smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)(C)OC(=O)N1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)C[C@H]1C(=O)[O-]	ZINC000014632518	539604100	/nfs/dbraw/zinc/60/41/00/539604100.db2.gz	YMUUKTKPQPJUOH-STQMWFEESA-N	-1	0	352.343	2.436	50	5		FEBARM
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000001110639	219371750	/nfs/dbraw/zinc/37/17/50/219371750.db2.gz	SQYMSOMMKPSXNR-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
CC(=O)Nc1ccc(C(=O)N[C@H](CC(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1	ZINC000004601601	204150826	/nfs/dbraw/zinc/15/08/26/204150826.db2.gz	OQUWEGCJYHXGNV-MRXNPFEDSA-N	-1	0	371.349	2.499	50	5		FEBARM
O=C([O-])C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2	ZINC000004718024	204158140	/nfs/dbraw/zinc/15/81/40/204158140.db2.gz	AASAAGQVBJFBKV-ZDUSSCGKSA-N	-1	0	358.306	2.269	50	5		FEBARM
O=[N+]([O-])c1cnc([N-]c2ccc(Br)c[n+]2[O-])c([N+](=O)[O-])c1	ZINC000004947523	204179815	/nfs/dbraw/zinc/17/98/15/204179815.db2.gz	JGBPIKCCCSDYLH-UHFFFAOYSA-N	-1	0	356.092	2.038	50	5		FEBARM
COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000008397431	204329691	/nfs/dbraw/zinc/32/96/91/204329691.db2.gz	HSHOLRVDTHFUSH-UHFFFAOYSA-N	-1	0	361.266	2.462	50	5		FEBARM
CC[C@H](NC(=O)COc1ccc2c(c1)oc(=O)c1ccccc21)C(=O)[O-]	ZINC000002117586	206152340	/nfs/dbraw/zinc/15/23/40/206152340.db2.gz	GOHKFLNWKRYMFP-HNNXBMFYSA-N	-1	0	355.346	2.304	50	5	biogenic	FEBARM
COC(=O)C[C@H](c1cccc([N+](=O)[O-])c1)c1c(=O)nc2ccccn2c1[O-]	ZINC000205968681	206337575	/nfs/dbraw/zinc/33/75/75/206337575.db2.gz	SLYRZFDOEWJXEH-CYBMUJFWSA-N	-1	0	369.333	2.003	50	5		FEBARM
O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)cc(Br)c1[O-]	ZINC000094986263	542956260	/nfs/dbraw/zinc/95/62/60/542956260.db2.gz	OBUGUMOAUVFAHC-UHFFFAOYSA-N	-1	0	350.068	2.356	50	5		FEBARM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc([N+](=O)[O-])c(C)n1	ZINC000095466340	542972081	/nfs/dbraw/zinc/97/20/81/542972081.db2.gz	IPVKTWCBENFIBN-UHFFFAOYSA-N	-1	0	352.328	2.316	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)CCC[C@H](C)C(=O)[O-]	ZINC000097002765	543001937	/nfs/dbraw/zinc/00/19/37/543001937.db2.gz	ACLJAOCVNHZPPD-WDEREUQCSA-N	-1	0	374.415	2.161	50	5		FEBARM
O=c1c2ccccc2c([O-])c2sc3nnc(-c4ccccc4O)n3nc1-2	ZINC000261491957	549731259	/nfs/dbraw/zinc/73/12/59/549731259.db2.gz	MSKHBLLDTSUHHM-UHFFFAOYSA-N	-1	0	362.370	2.090	50	5		FEBARM
Cc1nn(C)c2ncc([N-]S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc12	ZINC000024376412	539730191	/nfs/dbraw/zinc/73/01/91/539730191.db2.gz	WQPSWHTYVIEBPH-UHFFFAOYSA-N	-1	0	361.383	2.294	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(OC)c(OC)c1	ZINC000002843370	204061893	/nfs/dbraw/zinc/06/18/93/204061893.db2.gz	IZQZMOLERYNIJY-UHFFFAOYSA-N	-1	0	368.367	2.421	50	5		FEBARM
COc1ccc([N-]S(=O)(=O)c2ccc(NC(C)=O)cc2)c([N+](=O)[O-])c1	ZINC000003833670	204111854	/nfs/dbraw/zinc/11/18/54/204111854.db2.gz	RJLLYYHFZOIBMY-UHFFFAOYSA-N	-1	0	365.367	2.363	50	5		FEBARM
Cc1cc(C)nc(SCC(=O)Nc2cc(C(=O)[O-])cc([N+](=O)[O-])c2)n1	ZINC000004720938	204157792	/nfs/dbraw/zinc/15/77/92/204157792.db2.gz	GBVVVYZGZSVACV-UHFFFAOYSA-N	-1	0	362.367	2.431	50	5		FEBARM
COc1cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[nH]2)cc(Cl)c1OC	ZINC000009234889	204359251	/nfs/dbraw/zinc/35/92/51/204359251.db2.gz	XUDOJIZATFVGQC-ONEGZZNKSA-N	-1	0	353.718	2.225	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1cnc2onc(C)c2c1	ZINC000058171177	205254683	/nfs/dbraw/zinc/25/46/83/205254683.db2.gz	RDNHLJHSZGNQRI-UHFFFAOYSA-N	-1	0	364.339	2.249	50	5		FEBARM
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)s1	ZINC000095364826	542960426	/nfs/dbraw/zinc/96/04/26/542960426.db2.gz	INMRUGRXUMPUTR-UHFFFAOYSA-N	-1	0	372.380	2.252	50	5		FEBARM
O=C([O-])c1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	ZINC000015895384	539625262	/nfs/dbraw/zinc/62/52/62/539625262.db2.gz	PFFDCOWCLVDNOK-UHFFFAOYSA-N	-1	0	352.280	2.034	50	5		FEBARM
O=c1nc2n(-c3ccc(F)cc3)c3ccc([N+](=O)[O-])cc3cc-2c(=O)[n-]1	ZINC000002214772	204029337	/nfs/dbraw/zinc/02/93/37/204029337.db2.gz	VXZYELCHWJKUOM-UHFFFAOYSA-N	-1	0	352.281	2.226	50	5		FEBARM
COc1ccc(CC(=O)N[C@H](CC(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1	ZINC000003889422	204113223	/nfs/dbraw/zinc/11/32/23/204113223.db2.gz	FQYIHORYBQJLKG-MRXNPFEDSA-N	-1	0	358.350	2.478	50	5		FEBARM
O=C([O-])C[C@H](NS(=O)(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1	ZINC000004580690	204148571	/nfs/dbraw/zinc/14/85/71/204148571.db2.gz	YKBXSLTXFRTIJJ-AWEZNQCLSA-N	-1	0	368.342	2.228	50	5		FEBARM
O=C([O-])C[C@H](NC(=O)c1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1	ZINC000004601998	204151077	/nfs/dbraw/zinc/15/10/77/204151077.db2.gz	MUDWFGLRMCBQNN-ZDUSSCGKSA-N	-1	0	358.306	2.269	50	5		FEBARM
Cc1ccc(Cn2cnc([N-]S(=O)(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000006373277	206241397	/nfs/dbraw/zinc/24/13/97/206241397.db2.gz	KBFVAOQANQVYOU-UHFFFAOYSA-N	-1	0	373.394	2.344	50	5		FEBARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000003879446	132385863	/nfs/dbraw/zinc/38/58/63/132385863.db2.gz	VFYGCPDPBGSRJC-HOTGVXAUSA-N	-1	0	361.398	2.134	50	5		FEBARM
O=C1N=NC(c2ccccc2[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])O1	ZINC000328596251	553794557	/nfs/dbraw/zinc/79/45/57/553794557.db2.gz	YZEWJDCRTGRKMV-UHFFFAOYSA-N	-1	0	362.323	2.151	50	5		FEBARM
O=C([O-])C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000000187915	539331543	/nfs/dbraw/zinc/33/15/43/539331543.db2.gz	MBSNNYACNFXHKA-CQSZACIVSA-N	-1	0	350.352	2.089	50	5		FEBARM
CC(C)(C)OC(=O)N1CCN(c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000013462158	539587630	/nfs/dbraw/zinc/58/76/30/539587630.db2.gz	CYGRJUZYSXUAMM-UHFFFAOYSA-N	-1	0	351.359	2.350	50	5		FEBARM
O=C([O-])c1cccnc1S[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000004278650	204130041	/nfs/dbraw/zinc/13/00/41/204130041.db2.gz	WZBLSPDCFLPTIQ-LBPRGKRZSA-N	-1	0	373.346	2.112	50	5		FEBARM
COc1cc([N-]S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc(OC)c1	ZINC000006316513	204244145	/nfs/dbraw/zinc/24/41/45/204244145.db2.gz	BDSWGAYJKKTLNP-UHFFFAOYSA-N	-1	0	368.367	2.421	50	5		FEBARM
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)c1	ZINC000009338365	204363632	/nfs/dbraw/zinc/36/36/32/204363632.db2.gz	MJYBZHTTWNTFLY-UHFFFAOYSA-N	-1	0	366.351	2.278	50	5		FEBARM
Cc1nc(C2([N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])CCCCC2)no1	ZINC000046800161	205139202	/nfs/dbraw/zinc/13/92/02/205139202.db2.gz	AFLSMLNYGMITRI-UHFFFAOYSA-N	-1	0	366.399	2.424	50	5		FEBARM
O=C1CCc2cc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc3c2N1CC3	ZINC000005153427	206189948	/nfs/dbraw/zinc/18/99/48/206189948.db2.gz	BEPVKVQTSNAGLK-UHFFFAOYSA-N	-1	0	373.390	2.231	50	5		FEBARM
Nc1ccc(C(=O)OCc2cc(=O)oc3cc(O)ccc23)cc1[N+](=O)[O-]	ZINC000007981893	206214395	/nfs/dbraw/zinc/21/43/95/206214395.db2.gz	LFFCLULXJKLNRC-UHFFFAOYSA-N	-1	0	356.290	2.346	50	5		FEBARM
Cc1cc(S(=O)(=O)N2[C@H](C(=O)[O-])CCC2(C)C)cc([N+](=O)[O-])c1C	ZINC000240333257	206546708	/nfs/dbraw/zinc/54/67/08/206546708.db2.gz	FCMJQFFAMDFWMO-LBPRGKRZSA-N	-1	0	356.400	2.228	50	5		FEBARM
COc1cccc(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3[O-])CC2)c1	ZINC000130269503	132251089	/nfs/dbraw/zinc/25/10/89/132251089.db2.gz	JBFGGBDKIYBLQW-UHFFFAOYSA-N	-1	0	357.366	2.271	50	5		FEBARM
