smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1ccccc1C(=O)c1ccc(NCc2cccnc2)c([N+](=O)[O-])c1	ZINC000006257825	842411341	/nfs/dbraw/zinc/41/13/41/842411341.db2.gz	ZLUYKCGWAAQDBD-UHFFFAOYSA-N	-1	0	377.356	3.531	50	5		GHBARM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2ccc(-c3cn4ccccc4n3)cc2)c1	ZINC000004033858	204024155	/nfs/dbraw/zinc/02/41/55/204024155.db2.gz	TYLQDKKEHZRFSJ-UHFFFAOYSA-N	-1	0	394.412	3.710	50	5		GHBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(-c3ccccc3C(F)(F)F)o2)[nH]1	ZINC000013943429	570883289	/nfs/dbraw/zinc/88/32/89/570883289.db2.gz	RIVPIDALPSUTDB-FNORWQNLSA-N	-1	0	393.277	3.833	50	5		GHBARM
O=C(Nc1nc(-c2ccc3c(c2)CCO3)cs1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000012763946	571013957	/nfs/dbraw/zinc/01/39/57/571013957.db2.gz	MPJVFNVMALYXLP-UHFFFAOYSA-N	-1	0	383.385	3.611	50	5		GHBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(-c3cccc4cccnc43)o2)[nH]1	ZINC000885828013	900610981	/nfs/dbraw/zinc/61/09/81/900610981.db2.gz	IRSIMEPNBCOXHQ-VURMDHGXSA-N	-1	0	376.328	3.775	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1Cl	ZINC000004717968	204067480	/nfs/dbraw/zinc/06/74/80/204067480.db2.gz	SVASWLVOGPBBHE-AWEZNQCLSA-N	-1	0	383.187	3.847	50	5		GHBARM
O=C([O-])c1ccccc1-c1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1	ZINC000008433940	204277314	/nfs/dbraw/zinc/27/73/14/204277314.db2.gz	QGUGDQSNVRTGLG-UHFFFAOYSA-N	-1	0	388.335	3.761	50	5		GHBARM
Cc1nc(-c2ccc(CCNC(=O)c3ccc([N+](=O)[O-])c([O-])c3)cc2)cs1	ZINC000012621529	204432327	/nfs/dbraw/zinc/43/23/27/204432327.db2.gz	WNAHKSMJRTZIGC-UHFFFAOYSA-N	-1	0	383.429	3.705	50	5		GHBARM
CCOC(=O)c1c(C)n(-c2ccccc2)c2cc([N+](=O)[O-])c([O-])c([N+](=O)[O-])c21	ZINC000017299632	570936797	/nfs/dbraw/zinc/93/67/97/570936797.db2.gz	ZHDRMFQLGFSDQH-UHFFFAOYSA-N	-1	0	385.332	3.638	50	5		GHBARM
Cc1ccccc1-c1nnc([N-]C(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])s1	ZINC000009446071	857202450	/nfs/dbraw/zinc/20/24/50/857202450.db2.gz	VKTXMARJBFCUFI-UHFFFAOYSA-N	-1	0	385.361	3.582	50	5		GHBARM
O=C([O-])c1ccc(S(=O)(=O)c2ccc(-c3ccc([N+](=O)[O-])cc3)cc2)cc1	ZINC000003129761	203986517	/nfs/dbraw/zinc/98/65/17/203986517.db2.gz	ZKKUREOWLHGSBL-UHFFFAOYSA-N	-1	0	383.381	3.793	50	5		GHBARM
O=C([O-])c1cc(Br)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004361092	204041214	/nfs/dbraw/zinc/04/12/14/204041214.db2.gz	QVMMYAKEIZPKRO-UHFFFAOYSA-N	-1	0	399.584	3.961	50	5		GHBARM
CCc1ccc([N-]c2c([N+](=O)[O-])nn(-c3cccc(C(F)(F)F)c3)[n+]2[O-])cc1	ZINC000004885444	204087278	/nfs/dbraw/zinc/08/72/78/204087278.db2.gz	QDTWOVGXGNIKOX-UHFFFAOYSA-N	-1	0	393.325	3.739	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(Cl)cc1	ZINC000004653251	204059756	/nfs/dbraw/zinc/05/97/56/204059756.db2.gz	WICWWQJORHNLFZ-ZDUSSCGKSA-N	-1	0	383.187	3.847	50	5		GHBARM
O=C(c1ccccc1)c1cccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000005065661	570409397	/nfs/dbraw/zinc/40/93/97/570409397.db2.gz	DRZNABFABALYSV-UHFFFAOYSA-N	-1	0	382.397	3.627	50	5		GHBARM
O=C(Cc1cccc2ccccc21)NC(=S)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000035864432	570466189	/nfs/dbraw/zinc/46/61/89/570466189.db2.gz	WHAYKUIMDHFFTI-UHFFFAOYSA-N	-1	0	381.413	3.509	50	5		GHBARM
