIBZHIBSM-AWEZNQCLSA-N	-1	0	357.391	3.369	50	5		FGBARM
O=C([N-]c1nnc(-c2ccccc2)s1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000003016547	493829255	/nfs/dbraw/zinc/82/92/55/493829255.db2.gz	IKOOLDGQXYDMEU-UHFFFAOYSA-N	-1	0	371.334	3.274	50	5		FGBARM
Nc1nc(Nc2ccc([N+](=O)[O-])cc2)nc(-c2cc(Cl)ccc2[O-])n1	ZINC000048523192	493834993	/nfs/dbraw/zinc/83/49/93/493834993.db2.gz	WSLMTIKDUSAUNN-UHFFFAOYSA-N	-1	0	358.745	3.132	50	5		FGBARM
COc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(Br)ccc1[O-]	ZINC000004014147	493861416	/nfs/dbraw/zinc/86/14/16/493861416.db2.gz	BACXBDOAVMIOIW-UHFFFAOYSA-N	-1	0	367.155	3.324	50	5		FGBARM
COc1ccc(S(=O)(=O)[N-]c2cc(C)c(C)cc2[N+](=O)[O-])cc1OC	ZINC000004297026	493871592	/nfs/dbraw/zinc/87/15/92/493871592.db2.gz	HRDCZJSHUQSWOD-UHFFFAOYSA-N	-1	0	366.395	3.030	50	5		FGBARM
O=[N+]([O-])c1cc(Br)ccc1[N-]S(=O)(=O)c1ccccc1	ZINC000004522174	493880375	/nfs/dbraw/zinc/88/03/75/493880375.db2.gz	ZSXCYJOENVRONM-UHFFFAOYSA-N	-1	0	357.185	3.158	50	5		FGBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])c(C)c1	ZINC000004822396	493893981	/nfs/dbraw/zinc/89/39/81/493893981.db2.gz	FVYZCRNJNGCYKZ-UHFFFAOYSA-N	-1	0	359.773	3.428	50	5		FGBARM
COc1ccc(Br)cc1C(=O)Nc1ccc([N+](=O)[O-])cc1[O-]	ZINC000004832909	493895021	/nfs/dbraw/zinc/89/50/21/493895021.db2.gz	MIXSKATUZNCMME-UHFFFAOYSA-N	-1	0	367.155	3.324	50	5		FGBARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000006159134	493953108	/nfs/dbraw/zinc/95/31/08/493953108.db2.gz	QEWFTKSICFCOEQ-UHFFFAOYSA-N	-1	0	354.771	3.252	50	5		FGBARM
O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CCC[C@H](c2nc3ccccc3[nH]2)C1	ZINC000037183536	494102519	/nfs/dbraw/zinc/10/25/19/494102519.db2.gz	AKBVJYMJLHNUDJ-ZDUSSCGKSA-N	-1	0	366.377	3.197	50	5		FGBARM
O=[N+]([O-])c1ccc(CSC2=Nc3ccc(F)cc3S(=O)(=O)[N-]2)cc1	ZINC000009762025	494133295	/nfs/dbraw/zinc/13/32/95/494133295.db2.gz	PORNBOYJGXZEPR-UHFFFAOYSA-N	-1	0	367.383	3.138	50	5		FGBARM
O=C(NCCCSc1ccc(F)cc1)c1ccc([O-])cc1[N+](=O)[O-]	ZINC000170595757	495531613	/nfs/dbraw/zinc/53/16/13/495531613.db2.gz	PDKYRTYFQWSDBW-UHFFFAOYSA-N	-1	0	350.371	3.352	50	5		FGBARM
O=C([O-])CCC(=O)N1N=C(c2ccccc2)C[C@@H]1c1ccccc1[N+](=O)[O-]	ZINC000170620216	495536855	/nfs/dbraw/zinc/53/68/55/495536855.db2.gz	IUFUFSQITZTWIW-QGZVFWFLSA-N	-1	0	367.361	3.137	50	5		FGBARM