CC(=O)Nc1ccc(C(=O)N[C@@H](CC(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1	ZINC000004601595	204150261	/nfs/dbraw/zinc/15/02/61/204150261.db2.gz	OQUWEGCJYHXGNV-INIZCTEOSA-N	-1	0	371.349	2.499	50	5		FEBARM
Cc1ccc(-c2noc(C[N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])n2)cc1	ZINC000005389134	204206500	/nfs/dbraw/zinc/20/65/00/204206500.db2.gz	PZLSFOSGCRSJFY-UHFFFAOYSA-N	-1	0	374.378	2.432	50	5		FEBARM
CC(C)(C)OC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)C[C@H]1C(=O)[O-]	ZINC000169725320	534838874	/nfs/dbraw/zinc/83/88/74/534838874.db2.gz	OEGVXCIIXAPYMY-ZDUSSCGKSA-N	-1	0	369.349	2.244	50	5		FEBARM
CC(C)(C)OC(=O)N1CCN(c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CC1	ZINC000016697266	534838965	/nfs/dbraw/zinc/83/89/65/534838965.db2.gz	UURLRAAZXIBLIQ-UHFFFAOYSA-N	-1	0	351.359	2.350	50	5		FEBARM
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000001150648	203988386	/nfs/dbraw/zinc/98/83/86/203988386.db2.gz	WQNTZTVPBZRUOS-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
CCOc1cc(Cl)cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[nH]2)c1O	ZINC000009189661	204357322	/nfs/dbraw/zinc/35/73/22/204357322.db2.gz	OWVIPRPKTARGCM-ONEGZZNKSA-N	-1	0	353.718	2.312	50	5		FEBARM
CCOC(=O)c1sc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)nc1C	ZINC000008816073	571133154	/nfs/dbraw/zinc/13/31/54/571133154.db2.gz	WGIKJNUSSSZUFV-UHFFFAOYSA-N	-1	0	371.396	2.337	50	5		FEBARM
O=c1nc2n(-c3ccccc3F)c3ccc([N+](=O)[O-])cc3cc-2c(=O)[n-]1	ZINC000002230500	539347189	/nfs/dbraw/zinc/34/71/89/539347189.db2.gz	ZTGMFDLJQLCOFW-UHFFFAOYSA-N	-1	0	352.281	2.226	50	5		FEBARM
O=[N+]([O-])c1cc(F)ccc1S(=O)(=O)[N-]c1ccc(-n2cccn2)nc1	ZINC000026539619	539788902	/nfs/dbraw/zinc/78/89/02/539788902.db2.gz	FFEQAYMOECFLCZ-UHFFFAOYSA-N	-1	0	363.330	2.115	50	5		FEBARM
CN(Cc1ccccc1N1CCOCC1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000036403765	539990216	/nfs/dbraw/zinc/99/02/16/539990216.db2.gz	AJQAHLPICXLYLB-UHFFFAOYSA-N	-1	0	371.393	2.409	50	5		FEBARM
CC(=O)N/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(=O)[O-])c1	ZINC000001152472	539339220	/nfs/dbraw/zinc/33/92/20/539339220.db2.gz	FYTFMPVGUIWRLK-CXUHLZMHSA-N	-1	0	369.333	2.409	50	5		FEBARM
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000028195953	539827754	/nfs/dbraw/zinc/82/77/54/539827754.db2.gz	ZUHTXGBDYUZELI-UHFFFAOYSA-N	-1	0	354.315	2.321	50	5		FEBARM
CC1=C(C(=O)OC2CCCC2)[C@H](c2ccc([O-])c([N+](=O)[O-])c2)NC(=O)N1	ZINC000036144757	205006809	/nfs/dbraw/zinc/00/68/09/205006809.db2.gz	CKAWYPVHDYMUOJ-HNNXBMFYSA-N	-1	0	361.354	2.414	50	5		FEBARM
COc1cc(/C=C2/NC(=O)N(c3ccccc3)C2=O)cc([N+](=O)[O-])c1[O-]	ZINC000100370272	543025015	/nfs/dbraw/zinc/02/50/15/543025015.db2.gz	QGDOZEDFQRCHHS-KPKJPENVSA-N	-1	0	355.306	2.406	50	5		FEBARM
Cc1ccc([O-])c(C(=O)c2cnn(C(=O)c3cc([N+](=O)[O-])cn3C)c2)c1	ZINC000014226636	539600122	/nfs/dbraw/zinc/60/01/22/539600122.db2.gz	DDJNWQOCXYDFOH-UHFFFAOYSA-N	-1	0	354.322	2.063	50	5		FEBARM
COc1cc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC	ZINC000017075555	539639125	/nfs/dbraw/zinc/63/91/25/539639125.db2.gz	GLPGOXUIGROJKR-UHFFFAOYSA-N	-1	0	368.367	2.421	50	5		FEBARM
COc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c(C(=O)[O-])cc1OC	ZINC000001119611	219373342	/nfs/dbraw/zinc/37/33/42/219373342.db2.gz	RNZHIXZMNBJXEB-UHFFFAOYSA-N	-1	0	360.322	2.491	50	5		FEBARM
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccccc2C(N)=O)cc1[N+](=O)[O-]	ZINC000007418156	207195261	/nfs/dbraw/zinc/19/52/61/207195261.db2.gz	LQRBJZUSNIVFJG-UHFFFAOYSA-N	-1	0	369.786	2.456	50	5		FEBARM
CC[C@@H](C(=O)[O-])N1C(=O)c2ccc([N+](=O)[O-])c3c([N+](=O)[O-])ccc(c23)C1=O	ZINC000016610034	207590380	/nfs/dbraw/zinc/59/03/80/207590380.db2.gz	JXUGXLNOJSMPHL-VIFPVBQESA-N	-1	0	373.277	2.115	50	5		FEBARM
COC(=O)C[C@H](c1cccc([N+](=O)[O-])c1)c1c([O-])nc2ccccn2c1=O	ZINC000096118236	542992136	/nfs/dbraw/zinc/99/21/36/542992136.db2.gz	PQXRLWVUNNXICR-CYBMUJFWSA-N	-1	0	369.333	2.003	50	5		FEBARM
COC(=O)c1ccccc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000004980363	539397326	/nfs/dbraw/zinc/39/73/26/539397326.db2.gz	MIMDZVLJYRSZNT-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
Cc1ccccc1Cn1cnc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC000006373285	539427572	/nfs/dbraw/zinc/42/75/72/539427572.db2.gz	BBCVPNZTWJKOOU-UHFFFAOYSA-N	-1	0	373.394	2.344	50	5		FEBARM
O=C([O-])CCc1nc2cc(F)ccc2c2nc(=O)c(-c3ccccc3)nn12	ZINC000071924136	541775805	/nfs/dbraw/zinc/77/58/05/541775805.db2.gz	BGQNPCPLZKWMCX-UHFFFAOYSA-N	-1	0	364.336	2.461	50	5		FEBARM
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1cnc(Br)cn1	ZINC000078876701	208203381	/nfs/dbraw/zinc/20/33/81/208203381.db2.gz	SZMXBYBBEYFVSE-UHFFFAOYSA-N	-1	0	373.188	2.257	50	5		FEBARM
COc1ccccc1C(=O)[N-]C(=O)COC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000003513158	539368405	/nfs/dbraw/zinc/36/84/05/539368405.db2.gz	IQEAWKXZDPSFLP-UHFFFAOYSA-N	-1	0	372.333	2.025	50	5		FEBARM
O=C([O-])c1cccnc1S[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000019880987	539670470	/nfs/dbraw/zinc/67/04/70/539670470.db2.gz	SXGGDPZDAAMFHW-LBPRGKRZSA-N	-1	0	373.346	2.112	50	5		FEBARM
CC1=Nc2ncnn2[C@H](c2ccc([O-])c([N+](=O)[O-])c2)C1C(=O)OC(C)C	ZINC000004199646	207007481	/nfs/dbraw/zinc/00/74/81/207007481.db2.gz	ZCSWOIWKERHAAO-CQSZACIVSA-N	-1	0	359.342	2.132	50	5		FEBARM
O=C([O-])C[C@@H](NS(=O)(=O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000004601062	207032059	/nfs/dbraw/zinc/03/20/59/207032059.db2.gz	VLQJDYZLSCDHME-OAHLLOKOSA-N	-1	0	364.379	2.230	50	5		FEBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(OCc3ccccn3)cc2)[nH]1	ZINC000009273861	207263982	/nfs/dbraw/zinc/26/39/82/207263982.db2.gz	GHAZFWIPPJPLRF-RMKNXTFCSA-N	-1	0	366.333	2.116	50	5		FEBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2nnc(C(F)(F)F)s2)cc1	ZINC000002813536	539354992	/nfs/dbraw/zinc/35/49/92/539354992.db2.gz	WOINHOPRXCUJBU-UHFFFAOYSA-N	-1	0	354.291	2.266	50	5		FEBARM
CS(=O)(=O)[N-]c1ccccc1C(=O)OCc1cccc([N+](=O)[O-])c1	ZINC000018263306	539648823	/nfs/dbraw/zinc/64/88/23/539648823.db2.gz	NUMKPHAEHWNMMS-UHFFFAOYSA-N	-1	0	350.352	2.323	50	5		FEBARM
COc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1NC(C)=O	ZINC000024437084	539731159	/nfs/dbraw/zinc/73/11/59/539731159.db2.gz	MWUUTSMASAWORL-UHFFFAOYSA-N	-1	0	365.367	2.363	50	5		FEBARM
O=C([O-])CSc1nc(N2CCOCC2)cc(C(F)(F)F)c1[N+](=O)[O-]	ZINC000044154554	540119240	/nfs/dbraw/zinc/11/92/40/540119240.db2.gz	GZJYXUKLGHJLJK-UHFFFAOYSA-N	-1	0	367.305	2.022	50	5		FEBARM
O=[N+]([O-])c1cc(Cl)cnc1NCCN1c2ccccc2[N-]S1(=O)=O	ZINC000170601932	546163893	/nfs/dbraw/zinc/16/38/93/546163893.db2.gz	IQHFVKYLJLDSFQ-UHFFFAOYSA-N	-1	0	369.790	2.232	50	5		FEBARM
COC(=O)c1ccccc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000021631688	539685865	/nfs/dbraw/zinc/68/58/65/539685865.db2.gz	UTKPASVIOHKGJT-UHFFFAOYSA-N	-1	0	366.351	2.191	50	5		FEBARM
COc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)c(OC)c1	ZINC000055558166	540658501	/nfs/dbraw/zinc/65/85/01/540658501.db2.gz	CRYDRGSFOUUFIN-UHFFFAOYSA-N	-1	0	368.367	2.421	50	5		FEBARM