CCCOc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1OCCC	ZINC000006623302	570506742	/nfs/dbraw/zinc/50/67/42/570506742.db2.gz	IYIRSYHZPNLASJ-UHFFFAOYSA-N	-1	0	394.449	3.973	50	5		GHBARM
O=C([O-])c1cc(-c2ccccc2O)nc2n[nH]c(-c3ccc([N+](=O)[O-])cc3)c21	ZINC000020134675	860495666	/nfs/dbraw/zinc/49/56/66/860495666.db2.gz	DBQOCMVXBPHIPU-UHFFFAOYSA-N	-1	0	376.328	3.604	50	5		GHBARM
O=C([O-])C(=Cc1ccc([N+](=O)[O-])cc1)Sc1nnc2c(n1)[nH]c1ccccc12	ZINC000036580065	205018043	/nfs/dbraw/zinc/01/80/43/205018043.db2.gz	SLMUCHIREKLOJR-NTEUORMPSA-N	-1	0	393.384	3.632	50	5		GHBARM
CCCCOc1ccc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)[O-])cc1	ZINC000002895332	861757895	/nfs/dbraw/zinc/75/78/95/861757895.db2.gz	IICVFILOZNWDJM-QGOAFFKASA-N	-1	0	384.388	3.629	50	5		GHBARM
O=C([O-])c1cc(Br)ccc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000002939503	861806504	/nfs/dbraw/zinc/80/65/04/861806504.db2.gz	NPEIYQWOOAUEOJ-FPYGCLRLSA-N	-1	0	391.177	3.707	50	5		GHBARM
COC(=O)[C@H]([N-]c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C	ZINC000004052735	204025187	/nfs/dbraw/zinc/02/51/87/204025187.db2.gz	LOBHPJYVIQACAR-NSHDSACASA-N	-1	0	379.291	3.521	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1ccc(Cl)cc1	ZINC000004653261	204060026	/nfs/dbraw/zinc/06/00/26/204060026.db2.gz	LSYKWXKLQMNVEU-CQSZACIVSA-N	-1	0	383.187	3.847	50	5		GHBARM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1cc(Cl)cc(Cl)c1	ZINC000007708306	204247352	/nfs/dbraw/zinc/24/73/52/204247352.db2.gz	QJFLNBKMZQHIRR-UHFFFAOYSA-N	-1	0	377.205	3.711	50	5		GHBARM
O=[N+]([O-])c1ccc([N-]S(=O)(=O)c2ccc(F)cc2F)cc1C(F)(F)F	ZINC000008195578	204266071	/nfs/dbraw/zinc/26/60/71/204266071.db2.gz	CZSVMRFYOJRPJR-UHFFFAOYSA-N	-1	0	382.266	3.693	50	5		GHBARM
O=c1nc(COCC(F)(F)F)[n-]c2cc(-c3cccc([N+](=O)[O-])c3)sc21	ZINC000053850989	205138436	/nfs/dbraw/zinc/13/84/36/205138436.db2.gz	LVPYQUOKNZWWKX-UHFFFAOYSA-N	-1	0	385.323	3.639	50	5		GHBARM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1n[nH]cc1-c1cccc(Cl)c1	ZINC000084190095	571008414	/nfs/dbraw/zinc/00/84/14/571008414.db2.gz	YIQDMPZYCRXKEP-UHFFFAOYSA-N	-1	0	392.824	3.748	50	5		GHBARM
CSc1nc2ccc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2s1	ZINC000004347445	204040506	/nfs/dbraw/zinc/04/05/06/204040506.db2.gz	MDTVKZXNJNMZSM-UHFFFAOYSA-N	-1	0	381.460	3.727	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)c1c(Cl)cccc1Cl)c1cccc([N+](=O)[O-])c1	ZINC000004602033	204056968	/nfs/dbraw/zinc/05/69/68/204056968.db2.gz	IRRIXZZRBRMQMX-CYBMUJFWSA-N	-1	0	383.187	3.847	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)c1ccc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000004653574	204059857	/nfs/dbraw/zinc/05/98/57/204059857.db2.gz	UMNBJFXCWKIOBX-CQSZACIVSA-N	-1	0	383.187	3.847	50	5		GHBARM
CC(C)CNc1nnc(Sc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])s1	ZINC000014202356	204527959	/nfs/dbraw/zinc/52/79/59/204527959.db2.gz	BZLWHICOJUZACD-GQCTYLIASA-N	-1	0	380.451	3.763	50	5		GHBARM
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2cc(-c3cccs3)[nH]n2)c1Cl	ZINC000225749961	206072682	/nfs/dbraw/zinc/07/26/82/206072682.db2.gz	XRRHFXXAVZLNQH-UHFFFAOYSA-N	-1	0	398.853	3.809	50	5		GHBARM