Cc1cccc(-n2c3cccc(Cl)c3cc3c(=O)[n-]c(=O)nc2-3)c1C	ZINC000002256666	493804685	/nfs/dbraw/zinc/80/46/85/493804685.db2.gz	XQJGCGUUTSSTLD-UHFFFAOYSA-N	-1	0	351.793	3.449	50	5		FGBARM
C[C@@H](On1c2cc([N+](=O)[O-])ccc2nc1-c1ccc(Cl)cc1)C(=O)[O-]	ZINC000004001986	493861173	/nfs/dbraw/zinc/86/11/73/493861173.db2.gz	VJCRNBJHJVWPDU-SECBINFHSA-N	-1	0	361.741	3.167	50	5		FGBARM
CCCCN(CCCC)c1nc(=O)[n-]c(Nc2ccc([N+](=O)[O-])cc2)n1	ZINC000005250177	493921507	/nfs/dbraw/zinc/92/15/07/493921507.db2.gz	RAIYKPUIBOOREX-UHFFFAOYSA-N	-1	0	360.418	3.223	50	5		FGBARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000007056400	493998376	/nfs/dbraw/zinc/99/83/76/493998376.db2.gz	CYEJLVQMCBMQHT-UHFFFAOYSA-N	-1	0	356.787	3.366	50	5		FGBARM
Cc1ccc(-c2nn3c(CCCC(=O)[O-])nc4ccccc4c3nc2=O)cc1	ZINC000032934898	494030934	/nfs/dbraw/zinc/03/09/34/494030934.db2.gz	KDVGVOMDKHEDLC-UHFFFAOYSA-N	-1	0	374.400	3.020	50	5		FGBARM
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@@H](c2ccc(F)cc2)O1	ZINC000170644908	495544855	/nfs/dbraw/zinc/54/48/55/495544855.db2.gz	WGRLUVKWCZTLOL-GTNSWQLSSA-N	-1	0	360.341	3.042	50	5		FGBARM
O=C([O-])c1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(Br)cc1	ZINC000004955095	695544895	/nfs/dbraw/zinc/54/48/95/695544895.db2.gz	ZXTSCTHBHQEDDH-UHFFFAOYSA-N	-1	0	365.139	3.308	50	5		FGBARM
O=[N+]([O-])c1cc(C([O-])(C(F)(F)F)C(F)(F)F)cc([N+](=O)[O-])c1Cl	ZINC000003098197	493830736	/nfs/dbraw/zinc/83/07/36/493830736.db2.gz	UXFXOJGSXFNBDO-UHFFFAOYSA-N	-1	0	368.573	3.469	50	5		FGBARM
O=C([O-])C[C@@H](NC(=O)Cc1cccs1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004623341	493884694	/nfs/dbraw/zinc/88/46/94/493884694.db2.gz	WLMPUGNHHVMOTG-CYBMUJFWSA-N	-1	0	368.798	3.184	50	5		FGBARM
O=[N+]([O-])c1nn(-c2cccc(Cl)c2)[n+]([O-])c1[N-]c1cccc(Cl)c1	ZINC000004923458	493900732	/nfs/dbraw/zinc/90/07/32/493900732.db2.gz	IGGBRWODFRSBRP-UHFFFAOYSA-N	-1	0	366.164	3.464	50	5		FGBARM
O=[N+]([O-])c1cc(F)ccc1S(=O)(=O)[N-]c1ccccc1OC(F)F	ZINC000009751763	494131876	/nfs/dbraw/zinc/13/18/76/494131876.db2.gz	LMYPSNXRFHNUNB-UHFFFAOYSA-N	-1	0	362.285	3.136	50	5		FGBARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000012042447	494200185	/nfs/dbraw/zinc/20/01/85/494200185.db2.gz	HDDZLPUDTJTKEC-UHFFFAOYSA-N	-1	0	356.787	3.366	50	5		FGBARM