COC(=O)c1cccc([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)c1	ZINC000009338451	209513686	/nfs/dbraw/zinc/51/36/86/209513686.db2.gz	BFRHVOHVPMXNBK-UHFFFAOYSA-N	-1	0	366.351	2.191	50	5		FEBARM
Cc1ccc(Cn2cnc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	ZINC000002781037	539352941	/nfs/dbraw/zinc/35/29/41/539352941.db2.gz	FVIXQTVMKVSEGI-UHFFFAOYSA-N	-1	0	373.394	2.344	50	5		FEBARM
O=C(NCc1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000009887431	207289423	/nfs/dbraw/zinc/28/94/23/207289423.db2.gz	SIEDFQUAEOTMTQ-UHFFFAOYSA-N	-1	0	371.393	2.063	50	5		FEBARM
CN(C(=O)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1)c1ccccc1	ZINC000225490212	548737001	/nfs/dbraw/zinc/73/70/01/548737001.db2.gz	DVYAGBXZXVTNPU-CQSZACIVSA-N	-1	0	369.377	2.426	50	5		FEBARM
Cc1cccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)n1	ZINC000095397960	571133446	/nfs/dbraw/zinc/13/34/46/571133446.db2.gz	XZSUJCIMYZOQNC-UHFFFAOYSA-N	-1	0	372.200	2.862	50	5		FEBARM
COc1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)cc1[N+](=O)[O-]	ZINC000004980371	539398751	/nfs/dbraw/zinc/39/87/51/539398751.db2.gz	BMNUNVGLLCJZAW-UHFFFAOYSA-N	-1	0	352.324	2.102	50	5		FEBARM
Cc1nc(N2CCOCC2)nc([N-]c2ccc([N+](=O)[O-])cc2)c1[N+](=O)[O-]	ZINC000008836099	539492886	/nfs/dbraw/zinc/49/28/86/539492886.db2.gz	WSDNPEXWRZMBLX-UHFFFAOYSA-N	-1	0	360.330	2.182	50	5		FEBARM
COc1ccc(/C=C(/NC(=O)c2cccc([N+](=O)[O-])c2)C(=O)[O-])cc1OC	ZINC000013520904	539588008	/nfs/dbraw/zinc/58/80/08/539588008.db2.gz	WEYUGPVUZZLZDM-RIYZIHGNSA-N	-1	0	372.333	2.468	50	5		FEBARM
COc1cc(/C=C2/NC(=O)[N-]C2=O)c([N+](=O)[O-])cc1OCc1ccccc1	ZINC000001149065	219381698	/nfs/dbraw/zinc/38/16/98/219381698.db2.gz	LQZPPPRLAIMBKS-NTUHNPAUSA-N	-1	0	369.333	2.363	50	5		FEBARM
CC(C)(C)OC(=O)CC[C@H](NSc1ncccc1[N+](=O)[O-])C(=O)[O-]	ZINC000028631517	539834653	/nfs/dbraw/zinc/83/46/53/539834653.db2.gz	DZZKYCRBJSJURE-VIFPVBQESA-N	-1	0	357.388	2.162	50	5		FEBARM
Cc1cc(Br)cc(C=Cc2[nH]c(=O)[n-]c(=O)c2[N+](=O)[O-])c1O	ZINC000004173476	207004316	/nfs/dbraw/zinc/00/43/16/207004316.db2.gz	OJONMIMHCSATCE-NSCUHMNNSA-N	-1	0	368.143	2.331	50	5		FEBARM
O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCC(C(=O)N2CCCCC2)CC1	ZINC000095428352	209049174	/nfs/dbraw/zinc/04/91/74/209049174.db2.gz	VQXXQWYEFIYSKP-UHFFFAOYSA-N	-1	0	361.398	2.165	50	5		FEBARM
Cc1cnc([N+](=O)[O-])n1CCOC([O-])=NC(=O)c1ccccc1Cl	ZINC000001422368	539341746	/nfs/dbraw/zinc/34/17/46/539341746.db2.gz	ZRALNMUCRJEPKG-UHFFFAOYSA-N	-1	0	352.734	2.320	50	5		FEBARM
CCOc1cc([N+](=O)[O-])cc(/C=C2/C(=O)N(CC)C(=S)N2C)c1[O-]	ZINC000015011140	539608954	/nfs/dbraw/zinc/60/89/54/539608954.db2.gz	LPKVZSBGEPRGIH-XFFZJAGNSA-N	-1	0	351.384	2.119	50	5		FEBARM
O=C([O-])CCCN1C(=O)c2cc([N+](=O)[O-])cc3cc([N+](=O)[O-])cc(c32)C1=O	ZINC000035297418	208121887	/nfs/dbraw/zinc/12/18/87/208121887.db2.gz	AADPBQDVYKCPAK-UHFFFAOYSA-N	-1	0	373.277	2.117	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000006088767	539421607	/nfs/dbraw/zinc/42/16/07/539421607.db2.gz	RWGQWCJYMQVYDD-UHFFFAOYSA-N	-1	0	353.312	2.312	50	5		FEBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(F)c(Br)c2)[nH]1	ZINC000030840506	539892004	/nfs/dbraw/zinc/89/20/04/539892004.db2.gz	CCAODUBCHJOUIE-RQOWECAXSA-N	-1	0	356.107	2.043	50	5		FEBARM
O=C([O-])C12C[C@H]3C[C@@H](C1)CC(n1nc([N+](=O)[O-])nc1Br)(C3)C2	ZINC000002755793	210420148	/nfs/dbraw/zinc/42/01/48/210420148.db2.gz	DIYLKADNFMGZCX-WTDALBQZSA-N	-1	0	371.191	2.329	50	5		FEBARM
O=C([O-])CCN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000007716271	539465084	/nfs/dbraw/zinc/46/50/84/539465084.db2.gz	FVDCCUUIPSMZJR-UHFFFAOYSA-N	-1	0	364.379	2.260	50	5		FEBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(O)c(Br)c2)[nH]1	ZINC000015009209	211113223	/nfs/dbraw/zinc/11/32/23/211113223.db2.gz	UCKWOQZFDRKOMP-HNQUOIGGSA-N	-1	0	354.116	2.022	50	5		FEBARM
O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C(=O)N1c1ccccc1F	ZINC000103590463	222339643	/nfs/dbraw/zinc/33/96/43/222339643.db2.gz	QPXJOTPVIWTCBX-DZGCQCFKSA-N	-1	0	355.281	2.026	50	5		FEBARM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2ncn(Cc3ccc(C)cc3)n2)n1	ZINC000002785169	539352901	/nfs/dbraw/zinc/35/29/01/539352901.db2.gz	YBGNOICPGGXQSK-UHFFFAOYSA-N	-1	0	355.358	2.012	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1cccc(C(C)=O)c1O	ZINC000328596130	210110990	/nfs/dbraw/zinc/11/09/90/210110990.db2.gz	UDIKVWLKDHESLJ-UHFFFAOYSA-N	-1	0	366.351	2.312	50	5		FEBARM
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)c([N+](=O)[O-])c1	ZINC000028195841	539827705	/nfs/dbraw/zinc/82/77/05/539827705.db2.gz	GLRAFSQCPKLUDX-UHFFFAOYSA-N	-1	0	354.315	2.321	50	5		FEBARM
Cc1ccc(N2C(=O)[C@H]3ON=C(c4ccc(F)cc4)[C@@H]3C2=O)cc1[N+](=O)[O-]	ZINC000103555631	222338977	/nfs/dbraw/zinc/33/89/77/222338977.db2.gz	BKCHBGKVJZTYME-HOCLYGCPSA-N	-1	0	369.308	2.335	50	5		FEBARM
COC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1C	ZINC000001129241	210320977	/nfs/dbraw/zinc/32/09/77/210320977.db2.gz	QAIDTXYNZNTUQB-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
Cc1ccc([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2Br)nc1	ZINC000084191678	571078916	/nfs/dbraw/zinc/07/89/16/571078916.db2.gz	YHBCIGZQCVCZES-UHFFFAOYSA-N	-1	0	372.200	2.283	50	5		FEBARM
O=C1Cc2cc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc3c2N1CCC3	ZINC000004270420	539380522	/nfs/dbraw/zinc/38/05/22/539380522.db2.gz	VQVZIFSZKHZUES-UHFFFAOYSA-N	-1	0	373.390	2.231	50	5		FEBARM
COC(=O)c1cccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000005027834	539400560	/nfs/dbraw/zinc/40/05/60/539400560.db2.gz	QOPPGAMPUCZUJW-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
O=C(NCc1ccc(Cn2cccn2)cc1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000012626700	539568852	/nfs/dbraw/zinc/56/88/52/539568852.db2.gz	OLHZTYLYPNNKII-UHFFFAOYSA-N	-1	0	352.350	2.475	50	5		FEBARM
COC(=O)c1cn([N-]C(=O)c2ccccc2[N+](=O)[O-])c(=O)c2ccccc12	ZINC000003630731	539372250	/nfs/dbraw/zinc/37/22/50/539372250.db2.gz	BGARWEUGILHBAU-UHFFFAOYSA-N	-1	0	367.317	2.080	50	5		FEBARM
CNc1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)cc1[N+](=O)[O-]	ZINC000009319648	539500362	/nfs/dbraw/zinc/50/03/62/539500362.db2.gz	UGZBAEVQLPDOAD-UHFFFAOYSA-N	-1	0	351.340	2.136	50	5		FEBARM
O=C([O-])c1cc(S(=O)(=O)Nc2ccc(F)c([N+](=O)[O-])c2)ccc1F	ZINC000012983680	220048676	/nfs/dbraw/zinc/04/86/76/220048676.db2.gz	CETSEWIROVXQEK-UHFFFAOYSA-N	-1	0	358.278	2.372	50	5		FEBARM
Cc1ccc(S(=O)(=O)[N-]c2nc(C(F)(F)F)c[nH]2)cc1[N+](=O)[O-]	ZINC000225396831	548732982	/nfs/dbraw/zinc/73/29/82/548732982.db2.gz	GALVCGOWJCNSQS-UHFFFAOYSA-N	-1	0	350.278	2.446	50	5		FEBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ncn(Cc3ccccc3)n2)cc1	ZINC000002803941	539353778	/nfs/dbraw/zinc/35/37/78/539353778.db2.gz	ZNBIGCLIAXOICS-UHFFFAOYSA-N	-1	0	359.367	2.035	50	5		FEBARM
COC(=O)Cc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000024973650	539745198	/nfs/dbraw/zinc/74/51/98/539745198.db2.gz	NDEKVNQGNYJTMR-UHFFFAOYSA-N	-1	0	350.352	2.111	50	5		FEBARM
Cc1cc(C(=O)[N-]N2C(=O)NC3(CCC(C)CC3)C2=O)ccc1[N+](=O)[O-]	ZINC000016000018	220174373	/nfs/dbraw/zinc/17/43/73/220174373.db2.gz	RRQXTQVCNSWDSI-UHFFFAOYSA-N	-1	0	360.370	2.049	50	5		FEBARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2O)cc1	ZINC000080341331	542584402	/nfs/dbraw/zinc/58/44/02/542584402.db2.gz	KZQBDXAFLPSRJM-UHFFFAOYSA-N	-1	0	351.340	2.060	50	5		FEBARM