Cc1c(C(=O)[O-])cccc1N1C(=O)c2cccc3c([N+](=O)[O-])ccc(c32)C1=O	ZINC000001074782	203880820	/nfs/dbraw/zinc/88/08/20/203880820.db2.gz	JCHCZSNKUHUWCJ-UHFFFAOYSA-N	-1	0	376.324	3.555	50	5		GHBARM
O=C([O-])c1ccc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)c([N+](=O)[O-])c1	ZINC000004054089	204025149	/nfs/dbraw/zinc/02/51/49/204025149.db2.gz	JDDUDCWEOXQHKU-UHFFFAOYSA-N	-1	0	396.230	3.926	50	5		GHBARM
Cc1c(Cl)cccc1[N-]c1c([N+](=O)[O-])nn(-c2ccc(Cl)cc2)[n+]1[O-]	ZINC000004922977	204091818	/nfs/dbraw/zinc/09/18/18/204091818.db2.gz	CYAQGVLZADOFAD-UHFFFAOYSA-N	-1	0	380.191	3.773	50	5		GHBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])c(Cl)c1	ZINC000004923648	204091659	/nfs/dbraw/zinc/09/16/59/204091659.db2.gz	XHFJPFWGXNDTRO-UHFFFAOYSA-N	-1	0	380.191	3.773	50	5		GHBARM
Cc1c([N-]S(=O)(=O)c2ccc(Br)s2)cccc1[N+](=O)[O-]	ZINC000001117398	570753911	/nfs/dbraw/zinc/75/39/11/570753911.db2.gz	FIXZMLVMVHTDPA-UHFFFAOYSA-N	-1	0	377.241	3.528	50	5		GHBARM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1cccc2c1CN(CC(C)C)C2	ZINC000095982864	860733399	/nfs/dbraw/zinc/73/33/99/860733399.db2.gz	KYMWLUQWSJWVJH-UHFFFAOYSA-N	-1	0	389.477	3.676	50	5		GHBARM
COc1cc(/C=C\c2nc3ccc([N+](=O)[O-])cc3s2)ccc1OCC(=O)[O-]	ZINC000033581407	570380856	/nfs/dbraw/zinc/38/08/56/570380856.db2.gz	NIIINIMYTDLHPJ-CLTKARDFSA-N	-1	0	386.385	3.847	50	5		GHBARM
Cc1cc([N-]c2ccc(N3C(=O)[C@@H]4CC[C@H](C)C[C@@H]4C3=O)cc2[N+](=O)[O-])on1	ZINC000102785304	570863534	/nfs/dbraw/zinc/86/35/34/570863534.db2.gz	ZJGNAEMHSFXWFH-GDLCADMTSA-N	-1	0	384.392	3.560	50	5		GHBARM
CCOc1cc(C=Cc2[nH]c(=O)[n-]c(=O)c2[N+](=O)[O-])ccc1O[C@H](C)CC	ZINC000013468248	570953604	/nfs/dbraw/zinc/95/36/04/570953604.db2.gz	DSADXIMEVUBUNH-BPOWMSRESA-N	-1	0	375.381	3.542	50	5		GHBARM
COc1cccc(-c2cc(C(=O)[O-])c3c(n[nH]c3-c3cccc([N+](=O)[O-])c3)n2)c1	ZINC000020492270	860587626	/nfs/dbraw/zinc/58/76/26/860587626.db2.gz	FYLLKLMCWJEKFM-UHFFFAOYSA-N	-1	0	390.355	3.907	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000004653743	204059286	/nfs/dbraw/zinc/05/92/86/204059286.db2.gz	IFZUVRVXTIOUEJ-CYBMUJFWSA-N	-1	0	383.187	3.847	50	5		GHBARM
Cc1ccc(Cl)cc1[N-]c1c([N+](=O)[O-])nn(-c2cccc(Cl)c2)[n+]1[O-]	ZINC000004923765	204091712	/nfs/dbraw/zinc/09/17/12/204091712.db2.gz	IJDPJJUIPBKPFW-UHFFFAOYSA-N	-1	0	380.191	3.773	50	5		GHBARM
CC(C)Nc1cc(C(=O)c2cc(F)ccc2[O-])cn2c(=O)c3ccccc3nc12	ZINC000009516971	204314426	/nfs/dbraw/zinc/31/44/26/204314426.db2.gz	ZDQIYXHWDNSHGG-UHFFFAOYSA-N	-1	0	391.402	3.744	50	5		GHBARM
CCOC(=O)c1c(C)c(C(C)=O)sc1NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000001930561	570450011	/nfs/dbraw/zinc/45/00/11/570450011.db2.gz	XQKUZJNNAPIMFE-UHFFFAOYSA-N	-1	0	376.390	3.596	50	5		GHBARM
CCc1c(C)sc(NC(=S)Nc2cc([N+](=O)[O-])ccc2[O-])c1C(=O)OC	ZINC000035884018	570471516	/nfs/dbraw/zinc/47/15/16/570471516.db2.gz	QTCSKYJVYMRUQV-UHFFFAOYSA-N	-1	0	395.462	3.828	50	5		GHBARM
CSc1ccc([N-]S(=O)(=O)c2cc(Cl)c([N+](=O)[O-])cc2F)cc1	ZINC000328597709	860185337	/nfs/dbraw/zinc/18/53/37/860185337.db2.gz	ITVCTFWCUFPANE-UHFFFAOYSA-N	-1	0	376.818	3.910	50	5		GHBARM
COc1ccccc1-c1cc(C(=O)[O-])c2c(n[nH]c2-c2ccc([N+](=O)[O-])cc2)n1	ZINC000020492105	860587387	/nfs/dbraw/zinc/58/73/87/860587387.db2.gz	QQSBRURGMLNIBQ-UHFFFAOYSA-N	-1	0	390.355	3.907	50	5		GHBARM