Cc1ccc(C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1[N+](=O)[O-]	ZINC000012751830	539571910	/nfs/dbraw/zinc/57/19/10/539571910.db2.gz	DGTGWXZBNDXESB-UHFFFAOYSA-N	-1	0	358.379	2.473	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)C=C([O-])c1ccccc1OC	ZINC000101354829	222271865	/nfs/dbraw/zinc/27/18/65/222271865.db2.gz	FYOBGPVUFLBVRV-UHFFFAOYSA-N	-1	0	372.333	2.393	50	5		FEBARM
O=[N+]([O-])c1ccc(Nc2ccc(O)c(S(=O)(=O)[O-])c2)c([N+](=O)[O-])c1	ZINC000004822094	539392829	/nfs/dbraw/zinc/39/28/29/539392829.db2.gz	CQTYKXPSTQLSOZ-UHFFFAOYSA-N	-1	0	355.284	2.199	50	5		FEBARM
O=C([O-])CCc1nc2ccccc2c2nc(=O)c(-c3cccs3)nn12	ZINC000012878013	539577566	/nfs/dbraw/zinc/57/75/66/539577566.db2.gz	NURNBIXPTFZONQ-UHFFFAOYSA-N	-1	0	352.375	2.383	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000000673714	219312043	/nfs/dbraw/zinc/31/20/43/219312043.db2.gz	TZSWKFDILSRYEF-UHFFFAOYSA-N	-1	0	365.367	2.363	50	5		FEBARM
NC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000006316407	219724404	/nfs/dbraw/zinc/72/44/04/219724404.db2.gz	QBVTUGOQBAFMLH-UHFFFAOYSA-N	-1	0	355.759	2.148	50	5		FEBARM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(S(C)(=O)=O)cc1	ZINC000012557051	220007400	/nfs/dbraw/zinc/00/74/00/220007400.db2.gz	LFHYOISDVZQUNF-UHFFFAOYSA-N	-1	0	370.408	2.108	50	5		FEBARM
CCOC(=O)c1cnn2c1[N-]N=C([N+](=O)[O-])[C@H]2c1c[nH]c2ccccc21	ZINC000075286968	542166235	/nfs/dbraw/zinc/16/62/35/542166235.db2.gz	GSWHZYFAYYHMFP-CYBMUJFWSA-N	-1	0	354.326	2.146	50	5		FEBARM
Cn1c(=O)c2ccc(C(=O)Nc3cccc([N+](=O)[O-])c3)cc2[n-]c1=S	ZINC000102759389	222307774	/nfs/dbraw/zinc/30/77/74/222307774.db2.gz	JMMGULVIWGBYQK-UHFFFAOYSA-N	-1	0	356.363	2.383	50	5		FEBARM
COc1cc([N-]c2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])cc(OC)c1	ZINC000004758847	539392430	/nfs/dbraw/zinc/39/24/30/539392430.db2.gz	VALYAUXXMQOVDK-UHFFFAOYSA-N	-1	0	357.326	2.175	50	5		FEBARM
COc1ccc(Br)cc1C=Cc1[nH]c(=O)[n-]c(=O)c1[N+](=O)[O-]	ZINC000005093952	539402496	/nfs/dbraw/zinc/40/24/96/539402496.db2.gz	PYWBDADWHHJHAT-DUXPYHPUSA-N	-1	0	368.143	2.325	50	5		FEBARM
O=C([O-])C1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1	ZINC000009060932	539497423	/nfs/dbraw/zinc/49/74/23/539497423.db2.gz	VXGRKJQDCXLXQA-UHFFFAOYSA-N	-1	0	364.401	2.478	50	5		FEBARM
COc1cccc(C([O-])=CC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000101354960	222271795	/nfs/dbraw/zinc/27/17/95/222271795.db2.gz	VCLXRUKSAMKPND-UHFFFAOYSA-N	-1	0	372.333	2.393	50	5		FEBARM
O=C(NC(=S)Nc1cc([N+](=O)[O-])cc(Cl)c1[O-])c1cccnc1	ZINC000004409558	539384376	/nfs/dbraw/zinc/38/43/76/539384376.db2.gz	BTQYPSNWPIQTIJ-UHFFFAOYSA-N	-1	0	352.759	2.476	50	5		FEBARM
O=C([O-])C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000005020942	539400139	/nfs/dbraw/zinc/40/01/39/539400139.db2.gz	NDBROMODXPTBHM-CQSZACIVSA-N	-1	0	350.352	2.089	50	5		FEBARM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1ccccc1N1CCOCC1	ZINC000007055364	539446354	/nfs/dbraw/zinc/44/63/54/539446354.db2.gz	VRWGUCDNUGRBTA-UHFFFAOYSA-N	-1	0	363.395	2.232	50	5		FEBARM
CNC(=O)c1cccc([N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c1	ZINC000009154018	539498450	/nfs/dbraw/zinc/49/84/50/539498450.db2.gz	DQKPCRHHJQJOAN-UHFFFAOYSA-N	-1	0	363.395	2.372	50	5		FEBARM
COC(=O)C[C@@H](c1cccc([N+](=O)[O-])c1)c1c([O-])nc2ccccn2c1=O	ZINC000096118235	222032098	/nfs/dbraw/zinc/03/20/98/222032098.db2.gz	PQXRLWVUNNXICR-ZDUSSCGKSA-N	-1	0	369.333	2.003	50	5		FEBARM
Cc1ccc(C)c(-n2c(=O)c3ccc4c(=O)[nH]c(=O)c5ccc(c2=O)c3c45)c1	ZINC000227116791	548750745	/nfs/dbraw/zinc/75/07/45/548750745.db2.gz	JGEOQFSIZRQOLK-UHFFFAOYSA-N	-1	0	370.364	2.198	50	5		FEBARM
COc1ccc(CC(=O)N[C@@H](CC(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1	ZINC000004580685	539388533	/nfs/dbraw/zinc/38/85/33/539388533.db2.gz	FQYIHORYBQJLKG-INIZCTEOSA-N	-1	0	358.350	2.478	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000004833442	539392843	/nfs/dbraw/zinc/39/28/43/539392843.db2.gz	ZQBYWQHWWQOLSQ-UHFFFAOYSA-N	-1	0	365.367	2.363	50	5		FEBARM
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(O)c2)cc1[N+](=O)[O-]	ZINC000005028163	539400314	/nfs/dbraw/zinc/40/03/14/539400314.db2.gz	HIGMSZJQYZYLSP-UHFFFAOYSA-N	-1	0	352.324	2.108	50	5		FEBARM
COC(=O)c1ccc([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1	ZINC000004980348	539397779	/nfs/dbraw/zinc/39/77/79/539397779.db2.gz	UCXRSZUIJICMEW-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
COC(=O)c1sccc1[N-]S(=O)(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000009319767	539500497	/nfs/dbraw/zinc/50/04/97/539500497.db2.gz	JUCXOSWVHWLBBA-UHFFFAOYSA-N	-1	0	360.344	2.383	50	5		FEBARM
Cc1cc(C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)ccc1[N+](=O)[O-]	ZINC000010720936	539520191	/nfs/dbraw/zinc/52/01/91/539520191.db2.gz	PSLVHNXXVMDRQQ-UHFFFAOYSA-N	-1	0	358.379	2.473	50	5		FEBARM
COC(=O)[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C)c1ccccc1	ZINC000058265526	221111511	/nfs/dbraw/zinc/11/15/11/221111511.db2.gz	HZFFWALZZPTADK-HNNXBMFYSA-N	-1	0	364.379	2.096	50	5		FEBARM
O=C([O-])CCCN1C(=O)c2ccc([N+](=O)[O-])c3c([N+](=O)[O-])ccc(c23)C1=O	ZINC000035297624	539979995	/nfs/dbraw/zinc/97/99/95/539979995.db2.gz	WLYZEWWLRWSMGI-UHFFFAOYSA-N	-1	0	373.277	2.117	50	5		FEBARM
COc1cccc(N2CCN(C(=O)c3ccc([O-])c([N+](=O)[O-])c3)CC2)c1	ZINC000164000029	132261058	/nfs/dbraw/zinc/26/10/58/132261058.db2.gz	YRDXNPRPXXRYQS-UHFFFAOYSA-N	-1	0	357.366	2.271	50	5		FEBARM
Nc1c2cc(C(=O)[O-])c(=O)[nH]c2sc1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004789476	539393358	/nfs/dbraw/zinc/39/33/58/539393358.db2.gz	SNPTZLQRNMBBOF-UHFFFAOYSA-N	-1	0	374.334	2.031	50	5		FEBARM
COc1ccc(C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1[N+](=O)[O-]	ZINC000010720956	539520018	/nfs/dbraw/zinc/52/00/18/539520018.db2.gz	PJHIXEUOHRSAPJ-UHFFFAOYSA-N	-1	0	374.378	2.174	50	5		FEBARM
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1O	ZINC000020255000	220320670	/nfs/dbraw/zinc/32/06/70/220320670.db2.gz	KGTOUPDTFMIEHG-UHFFFAOYSA-N	-1	0	372.742	2.453	50	5		FEBARM
COc1cc(C=Cc2[nH]c(=O)[n-]c(=O)c2[N+](=O)[O-])ccc1OC(F)F	ZINC000004503614	539386158	/nfs/dbraw/zinc/38/61/58/539386158.db2.gz	YGPHUDAUJMWLOL-DUXPYHPUSA-N	-1	0	355.253	2.164	50	5		FEBARM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccccc1C(=O)[O-]	ZINC000005234970	539406589	/nfs/dbraw/zinc/40/65/89/539406589.db2.gz	VNZATHQWFMJJOW-UHFFFAOYSA-N	-1	0	350.352	2.427	50	5		FEBARM
Cn1cnnc1-c1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000032596089	539944098	/nfs/dbraw/zinc/94/40/98/539944098.db2.gz	KTKUWSGZDUZURG-UHFFFAOYSA-N	-1	0	359.367	2.191	50	5		FEBARM
COc1ccccc1OCC(=O)N[C@@H](CC(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000003623483	219523020	/nfs/dbraw/zinc/52/30/20/219523020.db2.gz	XXENMXLQLIPUSB-AWEZNQCLSA-N	-1	0	374.349	2.314	50	5		FEBARM
CC(C)(C)OC(=O)N[C@H]1CCN(c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000067172712	221248375	/nfs/dbraw/zinc/24/83/75/221248375.db2.gz	AAWNISLIDKPMRM-NSHDSACASA-N	-1	0	351.359	2.396	50	5		FEBARM