O=C(Nc1ccccc1)c1ccccc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000003991786	204023138	/nfs/dbraw/zinc/02/31/38/204023138.db2.gz	AEPZLELXAZPBSM-UHFFFAOYSA-N	-1	0	397.412	3.648	50	5		GHBARM
COCc1cc(C)nc2sc3c([n-]c(-c4ccccc4[N+](=O)[O-])nc3=O)c21	ZINC000078549431	205375523	/nfs/dbraw/zinc/37/55/23/205375523.db2.gz	VHTFURCFKDMCPF-UHFFFAOYSA-N	-1	0	382.401	3.975	50	5		GHBARM
Cc1c([N+](=O)[O-])cc(C(=O)[N-]c2c(F)c(F)c(F)c(F)c2F)cc1[N+](=O)[O-]	ZINC000002084703	570933281	/nfs/dbraw/zinc/93/32/81/570933281.db2.gz	NQWIWLUSQPLFFV-UHFFFAOYSA-N	-1	0	391.208	3.759	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)CSc1ccccc1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686813	204064703	/nfs/dbraw/zinc/06/47/03/204064703.db2.gz	RMHZJVWETYDGTA-OAHLLOKOSA-N	-1	0	394.836	3.673	50	5		GHBARM
C[C@@H](SCc1nc2cc([N+](=O)[O-])ccc2n1-c1ccc(F)cc1)C(=O)[O-]	ZINC000025106688	570724230	/nfs/dbraw/zinc/72/42/30/570724230.db2.gz	NEQUIIHUSLAORW-SNVBAGLBSA-N	-1	0	375.381	3.779	50	5		GHBARM
CCCOc1ccc([C@@H](CC(=O)[O-])NC(=O)c2cccc([N+](=O)[O-])c2C)cc1	ZINC000003623646	204015825	/nfs/dbraw/zinc/01/58/25/204015825.db2.gz	GORPXRIFSFDLCR-QGZVFWFLSA-N	-1	0	386.404	3.638	50	5		GHBARM
O=C1C[C@H](Sc2ccc(Cl)cc2)C([O-])=C1Nc1ccccc1[N+](=O)[O-]	ZINC000006995837	204228551	/nfs/dbraw/zinc/22/85/51/204228551.db2.gz	PWOIUWKQGPSXLO-HOTGVXAUSA-N	-1	0	376.821	3.732	50	5		GHBARM
O=C([O-])c1cccc(Nc2c(-c3ccc([N+](=O)[O-])cc3)nc3cnccn32)c1	ZINC000065322798	205230291	/nfs/dbraw/zinc/23/02/91/205230291.db2.gz	BBXWWJKHUUQVMK-UHFFFAOYSA-N	-1	0	375.344	3.746	50	5		GHBARM
COc1cc(C(=O)[O-])c(Br)cc1OCc1ccc([N+](=O)[O-])cc1	ZINC000227156715	206102198	/nfs/dbraw/zinc/10/21/98/206102198.db2.gz	LPIFLTBJVGVMQH-UHFFFAOYSA-N	-1	0	382.166	3.643	50	5		GHBARM
O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(Br)cc2)c1	ZINC000005234910	570523543	/nfs/dbraw/zinc/52/35/43/570523543.db2.gz	ZNZXEISUNCTGRB-UHFFFAOYSA-N	-1	0	391.630	3.812	50	5		GHBARM
Cc1ccccc1NC(=O)C[C@@H]([N-]C(=O)C(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000006997427	570733124	/nfs/dbraw/zinc/73/31/24/570733124.db2.gz	NFSDUJHQBKROQN-OAHLLOKOSA-N	-1	0	395.337	3.652	50	5		GHBARM
COc1ccc(S(=O)(=O)[N-]c2cccc([N+](=O)[O-])c2)c(Cl)c1Cl	ZINC000001128680	570755497	/nfs/dbraw/zinc/75/54/97/570755497.db2.gz	AIMQJJQNZBDKAV-UHFFFAOYSA-N	-1	0	377.205	3.711	50	5		GHBARM
CCOC(=O)c1c([N-]c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])sc2c1CCC2	ZINC000005332620	204125444	/nfs/dbraw/zinc/12/54/44/204125444.db2.gz	SHPNKNNSDOLMFS-UHFFFAOYSA-N	-1	0	377.378	3.974	50	5		GHBARM
CCCCOc1ccc2ccccc2c1C=Cc1[nH]c(=O)[n-]c(=O)c1[N+](=O)[O-]	ZINC000005041440	204105906	/nfs/dbraw/zinc/10/59/06/204105906.db2.gz	XDXTURAGOILRRC-MDZDMXLPSA-N	-1	0	381.388	3.886	50	5		GHBARM
CC(C)OC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	ZINC000007054951	204231646	/nfs/dbraw/zinc/23/16/46/204231646.db2.gz	VVLSYXMOSACMKI-UHFFFAOYSA-N	-1	0	398.824	3.614	50	5		GHBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2cccc(-c3cn4ccccc4n3)c2)cc1	ZINC000001030894	570747856	/nfs/dbraw/zinc/74/78/56/570747856.db2.gz	ZOMOERCRGNBHIA-UHFFFAOYSA-N	-1	0	394.412	3.710	50	5		GHBARM