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1noc(-c2ccoc2)n1	ZINC000096004203	542987614	/nfs/dbraw/zinc/98/76/14/542987614.db2.gz	VHMAKZABOGKIAP-UHFFFAOYSA-N	-1	0	350.312	2.347	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)CCC[C@@H](C)C(=O)[O-]	ZINC000097002766	222148990	/nfs/dbraw/zinc/14/89/90/222148990.db2.gz	ACLJAOCVNHZPPD-GHMZBOCLSA-N	-1	0	374.415	2.161	50	5		FEBARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)Cc2ccccc2[N+](=O)[O-])c1	ZINC000024153151	539726560	/nfs/dbraw/zinc/72/65/60/539726560.db2.gz	LEBLUZFEQMWSKC-UHFFFAOYSA-N	-1	0	364.379	2.275	50	5		FEBARM
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(OC)c2)c([N+](=O)[O-])c1	ZINC000028195772	539827441	/nfs/dbraw/zinc/82/74/41/539827441.db2.gz	XJZRQZBNUNRTED-UHFFFAOYSA-N	-1	0	366.351	2.191	50	5		FEBARM
COc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1	ZINC000035310606	539979441	/nfs/dbraw/zinc/97/94/41/539979441.db2.gz	SFSOGXJWIZNEQL-UHFFFAOYSA-N	-1	0	357.366	2.271	50	5		FEBARM
O=C(NCc1ccccc1Cn1cccn1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000036447626	539990434	/nfs/dbraw/zinc/99/04/34/539990434.db2.gz	VDWVJIYOFHSJFX-UHFFFAOYSA-N	-1	0	352.350	2.475	50	5		FEBARM
CC(C)(C)OC(=O)CC[C@@H](NSc1ncccc1[N+](=O)[O-])C(=O)[O-]	ZINC000028631514	539834392	/nfs/dbraw/zinc/83/43/92/539834392.db2.gz	DZZKYCRBJSJURE-SECBINFHSA-N	-1	0	357.388	2.162	50	5		FEBARM
O=C([O-])c1cccnc1S[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000004806551	204163941	/nfs/dbraw/zinc/16/39/41/204163941.db2.gz	SXGGDPZDAAMFHW-GFCCVEGCSA-N	-1	0	373.346	2.112	50	5		FEBARM
Cc1cccc(Cn2cnc([N-]S(=O)(=O)c3cccc([N+](=O)[O-])c3)n2)c1	ZINC000006373281	206242505	/nfs/dbraw/zinc/24/25/05/206242505.db2.gz	RUHSMOPIRSKOLX-UHFFFAOYSA-N	-1	0	373.394	2.344	50	5		FEBARM
COc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)[O-])cc2)cc1[N+](=O)[O-]	ZINC000097141275	206543369	/nfs/dbraw/zinc/54/33/69/206543369.db2.gz	CLEQEJYVLGWJMC-UHFFFAOYSA-N	-1	0	366.351	2.127	50	5		FEBARM
O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCC(c2nnc3ccccn32)CC1	ZINC000095427648	542969951	/nfs/dbraw/zinc/96/99/51/542969951.db2.gz	RAMWDKGUZOQPHH-UHFFFAOYSA-N	-1	0	367.365	2.363	50	5		FEBARM
Cc1cc(S(=O)(=O)N2[C@@H](C(=O)[O-])CCC2(C)C)cc([N+](=O)[O-])c1C	ZINC000240333256	548884063	/nfs/dbraw/zinc/88/40/63/548884063.db2.gz	FCMJQFFAMDFWMO-GFCCVEGCSA-N	-1	0	356.400	2.228	50	5		FEBARM
Cc1ccccc1Cn1cnc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000017076417	204649895	/nfs/dbraw/zinc/64/98/95/204649895.db2.gz	LXTYLSZHVNMZEO-UHFFFAOYSA-N	-1	0	373.394	2.344	50	5		FEBARM
CC1=C(C(=O)OC2CCCC2)[C@@H](c2ccc([O-])c([N+](=O)[O-])c2)NC(=O)N1	ZINC000036144758	205006703	/nfs/dbraw/zinc/00/67/03/205006703.db2.gz	CKAWYPVHDYMUOJ-OAHLLOKOSA-N	-1	0	361.354	2.414	50	5		FEBARM
CC(C)(C)OC(=O)N[C@@H]1CCN(c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000067172711	205367756	/nfs/dbraw/zinc/36/77/56/205367756.db2.gz	AAWNISLIDKPMRM-LLVKDONJSA-N	-1	0	351.359	2.396	50	5		FEBARM
COC(=O)c1sccc1[N-]S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000009882126	206248722	/nfs/dbraw/zinc/24/87/22/206248722.db2.gz	JHTAAZFULRNWNR-UHFFFAOYSA-N	-1	0	372.380	2.252	50	5		FEBARM
C[C@@H]1CN(C(=O)C(C)(C)C)C[C@@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000293630536	552842108	/nfs/dbraw/zinc/84/21/08/552842108.db2.gz	GMBNOLFWVPJWBL-VXGBXAGGSA-N	-1	0	363.414	2.408	50	5		FEBARM
Cc1ccc(S(=O)(=O)N(CC(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1	ZINC000007602789	539462012	/nfs/dbraw/zinc/46/20/12/539462012.db2.gz	OIKCVEHFZIFXGJ-UHFFFAOYSA-N	-1	0	350.352	2.183	50	5		FEBARM
CC(=O)N/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000001138553	203986723	/nfs/dbraw/zinc/98/67/23/203986723.db2.gz	QUBMIOIRDKZMAE-MHWRWJLKSA-N	-1	0	369.333	2.409	50	5		FEBARM
CCOCc1nnc([N-]C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])s1	ZINC000002846727	204061833	/nfs/dbraw/zinc/06/18/33/204061833.db2.gz	MDBIKXOWYYWEEX-UHFFFAOYSA-N	-1	0	368.371	2.252	50	5		FEBARM
O=C([O-])C[C@@H](NC(=O)c1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1	ZINC000004601996	204150086	/nfs/dbraw/zinc/15/00/86/204150086.db2.gz	MUDWFGLRMCBQNN-CYBMUJFWSA-N	-1	0	358.306	2.269	50	5		FEBARM
CCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c1	ZINC000042004896	205093302	/nfs/dbraw/zinc/09/33/02/205093302.db2.gz	LRMKKIYZPLDFLC-UHFFFAOYSA-N	-1	0	363.395	2.454	50	5		FEBARM
COc1ccc(C(=O)NC(=O)COC(=O)c2cccc([N+](=O)[O-])c2C)cc1	ZINC000007738104	204305667	/nfs/dbraw/zinc/30/56/67/204305667.db2.gz	OTGDWAIPIJRXCQ-UHFFFAOYSA-N	-1	0	372.333	2.025	50	5		FEBARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000003879445	132385792	/nfs/dbraw/zinc/38/57/92/132385792.db2.gz	VFYGCPDPBGSRJC-CVEARBPZSA-N	-1	0	361.398	2.134	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1-n1c2ccccc2cc2c(=O)[n-]c(=O)nc1-2	ZINC000096562582	542999282	/nfs/dbraw/zinc/99/92/82/542999282.db2.gz	VXKKYACBPVVWKH-UHFFFAOYSA-N	-1	0	364.317	2.096	50	5		FEBARM
COc1ccc(C([O-])=CC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	ZINC000100927915	543026430	/nfs/dbraw/zinc/02/64/30/543026430.db2.gz	ZJZCDACAWDVYAW-UHFFFAOYSA-N	-1	0	372.333	2.393	50	5		FEBARM
O=C([O-])c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c([N+](=O)[O-])c1	ZINC000005158516	539403844	/nfs/dbraw/zinc/40/38/44/539403844.db2.gz	GYTRQBRJMMJEBF-YPMHNXCESA-N	-1	0	355.350	2.078	50	5		FEBARM
CC(C)(C)OC(=O)N1C[C@@H](Oc2ccccc2[N+](=O)[O-])C[C@H]1C(=O)[O-]	ZINC000042783188	205098299	/nfs/dbraw/zinc/09/82/99/205098299.db2.gz	AQKMUZXZAQMDPI-JQWIXIFHSA-N	-1	0	352.343	2.436	50	5		FEBARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000003879447	132385907	/nfs/dbraw/zinc/38/59/07/132385907.db2.gz	VFYGCPDPBGSRJC-HZPDHXFCSA-N	-1	0	361.398	2.134	50	5		FEBARM
CCOc1cc([N+](=O)[O-])cc(/C=C2\C(=O)N(CC)C(=S)N2C)c1[O-]	ZINC000033306891	539973682	/nfs/dbraw/zinc/97/36/82/539973682.db2.gz	LPKVZSBGEPRGIH-YRNVUSSQSA-N	-1	0	351.384	2.119	50	5		FEBARM
O=C([O-])C[C@H](NS(=O)(=O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000004601059	204150516	/nfs/dbraw/zinc/15/05/16/204150516.db2.gz	VLQJDYZLSCDHME-HNNXBMFYSA-N	-1	0	364.379	2.230	50	5		FEBARM
O=C(NC(=S)Nc1cc([N+](=O)[O-])ccc1[O-])c1ccc2c(c1)OCO2	ZINC000035999923	205000341	/nfs/dbraw/zinc/00/03/41/205000341.db2.gz	QDCMPSRGIPSCBQ-UHFFFAOYSA-N	-1	0	361.335	2.156	50	5		FEBARM
CC(C)(C)OC(=O)N1CCN(c2ccc(F)cc2[N+](=O)[O-])C[C@H]1C(=O)[O-]	ZINC000169725305	534839249	/nfs/dbraw/zinc/83/92/49/534839249.db2.gz	IXIYSAJIPHUATO-ZDUSSCGKSA-N	-1	0	369.349	2.244	50	5		FEBARM
CC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2[O-])cc1	ZINC000003110409	204078324	/nfs/dbraw/zinc/07/83/24/204078324.db2.gz	RJMCJCJHWIYMLQ-UHFFFAOYSA-N	-1	0	360.282	2.419	50	5		FEBARM
CCn1cc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])cc(Cl)c2[O-])cn1	ZINC000002776418	204055853	/nfs/dbraw/zinc/05/58/53/204055853.db2.gz	JFAQMNLMFKFARQ-UHFFFAOYSA-N	-1	0	369.790	2.297	50	5		FEBARM
O=C([O-])c1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000004007360	132386120	/nfs/dbraw/zinc/38/61/20/132386120.db2.gz	XSDWMLFXVSWOAH-UHFFFAOYSA-N	-1	0	355.350	2.255	50	5		FEBARM
O=C(CCn1cnc2ccccc2c1=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000089866523	542772263	/nfs/dbraw/zinc/77/22/63/542772263.db2.gz	KSFVHZSBBAALNJ-UHFFFAOYSA-N	-1	0	354.322	2.039	50	5		FEBARM