CCN(CC)c1ccc2cc(C(=O)Nc3cccc([N+](=O)[O-])c3)/c(=N/O)oc2c1	ZINC000004663578	204060480	/nfs/dbraw/zinc/06/04/80/204060480.db2.gz	IVQIAIOEAFBEFW-XDOYNYLZSA-N	-1	0	396.403	3.729	50	5		GHBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2cc(-c3ccccc3)on2)c(Cl)c1	ZINC000225464248	206050250	/nfs/dbraw/zinc/05/02/50/206050250.db2.gz	OVWOWCOQXDHFIB-UHFFFAOYSA-N	-1	0	379.781	3.704	50	5		GHBARM
CCc1nc2sc([C@@H](c3ccc([N+](=O)[O-])cc3)N3CCCCC3)c([O-])n2n1	ZINC000022853070	570556607	/nfs/dbraw/zinc/55/66/07/570556607.db2.gz	WDEFPGFWTHSFHE-OAHLLOKOSA-N	-1	0	387.465	3.542	50	5		GHBARM
O=[N+]([O-])c1ccc(-c2csc([N-]c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])n2)o1	ZINC000104152749	570896533	/nfs/dbraw/zinc/89/65/33/570896533.db2.gz	WAHXIKBMISMSMO-UHFFFAOYSA-N	-1	0	377.294	3.871	50	5		GHBARM
CCCCc1nnc2n1N1C(=CS[C@H]1c1ccc([O-])c([N+](=O)[O-])c1)S2	ZINC000020730643	900176135	/nfs/dbraw/zinc/17/61/35/900176135.db2.gz	HYRXSKRPAHBZLZ-AWEZNQCLSA-N	-1	0	377.451	3.523	50	5		GHBARM
Cc1ccc(-c2csc(NC(=O)c3cccc([N+](=O)[O-])c3C(=O)[O-])n2)cc1	ZINC000004855173	204083093	/nfs/dbraw/zinc/08/30/93/204083093.db2.gz	ZTBPWJOAMTTZRA-UHFFFAOYSA-N	-1	0	383.385	3.977	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)CSc1ccccc1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686809	204063977	/nfs/dbraw/zinc/06/39/77/204063977.db2.gz	RMHZJVWETYDGTA-HNNXBMFYSA-N	-1	0	394.836	3.673	50	5		GHBARM
O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CCC[C@H](c2nc3ccccc3s2)C1	ZINC000012989370	204473909	/nfs/dbraw/zinc/47/39/09/204473909.db2.gz	ZEWNFSSCIOYPIZ-ZDUSSCGKSA-N	-1	0	383.429	3.930	50	5		GHBARM
O=C([O-])c1cccc(CN2C(=O)S/C(=C/c3ccccc3[N+](=O)[O-])C2=O)c1	ZINC000002352842	898100051	/nfs/dbraw/zinc/10/00/51/898100051.db2.gz	UIEKPGCTBLUXNF-OQLLNIDSSA-N	-1	0	384.369	3.530	50	5		GHBARM
O=C([O-])/C(NC(=O)c1ccccc1)=C1\c2ccccc2-c2ccc([N+](=O)[O-])cc21	ZINC000001189827	206365425	/nfs/dbraw/zinc/36/54/25/206365425.db2.gz	KIMLCUKBARWZBP-VXPUYCOJSA-N	-1	0	386.363	3.849	50	5		GHBARM
CCCCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000036644252	520723954	/nfs/dbraw/zinc/72/39/54/520723954.db2.gz	JOWJECVNODXDFK-UHFFFAOYSA-N	-1	0	392.433	3.661	50	5		GHBARM
O=[N+]([O-])c1nn(-c2cccc(Cl)c2)[n+]([O-])c1[N-]c1ccc(F)cc1Cl	ZINC000004924019	570370570	/nfs/dbraw/zinc/37/05/70/570370570.db2.gz	IESRKCIMYXLKAZ-UHFFFAOYSA-N	-1	0	384.154	3.603	50	5		GHBARM
O=C([O-])c1ccc(/C=C2/SC(=O)N(Cc3cccc([N+](=O)[O-])c3)C2=O)cc1	ZINC000004550841	570896809	/nfs/dbraw/zinc/89/68/09/570896809.db2.gz	RHUXRQIHMDTANE-OQLLNIDSSA-N	-1	0	384.369	3.530	50	5		GHBARM
Cc1cc([N-]c2ccc(N3C(=O)[C@@H]4CC[C@@H](C)C[C@H]4C3=O)cc2[N+](=O)[O-])on1	ZINC000104798185	570905593	/nfs/dbraw/zinc/90/55/93/570905593.db2.gz	ZJGNAEMHSFXWFH-LERXQTSPSA-N	-1	0	384.392	3.560	50	5		GHBARM
CN(c1ccccc1)c1ccccc1NS(=O)(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000032932358	570945275	/nfs/dbraw/zinc/94/52/75/570945275.db2.gz	SWXFEJWDOYVIGO-UHFFFAOYSA-N	-1	0	399.428	3.869	50	5		GHBARM
COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)c2ccccc2)cc1	ZINC000012979848	899051842	/nfs/dbraw/zinc/05/18/42/899051842.db2.gz	HJMOVZIKEUVOEY-HXUWFJFHSA-N	-1	0	378.384	3.828	50	5		GHBARM
COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)c2ccccc2)cc1	ZINC000012979846	899052092	/nfs/dbraw/zinc/05/20/92/899052092.db2.gz	HJMOVZIKEUVOEY-FQEVSTJZSA-N	-1	0	378.384	3.828	50	5		GHBARM
CCCCc1nnc2n1N1C(=CS[C@@H]1c1ccc([O-])c([N+](=O)[O-])c1)S2	ZINC000020730647	207211725	/nfs/dbraw/zinc/21/17/25/207211725.db2.gz	HYRXSKRPAHBZLZ-CQSZACIVSA-N	-1	0	377.451	3.523	50	5		GHBARM
COc1ccc(-c2csc(NC(=O)c3cccc([N+](=O)[O-])c3C(=O)[O-])n2)cc1	ZINC000005527142	208671289	/nfs/dbraw/zinc/67/12/89/208671289.db2.gz	PIFXAAUREQBWER-UHFFFAOYSA-N	-1	0	399.384	3.677	50	5		GHBARM
COC(=O)c1c(C)c(C)sc1NC(=S)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000035884015	570471411	/nfs/dbraw/zinc/47/14/11/570471411.db2.gz	JJBMRLNEBHYFTB-UHFFFAOYSA-N	-1	0	381.435	3.574	50	5		GHBARM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2cccc(-c3cn4ccccc4n3)c2)c1	ZINC000004354030	570691613	/nfs/dbraw/zinc/69/16/13/570691613.db2.gz	CCDSBDXWIVIDNW-UHFFFAOYSA-N	-1	0	394.412	3.710	50	5		GHBARM
COC(=O)[C@@H]([N-]c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C	ZINC000004052734	862740624	/nfs/dbraw/zinc/74/06/24/862740624.db2.gz	LOBHPJYVIQACAR-LLVKDONJSA-N	-1	0	379.291	3.521	50	5		GHBARM
O=C([O-])[C@@H]1CS[C@H](c2ccccc2Cl)N1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000004177937	898211047	/nfs/dbraw/zinc/21/10/47/898211047.db2.gz	VTTWMSWWFLOKML-GOEBONIOSA-N	-1	0	392.820	3.589	50	5		GHBARM
O=C([O-])[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2	ZINC000010435001	206392270	/nfs/dbraw/zinc/39/22/70/206392270.db2.gz	DBLBGYFZSOEVDS-DIQJQSEOSA-N	-1	0	392.839	3.648	50	5		GHBARM
COc1cc(/C=C2\CCn3c2nc2cc(Cl)ccc2c3=O)cc([N+](=O)[O-])c1[O-]	ZINC000035587894	570402123	/nfs/dbraw/zinc/40/21/23/570402123.db2.gz	LFJKGYUSKFCMER-IZZDOVSWSA-N	-1	0	399.790	3.617	50	5		GHBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2cn(Cc3ccccc3)c3ccccc23)[nH]1	ZINC000005064303	570408980	/nfs/dbraw/zinc/40/89/80/570408980.db2.gz	WBTORKRITLRPEX-ZHACJKMWSA-N	-1	0	388.383	3.557	50	5		GHBARM
O=C([O-])c1ccccc1-c1nc2ccccc2c2nc(=O)c(-c3ccccc3)nn21	ZINC000065501954	570827519	/nfs/dbraw/zinc/82/75/19/570827519.db2.gz	IVINGVMVHLVFJL-UHFFFAOYSA-N	-1	0	394.390	3.670	50	5		GHBARM
O=c1[nH]c(SCc2ccc([N+](=O)[O-])cc2)nc2c1cnn2-c1ccccc1	ZINC000002717732	861529943	/nfs/dbraw/zinc/52/99/43/861529943.db2.gz	QNBOILLXJCHVHJ-UHFFFAOYSA-N	-1	0	379.401	3.722	50	5		GHBARM
O=[N+]([O-])c1cc([N+](=O)[O-])c([N-]c2ccc(Cl)c([N+](=O)[O-])c2)c([N+](=O)[O-])c1	ZINC000104233867	206230263	/nfs/dbraw/zinc/23/02/63/206230263.db2.gz	HAKHKUNDPNWMOZ-UHFFFAOYSA-N	-1	0	383.660	3.716	50	5		GHBARM
COC([O-])=NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	ZINC000001040675	206344174	/nfs/dbraw/zinc/34/41/74/206344174.db2.gz	KYFIOXHVUGJGHS-UHFFFAOYSA-N	-1	0	384.266	3.902	50	5		GHBARM
Cc1ccc2c(c1)c(CC(=O)Nc1cccc([N+](=O)[O-])c1C)c(C(=O)[O-])n2C	ZINC000004821814	570288557	/nfs/dbraw/zinc/28/85/57/570288557.db2.gz	GAAYJUQAQUYGJV-UHFFFAOYSA-N	-1	0	381.388	3.583	50	5		GHBARM
O=C1OC(c2ccccc2)=N/C1=C/c1ccc(-c2cc([N+](=O)[O-])ccc2[O-])o1	ZINC000035396482	570348194	/nfs/dbraw/zinc/34/81/94/570348194.db2.gz	FIWWTJPYAJPJOR-LFIBNONCSA-N	-1	0	376.324	3.905	50	5		GHBARM