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1c[nH]nc1-c1ccccn1	ZINC000095427315	542969045	/nfs/dbraw/zinc/96/90/45/542969045.db2.gz	MHEFFHVQLWGGLL-UHFFFAOYSA-N	-1	0	359.367	2.489	50	5		FEBARM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(-n2cccn2)nc1	ZINC000026539595	539789118	/nfs/dbraw/zinc/78/91/18/539789118.db2.gz	HMMOCTGRPIGYSK-UHFFFAOYSA-N	-1	0	359.367	2.285	50	5		FEBARM
O=C1OCCN1c1cccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000031720136	539917260	/nfs/dbraw/zinc/91/72/60/539917260.db2.gz	AOOCBEWMDKSWTF-UHFFFAOYSA-N	-1	0	363.351	2.352	50	5		FEBARM
CC(=O)N(C)Cc1ccccc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000032096313	539929257	/nfs/dbraw/zinc/92/92/57/539929257.db2.gz	SXNQBDPFXNKXMU-UHFFFAOYSA-N	-1	0	363.395	2.374	50	5		FEBARM
COC(=O)[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C)c1ccccc1	ZINC000058265527	540836746	/nfs/dbraw/zinc/83/67/46/540836746.db2.gz	HZFFWALZZPTADK-OAHLLOKOSA-N	-1	0	364.379	2.096	50	5		FEBARM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2ncn(Cc3cccc(C)c3)n2)n1	ZINC000002786006	204057416	/nfs/dbraw/zinc/05/74/16/204057416.db2.gz	QZDOGRYGVVFHJJ-UHFFFAOYSA-N	-1	0	355.358	2.012	50	5		FEBARM
CC1=Nc2ncnn2[C@@H](c2ccc([O-])c([N+](=O)[O-])c2)C1C(=O)OC(C)C	ZINC000004199649	204127721	/nfs/dbraw/zinc/12/77/21/204127721.db2.gz	ZCSWOIWKERHAAO-AWEZNQCLSA-N	-1	0	359.342	2.132	50	5		FEBARM
Cc1cccc(Cn2cnc([N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])n2)c1	ZINC000006502373	204250329	/nfs/dbraw/zinc/25/03/29/204250329.db2.gz	SUQHRDDZVWVITI-UHFFFAOYSA-N	-1	0	373.394	2.344	50	5		FEBARM
COC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000004980364	206239347	/nfs/dbraw/zinc/23/93/47/206239347.db2.gz	UKCKNLHOLRNLAP-UHFFFAOYSA-N	-1	0	366.351	2.191	50	5		FEBARM
O=C(Nc1cc(=O)nc2[n-]c(C(F)(F)F)nn21)c1cccc([N+](=O)[O-])c1	ZINC000017017142	539638161	/nfs/dbraw/zinc/63/81/61/539638161.db2.gz	IWSVVKLRYDENGN-UHFFFAOYSA-N	-1	0	368.231	2.009	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)OCCO2	ZINC000058246351	540835909	/nfs/dbraw/zinc/83/59/09/540835909.db2.gz	MYPGNOVJCWWERQ-UHFFFAOYSA-N	-1	0	366.351	2.175	50	5		FEBARM
Nc1c([N+](=O)[O-])cc([N+](=O)[O-])c(Nc2cccc(C(=O)[O-])c2)c1[N+](=O)[O-]	ZINC000100569074	209214616	/nfs/dbraw/zinc/21/46/16/209214616.db2.gz	CJCYQOIZCOUHBE-UHFFFAOYSA-N	-1	0	363.242	2.435	50	5		FEBARM
Nc1c([N+](=O)[O-])cc([N+](=O)[O-])c(Nc2ccc(C(=O)[O-])cc2)c1[N+](=O)[O-]	ZINC000100569073	209214683	/nfs/dbraw/zinc/21/46/83/209214683.db2.gz	RSJAVKJOYGIUHT-UHFFFAOYSA-N	-1	0	363.242	2.435	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)CCC[C@H](C)C(=O)[O-]	ZINC000097002767	543002117	/nfs/dbraw/zinc/00/21/17/543002117.db2.gz	ACLJAOCVNHZPPD-QWRGUYRKSA-N	-1	0	374.415	2.161	50	5		FEBARM
O=C([O-])C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2	ZINC000003856194	539373734	/nfs/dbraw/zinc/37/37/34/539373734.db2.gz	PQFSWUOMCYDAPB-AWEZNQCLSA-N	-1	0	372.333	2.198	50	5		FEBARM
CC[C@@H](NC(=O)COc1ccc2c(c1)oc(=O)c1ccccc21)C(=O)[O-]	ZINC000002117590	209393378	/nfs/dbraw/zinc/39/33/78/209393378.db2.gz	GOHKFLNWKRYMFP-OAHLLOKOSA-N	-1	0	355.346	2.304	50	5	biogenic	FEBARM
Cc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2ON=C(c3ccc(F)cc3)[C@H]2C1=O	ZINC000101343106	209224454	/nfs/dbraw/zinc/22/44/54/209224454.db2.gz	DJVBVKDGXSKYIZ-GDBMZVCRSA-N	-1	0	369.308	2.335	50	5		FEBARM
CC(C)C[C@H](CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])CC(=O)[O-]	ZINC000097050539	543003416	/nfs/dbraw/zinc/00/34/16/543003416.db2.gz	RMWBAIBKLCXEJX-JTQLQIEISA-N	-1	0	362.379	2.149	50	5		FEBARM
O=C([O-])c1cccnc1S[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000019774515	220297355	/nfs/dbraw/zinc/29/73/55/220297355.db2.gz	WZBLSPDCFLPTIQ-GFCCVEGCSA-N	-1	0	373.346	2.112	50	5		FEBARM
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1	ZINC000096004366	209095051	/nfs/dbraw/zinc/09/50/51/209095051.db2.gz	PRGVCYVXXHGAEC-UHFFFAOYSA-N	-1	0	364.402	2.003	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1nc(C(F)(F)F)c[nH]1	ZINC000225396932	548733064	/nfs/dbraw/zinc/73/30/64/548733064.db2.gz	UXONXPWHBXYSPZ-UHFFFAOYSA-N	-1	0	366.277	2.146	50	5		FEBARM
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccc3c(c2)OCCCO3)ccc1[O-]	ZINC000012521262	539562414	/nfs/dbraw/zinc/56/24/14/539562414.db2.gz	RPHVKBCKZWSVOK-UHFFFAOYSA-N	-1	0	366.351	2.263	50	5		FEBARM
COc1cc(/C=C2\NC(=O)N(c3ccccc3)C2=O)cc([N+](=O)[O-])c1[O-]	ZINC000013546772	539587689	/nfs/dbraw/zinc/58/76/89/539587689.db2.gz	QGDOZEDFQRCHHS-GHXNOFRVSA-N	-1	0	355.306	2.406	50	5		FEBARM
COc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])c1	ZINC000008660760	207240821	/nfs/dbraw/zinc/24/08/21/207240821.db2.gz	AZGZZSBKMCSHTB-UHFFFAOYSA-N	-1	0	353.312	2.312	50	5		FEBARM
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1	ZINC000004262998	539380327	/nfs/dbraw/zinc/38/03/27/539380327.db2.gz	VOUXVYDAHAYBCT-UHFFFAOYSA-N	-1	0	366.351	2.191	50	5		FEBARM
CCCC1=NC(=S)N[C@@H](c2ccc([O-])c([N+](=O)[O-])c2)C1C(=O)OCC	ZINC000035358008	539981296	/nfs/dbraw/zinc/98/12/96/539981296.db2.gz	PRGJGMGVHORJTL-AWEZNQCLSA-N	-1	0	365.411	2.437	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1	ZINC000042122872	209247425	/nfs/dbraw/zinc/24/74/25/209247425.db2.gz	GWMYMXFLBMUTOP-UHFFFAOYSA-N	-1	0	352.324	2.102	50	5		FEBARM
Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2ON=C(c3ccc(F)cc3)[C@H]2C1=O	ZINC000101343700	209223910	/nfs/dbraw/zinc/22/39/10/209223910.db2.gz	HDHFHLPFEOKSPN-GDBMZVCRSA-N	-1	0	369.308	2.335	50	5		FEBARM
O=C([O-])CCN1C(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2C1=O	ZINC000001201160	206867723	/nfs/dbraw/zinc/86/77/23/206867723.db2.gz	BICJQBMBVLSMSX-UHFFFAOYSA-N	-1	0	356.290	2.458	50	5		FEBARM
Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2[O-])cc1NS(C)(=O)=O	ZINC000095409807	209049382	/nfs/dbraw/zinc/04/93/82/209049382.db2.gz	ANQDKDXXTHEFKH-UHFFFAOYSA-N	-1	0	365.367	2.233	50	5		FEBARM
CC(C)(C)OC(=O)N1CCN(c2cccc(F)c2[N+](=O)[O-])C[C@H]1C(=O)[O-]	ZINC000169725313	534838904	/nfs/dbraw/zinc/83/89/04/534838904.db2.gz	HHHSXGDWRDBZOL-LBPRGKRZSA-N	-1	0	369.349	2.244	50	5		FEBARM
COc1cc(/C=C2\NC(=O)[N-]C2=O)c([N+](=O)[O-])cc1OCc1ccccc1	ZINC000013546527	539587796	/nfs/dbraw/zinc/58/77/96/539587796.db2.gz	LQZPPPRLAIMBKS-QPEQYQDCSA-N	-1	0	369.333	2.363	50	5		FEBARM
CCOC(=O)c1ccc(-n2c3ccccc3cc3c(=O)[n-]c(=O)nc2-3)cc1	ZINC000005053752	207076850	/nfs/dbraw/zinc/07/68/50/207076850.db2.gz	IEGIYGUERGFPCB-UHFFFAOYSA-N	-1	0	361.357	2.356	50	5		FEBARM
O=[N+]([O-])c1cc(F)ccc1S(=O)(=O)[N-]c1ccc2c(c1)OCCO2	ZINC000008778934	207249776	/nfs/dbraw/zinc/24/97/76/207249776.db2.gz	WVQJWFQFGAGAAB-UHFFFAOYSA-N	-1	0	354.315	2.306	50	5		FEBARM
COc1cc(/C=c2\sc3nc4ccccc4n3c2=O)cc([N+](=O)[O-])c1[O-]	ZINC000036476307	208164342	/nfs/dbraw/zinc/16/43/42/208164342.db2.gz	JQNWFLQFHSNEIK-ZSOIEALJSA-N	-1	0	369.358	2.079	50	5		FEBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(F)c(Br)c2)[nH]1	ZINC000015009206	539609525	/nfs/dbraw/zinc/60/95/25/539609525.db2.gz	CCAODUBCHJOUIE-DUXPYHPUSA-N	-1	0	356.107	2.456	50	5		FEBARM
CC[C@H](C(=O)[O-])N1C(=O)c2ccc([N+](=O)[O-])c3c([N+](=O)[O-])ccc(c23)C1=O	ZINC000016610036	539633946	/nfs/dbraw/zinc/63/39/46/539633946.db2.gz	JXUGXLNOJSMPHL-SECBINFHSA-N	-1	0	373.277	2.115	50	5		FEBARM
CN1CCc2c(sc3c2C(=O)N[C@H](c2cc([O-])ccc2[N+](=O)[O-])N3)C1	ZINC000017820215	539643914	/nfs/dbraw/zinc/64/39/14/539643914.db2.gz	RYQQMBMIOLYZOT-AWEZNQCLSA-N	-1	0	360.395	2.204	50	5		FEBARM