O=C([O-])[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2	ZINC000005749618	570922283	/nfs/dbraw/zinc/92/22/83/570922283.db2.gz	DBLBGYFZSOEVDS-PDQODMTBSA-N	-1	0	392.839	3.648	50	5		GHBARM
O=C1OC2(CCCCC2)OC([O-])=C1c1c(F)c(F)c([N+](=O)[O-])c(F)c1F	ZINC000526058547	858153360	/nfs/dbraw/zinc/15/33/60/858153360.db2.gz	AKXCTOVBIXKKDQ-UHFFFAOYSA-N	-1	0	377.246	3.612	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000004622574	206536125	/nfs/dbraw/zinc/53/61/25/206536125.db2.gz	IFZUVRVXTIOUEJ-ZDUSSCGKSA-N	-1	0	383.187	3.847	50	5		GHBARM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2nc3ccccc3nc2Cl)ccc1Cl	ZINC000003885319	570817428	/nfs/dbraw/zinc/81/74/28/570817428.db2.gz	ZDDVIRYZARFPSI-UHFFFAOYSA-N	-1	0	399.215	3.646	50	5		GHBARM
Cc1cc([N-]c2ccc(N3C(=O)[C@@H]4CC[C@@H](C)C[C@@H]4C3=O)cc2[N+](=O)[O-])on1	ZINC000102785307	570863510	/nfs/dbraw/zinc/86/35/10/570863510.db2.gz	ZJGNAEMHSFXWFH-HONMWMINSA-N	-1	0	384.392	3.560	50	5		GHBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(-c3cccc4cccnc43)o2)[nH]1	ZINC000253630336	916199476	/nfs/dbraw/zinc/19/94/76/916199476.db2.gz	IRSIMEPNBCOXHQ-SOFGYWHQSA-N	-1	0	376.328	3.775	50	5		GHBARM
COc1cc(/C=C\c2ccc3c(cccc3[N+](=O)[O-])n2)ccc1OCC(=O)[O-]	ZINC000033496889	206264556	/nfs/dbraw/zinc/26/45/56/206264556.db2.gz	LWTHWWUDJAWPEX-ALCCZGGFSA-N	-1	0	380.356	3.785	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1cccc([N+](=O)[O-])c1	ZINC000004619074	206536201	/nfs/dbraw/zinc/53/62/01/206536201.db2.gz	CGOFMHUIODUDMT-AWEZNQCLSA-N	-1	0	383.187	3.847	50	5		GHBARM
COc1ccc(-c2cc(C(=O)[O-])c3c(n[nH]c3-c3ccc([N+](=O)[O-])cc3)n2)cc1	ZINC000020849637	207215685	/nfs/dbraw/zinc/21/56/85/207215685.db2.gz	RGKACDXBTSZQDE-UHFFFAOYSA-N	-1	0	390.355	3.907	50	5		GHBARM
CCc1nc2sc([C@H](c3ccc([N+](=O)[O-])cc3)N3CCCCC3)c([O-])n2n1	ZINC000022853067	570556616	/nfs/dbraw/zinc/55/66/16/570556616.db2.gz	WDEFPGFWTHSFHE-HNNXBMFYSA-N	-1	0	387.465	3.542	50	5		GHBARM
CCCOc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000004593241	570624146	/nfs/dbraw/zinc/62/41/46/570624146.db2.gz	ZCHBRBWRSOTSIX-KRWDZBQOSA-N	-1	0	386.404	3.638	50	5		GHBARM
Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2)cs1	ZINC000002483850	861197173	/nfs/dbraw/zinc/19/71/73/861197173.db2.gz	GLKCOPMVOLMPAS-UHFFFAOYSA-N	-1	0	375.431	3.828	50	5		GHBARM
O=C(CSc1nc2cc(Cl)ccc2[nH]1)Nc1ccc([N+](=O)[O-])cc1[O-]	ZINC000008014951	863001000	/nfs/dbraw/zinc/00/10/00/863001000.db2.gz	NCPKFJILJNMSIF-UHFFFAOYSA-N	-1	0	378.797	3.561	50	5		GHBARM
Cc1c(C(=O)[O-])sc2[nH]c(C=Cc3cc([N+](=O)[O-])ccc3Cl)nc(=O)c12	ZINC000008882505	922399272	/nfs/dbraw/zinc/39/92/72/922399272.db2.gz	SPOGVVPBIFVCCG-GORDUTHDSA-N	-1	0	391.792	3.723	50	5		GHBARM
COc1cc(/C=C2\C(=O)Nc3ccc(Br)cc32)cc([N+](=O)[O-])c1[O-]	ZINC000015016072	207041578	/nfs/dbraw/zinc/04/15/78/207041578.db2.gz	LBWNPEJGCUOVKK-WCIBSUBMSA-N	-1	0	391.177	3.564	50	5		GHBARM
COc1ccc(-c2c(C)[n-]n3c2nc(-c2ccc([N+](=O)[O-])cc2)cc3=O)cc1	ZINC000100525745	208377473	/nfs/dbraw/zinc/37/74/73/208377473.db2.gz	SZTQHKZVTLGFSD-UHFFFAOYSA-N	-1	0	376.372	3.582	50	5		GHBARM
CCCOc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000004593229	570623948	/nfs/dbraw/zinc/62/39/48/570623948.db2.gz	ZCHBRBWRSOTSIX-QGZVFWFLSA-N	-1	0	386.404	3.638	50	5		GHBARM