COc1ccc(S(=O)(=O)N(C)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-]	ZINC000005027949	209504206	/nfs/dbraw/zinc/50/42/06/209504206.db2.gz	BHQSYJQIICOZLW-UHFFFAOYSA-N	-1	0	366.351	2.127	50	5		FEBARM
CC(C)(C)OC(=O)N[C@@H](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)[O-]	ZINC000008700677	207242123	/nfs/dbraw/zinc/24/21/23/207242123.db2.gz	ANQMEPHYMTWCEW-JTQLQIEISA-N	-1	0	355.303	2.023	50	5		FEBARM
O=C([O-])CCc1nc2ccccc2c2nc(=O)c(Cc3ccccc3)nn12	ZINC000032934908	208059476	/nfs/dbraw/zinc/05/94/76/208059476.db2.gz	RRZGYLKTEQRDCA-UHFFFAOYSA-N	-1	0	360.373	2.246	50	5		FEBARM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)N(C)C)cc1	ZINC000005077896	539401252	/nfs/dbraw/zinc/40/12/52/539401252.db2.gz	OBZIFVIWXQOOIO-UHFFFAOYSA-N	-1	0	363.395	2.406	50	5		FEBARM
Cc1cccc(-c2noc(C[N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])n2)c1	ZINC000006757615	539435758	/nfs/dbraw/zinc/43/57/58/539435758.db2.gz	UAMKJWPWUPKHKB-UHFFFAOYSA-N	-1	0	374.378	2.432	50	5		FEBARM
CCOC(=O)c1sc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)nc1C	ZINC000008816209	518488790	/nfs/dbraw/zinc/48/87/90/518488790.db2.gz	YZZRPTAXQPWSKB-UHFFFAOYSA-N	-1	0	371.396	2.337	50	5		FEBARM
COc1ccccc1OCC(=O)N[C@H](CC(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000003623485	539372178	/nfs/dbraw/zinc/37/21/78/539372178.db2.gz	XXENMXLQLIPUSB-CQSZACIVSA-N	-1	0	374.349	2.314	50	5		FEBARM
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000003876392	539373132	/nfs/dbraw/zinc/37/31/32/539373132.db2.gz	XREHTMWBQXLMJA-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)[O-])cc1[N+](=O)[O-]	ZINC000004980343	539397879	/nfs/dbraw/zinc/39/78/79/539397879.db2.gz	CRRHAELCSMSVEN-UHFFFAOYSA-N	-1	0	352.324	2.102	50	5		FEBARM
O=C(CSc1nnnn1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1[O-]	ZINC000009235078	539499829	/nfs/dbraw/zinc/49/98/29/539499829.db2.gz	YHCHGNUEZAKURZ-UHFFFAOYSA-N	-1	0	372.366	2.007	50	5		FEBARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000003879448	132385894	/nfs/dbraw/zinc/38/58/94/132385894.db2.gz	VFYGCPDPBGSRJC-JKSUJKDBSA-N	-1	0	361.398	2.134	50	5		FEBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2cc(Br)ccc2O)[nH]1	ZINC000003898358	539374467	/nfs/dbraw/zinc/37/44/67/539374467.db2.gz	DVPCHIHYYCWWSD-HNQUOIGGSA-N	-1	0	354.116	2.022	50	5		FEBARM
COC(=O)c1cc(OC)ccc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000058160900	540830320	/nfs/dbraw/zinc/83/03/20/540830320.db2.gz	QXKBEVPOCCAFIZ-UHFFFAOYSA-N	-1	0	366.351	2.191	50	5		FEBARM
Cc1cc([N+](=O)[O-])ccc1[N-]c1c([N+](=O)[O-])nn(-c2ccccc2)[n+]1[O-]	ZINC000016282771	211159584	/nfs/dbraw/zinc/15/95/84/211159584.db2.gz	BTXPRUGVWYQUBS-UHFFFAOYSA-N	-1	0	356.298	2.374	50	5		FEBARM
CN(C(=O)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1)c1ccccc1	ZINC000225490246	548735975	/nfs/dbraw/zinc/73/59/75/548735975.db2.gz	DVYAGBXZXVTNPU-AWEZNQCLSA-N	-1	0	369.377	2.426	50	5		FEBARM
O=C([O-])CCCNC(=O)COc1ccc2c(c1)oc(=O)c1ccccc12	ZINC000002112747	539344831	/nfs/dbraw/zinc/34/48/31/539344831.db2.gz	NSJITANYHLJYNA-UHFFFAOYSA-N	-1	0	355.346	2.306	50	5	biogenic	FEBARM
Cc1cccc(Cn2cnc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)n2)c1	ZINC000002804314	539353814	/nfs/dbraw/zinc/35/38/14/539353814.db2.gz	ALXXLALVGMDYHL-UHFFFAOYSA-N	-1	0	373.394	2.344	50	5		FEBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2cc(Br)ccc2F)[nH]1	ZINC000004810955	539393277	/nfs/dbraw/zinc/39/32/77/539393277.db2.gz	NBIJLQDSIURNNW-DAFODLJHSA-N	-1	0	356.107	2.456	50	5		FEBARM
COc1ccc(NC(=O)c2c(C(=O)[O-])cccc2[N+](=O)[O-])c([N+](=O)[O-])c1	ZINC000015637172	211134095	/nfs/dbraw/zinc/13/40/95/211134095.db2.gz	LDVDNDWOKNWEDX-UHFFFAOYSA-N	-1	0	361.266	2.462	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000002843039	210428573	/nfs/dbraw/zinc/42/85/73/210428573.db2.gz	HWBHGGDKQPEUTK-UHFFFAOYSA-N	-1	0	366.351	2.175	50	5		FEBARM
COc1ccc(C([O-])=CC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1	ZINC000101354857	222271011	/nfs/dbraw/zinc/27/10/11/222271011.db2.gz	JQLGEPIAQNTZPL-UHFFFAOYSA-N	-1	0	372.333	2.393	50	5		FEBARM
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2nc3ccccn3n2)c1Cl	ZINC000225400527	548732623	/nfs/dbraw/zinc/73/26/23/548732623.db2.gz	FUTXJXVWELHLBJ-UHFFFAOYSA-N	-1	0	367.774	2.400	50	5		FEBARM
O=C([O-])C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2	ZINC000003856195	539373570	/nfs/dbraw/zinc/37/35/70/539373570.db2.gz	PQFSWUOMCYDAPB-CQSZACIVSA-N	-1	0	372.333	2.198	50	5		FEBARM
CCOc1cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[nH]2)cc(Cl)c1O	ZINC000010079053	539512265	/nfs/dbraw/zinc/51/22/65/539512265.db2.gz	PHLIVUDQUAENOD-ONEGZZNKSA-N	-1	0	353.718	2.312	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1[N-]c1c([N+](=O)[O-])nn(-c2ccccc2)[n+]1[O-]	ZINC000020209020	211273199	/nfs/dbraw/zinc/27/31/99/211273199.db2.gz	GMSROMMXDIUUEF-UHFFFAOYSA-N	-1	0	372.297	2.074	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000002058287	210379185	/nfs/dbraw/zinc/37/91/85/210379185.db2.gz	KAUCWJXQOCJYTE-UHFFFAOYSA-N	-1	0	353.312	2.312	50	5		FEBARM
Cc1c(OCC(=O)N[C@@H](C)C(=O)[O-])ccc2c3ccccc3c(=O)oc12	ZINC000002159937	539345915	/nfs/dbraw/zinc/34/59/15/539345915.db2.gz	DHCNRCCJWVIOOE-NSHDSACASA-N	-1	0	355.346	2.223	50	5	biogenic	FEBARM
O=C([O-])C[C@@H](NS(=O)(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1	ZINC000004580688	539387925	/nfs/dbraw/zinc/38/79/25/539387925.db2.gz	YKBXSLTXFRTIJJ-CQSZACIVSA-N	-1	0	368.342	2.228	50	5		FEBARM
COc1ccc(-n2nc([N+](=O)[O-])c([N-]c3cccc(OC)c3)[n+]2[O-])cc1	ZINC000004821923	539393166	/nfs/dbraw/zinc/39/31/66/539393166.db2.gz	AECSFQRHJKEIHZ-UHFFFAOYSA-N	-1	0	357.326	2.175	50	5		FEBARM
CCCC1=NC(=S)N[C@H](c2ccc([O-])c([N+](=O)[O-])c2)C1C(=O)OCC	ZINC000035358011	539981632	/nfs/dbraw/zinc/98/16/32/539981632.db2.gz	PRGJGMGVHORJTL-CQSZACIVSA-N	-1	0	365.411	2.437	50	5		FEBARM
COc1ccc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[nH]2)cc1Br	ZINC000016275828	211159331	/nfs/dbraw/zinc/15/93/31/211159331.db2.gz	VJXGMZRCLDQNHU-HWKANZROSA-N	-1	0	368.143	2.325	50	5		FEBARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)c1	ZINC000055555968	221071241	/nfs/dbraw/zinc/07/12/41/221071241.db2.gz	DZJOPGYSGDWLJZ-UHFFFAOYSA-N	-1	0	368.367	2.421	50	5		FEBARM
Cc1c(OCC(=O)NCCC(=O)[O-])ccc2c3ccccc3c(=O)oc12	ZINC000002114515	539345015	/nfs/dbraw/zinc/34/50/15/539345015.db2.gz	LACTYVRGMWVSMN-UHFFFAOYSA-N	-1	0	355.346	2.224	50	5	biogenic	FEBARM
Cc1ccccc1Cn1cnc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	ZINC000002782190	539352871	/nfs/dbraw/zinc/35/28/71/539352871.db2.gz	MAWXLTHDFDPCNC-UHFFFAOYSA-N	-1	0	373.394	2.344	50	5		FEBARM
COc1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1[N+](=O)[O-]	ZINC000004980339	539397436	/nfs/dbraw/zinc/39/74/36/539397436.db2.gz	UUZYQHRKECYFIU-UHFFFAOYSA-N	-1	0	352.324	2.102	50	5		FEBARM
COC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000004697317	219597490	/nfs/dbraw/zinc/59/74/90/219597490.db2.gz	MJIUUCJINDPPSY-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
O=C([O-])c1ccccc1C(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000003894111	132385887	/nfs/dbraw/zinc/38/58/87/132385887.db2.gz	KLRJSIVPZCZZFV-UHFFFAOYSA-N	-1	0	356.334	2.361	50	5		FEBARM
O=C([O-])CCCCCNS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000005756854	539415827	/nfs/dbraw/zinc/41/58/27/539415827.db2.gz	DUGCZLCWLWLCEF-UHFFFAOYSA-N	-1	0	350.780	2.172	50	5		FEBARM
CCOC(=O)c1cnn2c1[N-]N=C([N+](=O)[O-])[C@@H]2c1c[nH]c2ccccc21	ZINC000075286966	542166008	/nfs/dbraw/zinc/16/60/08/542166008.db2.gz	GSWHZYFAYYHMFP-ZDUSSCGKSA-N	-1	0	354.326	2.146	50	5		FEBARM
O=C([O-])C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2	ZINC000004718025	210557396	/nfs/dbraw/zinc/55/73/96/210557396.db2.gz	AASAAGQVBJFBKV-CYBMUJFWSA-N	-1	0	358.306	2.269	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)CCC[C@@H](C)C(=O)[O-]	ZINC000097002768	222149720	/nfs/dbraw/zinc/14/97/20/222149720.db2.gz	ACLJAOCVNHZPPD-MNOVXSKESA-N	-1	0	374.415	2.161	50	5		FEBARM
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000005028156	539400426	/nfs/dbraw/zinc/40/04/26/539400426.db2.gz	ZBPCGHNRSXTSDU-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
O=[N+]([O-])c1ccc(NCCO)c([N-]S(=O)(=O)c2c(F)cccc2F)c1	ZINC000026540697	539789177	/nfs/dbraw/zinc/78/91/77/539789177.db2.gz	PUHVBQBONUIIDA-UHFFFAOYSA-N	-1	0	373.337	2.078	50	5		FEBARM
COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000004013028	219533738	/nfs/dbraw/zinc/53/37/38/219533738.db2.gz	IMDSHRNQNZPNKS-UHFFFAOYSA-N	-1	0	361.266	2.462	50	5		FEBARM
C[C@H]1CN(C(=O)C(C)(C)C)C[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000293630534	223078627	/nfs/dbraw/zinc/07/86/27/223078627.db2.gz	GMBNOLFWVPJWBL-RYUDHWBXSA-N	-1	0	363.414	2.408	50	5		FEBARM
Cc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)nc1	ZINC000089652303	542767253	/nfs/dbraw/zinc/76/72/53/542767253.db2.gz	ULMWOGXKTVSFBY-UHFFFAOYSA-N	-1	0	372.200	2.862	50	5		FEBARM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2ncn(Cc3ccccc3)n2)c1	ZINC000006373297	263345111	/nfs/dbraw/zinc/34/51/11/263345111.db2.gz	ILYQZNPTGBWBAJ-UHFFFAOYSA-N	-1	0	359.367	2.035	50	5		FEBARM
O=C([O-])C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000005020944	539400571	/nfs/dbraw/zinc/40/05/71/539400571.db2.gz	NDBROMODXPTBHM-AWEZNQCLSA-N	-1	0	350.352	2.089	50	5		FEBARM
COc1cccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])c([O-])c3)CC2)c1	ZINC000035334133	132935970	/nfs/dbraw/zinc/93/59/70/132935970.db2.gz	OCUCLTAENLKLJL-UHFFFAOYSA-N	-1	0	357.366	2.271	50	5		FEBARM
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc([N+](=O)[O-])cc2)c1C	ZINC000095457184	542971079	/nfs/dbraw/zinc/97/10/79/542971079.db2.gz	XBJHPOSEGSLRKU-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
O=C(Nc1cc(=O)nc2[n-]c(C(F)(F)F)nn21)c1ccc([N+](=O)[O-])cc1	ZINC000008969789	539495512	/nfs/dbraw/zinc/49/55/12/539495512.db2.gz	FRWRPTLFIPWKIB-UHFFFAOYSA-N	-1	0	368.231	2.009	50	5		FEBARM
COC(=O)c1cccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1C	ZINC000002868869	539355888	/nfs/dbraw/zinc/35/58/88/539355888.db2.gz	QUZRIIWESOUGGP-UHFFFAOYSA-N	-1	0	350.352	2.491	50	5		FEBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000005008007	539399659	/nfs/dbraw/zinc/39/96/59/539399659.db2.gz	PXIIDHBNJKCZFB-UHFFFAOYSA-N	-1	0	353.312	2.312	50	5		FEBARM
COc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c([N+](=O)[O-])c1	ZINC000006088748	539421779	/nfs/dbraw/zinc/42/17/79/539421779.db2.gz	JPNVDRLXIBANKF-UHFFFAOYSA-N	-1	0	353.312	2.312	50	5		FEBARM
Cc1nnc(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[n-]c1=O	ZINC000018094168	220223279	/nfs/dbraw/zinc/22/32/79/220223279.db2.gz	DSDZNFWMBVFTOE-UHFFFAOYSA-N	-1	0	355.763	2.178	50	5		FEBARM
CC(C)(C)OC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(=O)[O-])CC1	ZINC000067172708	534839228	/nfs/dbraw/zinc/83/92/28/534839228.db2.gz	BSYOHJMSIFLHQB-UHFFFAOYSA-N	-1	0	351.359	2.350	50	5		FEBARM
COc1ccc(S(=O)(=O)[N-]c2ccc(NC(C)=O)cc2)c([N+](=O)[O-])c1	ZINC000006191781	539422618	/nfs/dbraw/zinc/42/26/18/539422618.db2.gz	SNEXJPOBJSJOQH-UHFFFAOYSA-N	-1	0	365.367	2.363	50	5		FEBARM
COc1cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[nH]2)ccc1OC(F)F	ZINC000009235257	539499486	/nfs/dbraw/zinc/49/94/86/539499486.db2.gz	MTDCVKXROMUSJX-HWKANZROSA-N	-1	0	355.253	2.164	50	5		FEBARM
COc1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2F)cc1[N+](=O)[O-]	ZINC000024432919	539731468	/nfs/dbraw/zinc/73/14/68/539731468.db2.gz	HNBNFVIQBRDWMQ-UHFFFAOYSA-N	-1	0	370.314	2.242	50	5		FEBARM
CC(C)(C)OC(=O)N1C[C@@H](Oc2cccc([N+](=O)[O-])c2)C[C@H]1C(=O)[O-]	ZINC000014632517	220128243	/nfs/dbraw/zinc/12/82/43/220128243.db2.gz	NKHQBHKCUHCTPO-STQMWFEESA-N	-1	0	352.343	2.436	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1ccc2c(c1)OCCO2	ZINC000055546046	221070463	/nfs/dbraw/zinc/07/04/63/221070463.db2.gz	SQVWZAPAMWLOAF-UHFFFAOYSA-N	-1	0	366.351	2.175	50	5		FEBARM
CCNC(=O)COc1cccc(NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)c1	ZINC000096014132	542987478	/nfs/dbraw/zinc/98/74/78/542987478.db2.gz	IPSQTYLXQNUJJH-UHFFFAOYSA-N	-1	0	359.338	2.068	50	5		FEBARM
C[C@@H]1CN(C(=O)C(C)(C)C)C[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000293630535	534299313	/nfs/dbraw/zinc/29/93/13/534299313.db2.gz	GMBNOLFWVPJWBL-TXEJJXNPSA-N	-1	0	363.414	2.408	50	5		FEBARM
NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1	ZINC000005883332	539418333	/nfs/dbraw/zinc/41/83/33/539418333.db2.gz	DYWZOYSFTGQWPI-UHFFFAOYSA-N	-1	0	355.759	2.148	50	5		FEBARM
O=C([O-])CCCCCNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000005756835	539416389	/nfs/dbraw/zinc/41/63/89/539416389.db2.gz	AGRRPGFPTDYICA-UHFFFAOYSA-N	-1	0	350.780	2.172	50	5		FEBARM
O=C([O-])C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000000187918	219305020	/nfs/dbraw/zinc/30/50/20/219305020.db2.gz	MBSNNYACNFXHKA-AWEZNQCLSA-N	-1	0	350.352	2.089	50	5		FEBARM
CN(C)c1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	ZINC000028293970	539829702	/nfs/dbraw/zinc/82/97/02/539829702.db2.gz	CVVWTQPNPXQTNF-UHFFFAOYSA-N	-1	0	366.355	2.370	50	5		FEBARM
COc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)cc1OC	ZINC000055555439	221071493	/nfs/dbraw/zinc/07/14/93/221071493.db2.gz	ATRSNMAKIUXKIW-UHFFFAOYSA-N	-1	0	368.367	2.421	50	5		FEBARM
COc1cc([N+](=O)[O-])ccc1NC(=O)C(=O)C=C([O-])c1ccccc1OC	ZINC000101354823	222272160	/nfs/dbraw/zinc/27/21/60/222272160.db2.gz	ANODGXLXFSACRX-UHFFFAOYSA-N	-1	0	372.333	2.393	50	5		FEBARM
O=C([O-])[C@@]12C[C@H]3C[C@@H](C1)C[C@](n1nc([N+](=O)[O-])nc1Br)(C3)C2	ZINC000102832844	222310450	/nfs/dbraw/zinc/31/04/50/222310450.db2.gz	DIYLKADNFMGZCX-GRUGVGOFSA-N	-1	0	371.191	2.329	50	5		FEBARM
CC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2[O-])c1	ZINC000003110410	539359956	/nfs/dbraw/zinc/35/99/56/539359956.db2.gz	XHVDYDYZQFSRDP-UHFFFAOYSA-N	-1	0	360.282	2.419	50	5		FEBARM
Cc1cc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2NCCO)c(C)s1	ZINC000026540735	539789525	/nfs/dbraw/zinc/78/95/25/539789525.db2.gz	FMXYTFWHJFODHY-UHFFFAOYSA-N	-1	0	371.440	2.478	50	5		FEBARM
O=[N+]([O-])c1ccccc1[N-]S(=O)(=O)N=c1[nH]c2ccccc2s1	ZINC000075250544	542164318	/nfs/dbraw/zinc/16/43/18/542164318.db2.gz	BMXOVNMQBNGRDQ-UHFFFAOYSA-N	-1	0	350.381	2.973	50	5		FEBARM
COC(=O)c1sccc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000009606190	539504887	/nfs/dbraw/zinc/50/48/87/539504887.db2.gz	GPORKEGQZSKMAQ-UHFFFAOYSA-N	-1	0	372.380	2.252	50	5		FEBARM