O=c1[nH]c(C=Cc2ccc(-c3ccccc3C(F)(F)F)o2)nc([O-])c1[N+](=O)[O-]	ZINC000009234945	898658645	/nfs/dbraw/zinc/65/86/45/898658645.db2.gz	RIQXPCSAADVWRZ-SOFGYWHQSA-N	-1	0	393.277	3.833	50	5		GHBARM
Cc1ccc2nc([N-]S(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)sc2c1	ZINC000024754837	570289940	/nfs/dbraw/zinc/28/99/40/570289940.db2.gz	WCHHLBSGOFOECP-UHFFFAOYSA-N	-1	0	383.838	3.967	50	5		GHBARM
O=C(c1cccc([N+](=O)[O-])c1)N1NC(C2CCCCC2)=C[C@]1(O)C(F)(F)F	ZINC000004163631	570968129	/nfs/dbraw/zinc/96/81/29/570968129.db2.gz	FNSPRIDGSYIFLI-INIZCTEOSA-N	-1	0	385.342	3.628	50	5		GHBARM
COCc1cccc([N-]S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)c1	ZINC000328596085	206231087	/nfs/dbraw/zinc/23/10/87/206231087.db2.gz	RULUHNDJBKJYTC-UHFFFAOYSA-N	-1	0	391.232	3.849	50	5		GHBARM
O=C([O-])CCCC(=O)N1N=C(c2ccccc2)C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000000907723	206332896	/nfs/dbraw/zinc/33/28/96/206332896.db2.gz	KVTYHYDIPOCBEI-SFHVURJKSA-N	-1	0	381.388	3.527	50	5		GHBARM
O=C([O-])c1cc(-c2ccc(O)cc2)nc2n[nH]c(-c3ccc([N+](=O)[O-])cc3)c21	ZINC000020492186	207199878	/nfs/dbraw/zinc/19/98/78/207199878.db2.gz	OWZPHBCMOTUFGW-UHFFFAOYSA-N	-1	0	376.328	3.604	50	5		GHBARM
O=C1C[C@@H](Sc2ccc(Cl)cc2)C([O-])=C1Nc1ccccc1[N+](=O)[O-]	ZINC000006995839	570730949	/nfs/dbraw/zinc/73/09/49/570730949.db2.gz	PWOIUWKQGPSXLO-HZPDHXFCSA-N	-1	0	376.821	3.732	50	5		GHBARM
CCCOc1ccc([C@H](CC(=O)[O-])NC(=O)c2cccc([N+](=O)[O-])c2C)cc1	ZINC000003623648	862525404	/nfs/dbraw/zinc/52/54/04/862525404.db2.gz	GORPXRIFSFDLCR-KRWDZBQOSA-N	-1	0	386.404	3.638	50	5		GHBARM
O=C([O-])c1cccc(CN2C(=O)S/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)c1	ZINC000004898889	206568841	/nfs/dbraw/zinc/56/88/41/206568841.db2.gz	CKVJBQJWIBGJNO-OQLLNIDSSA-N	-1	0	384.369	3.530	50	5		GHBARM
O=C([O-])c1cc(-c2ccccc2O)nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)c21	ZINC000020492272	207199410	/nfs/dbraw/zinc/19/94/10/207199410.db2.gz	TYPOVPSKUGWFNZ-UHFFFAOYSA-N	-1	0	376.328	3.604	50	5		GHBARM
COc1cc(/C=C2\CCn3c2nc2sc(C)c(C)c2c3=O)cc([N+](=O)[O-])c1[O-]	ZINC000036290102	207519465	/nfs/dbraw/zinc/51/94/65/207519465.db2.gz	FEIIWYXWRISMCA-WUXMJOGZSA-N	-1	0	399.428	3.642	50	5		GHBARM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2ccccc2OC(F)F)ccc1Cl	ZINC000007159026	570502290	/nfs/dbraw/zinc/50/22/90/570502290.db2.gz	CSDUXAMNOKDOCT-UHFFFAOYSA-N	-1	0	378.740	3.650	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)c1ccc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000004622474	570697875	/nfs/dbraw/zinc/69/78/75/570697875.db2.gz	UMNBJFXCWKIOBX-AWEZNQCLSA-N	-1	0	383.187	3.847	50	5		GHBARM
O=C([O-])c1ccc2c(=O)n3c(nc2c1)/C(=C/c1ccc(Cl)c([N+](=O)[O-])c1)CC3	ZINC000005937479	206634106	/nfs/dbraw/zinc/63/41/06/206634106.db2.gz	NPMCGXHCFGTNNO-YRNVUSSQSA-N	-1	0	397.774	3.601	50	5		GHBARM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]c1ccc2[nH]c(C3CCC3)nc2c1	ZINC000079047648	208069701	/nfs/dbraw/zinc/06/97/01/208069701.db2.gz	PTQJYYBDLQRPNN-UHFFFAOYSA-N	-1	0	386.433	3.848	50	5		GHBARM
O=C1[N-]C(=O)/C(=C/c2c(OCc3ccc([N+](=O)[O-])cc3)ccc3ccccc32)N1	ZINC000013546541	570654276	/nfs/dbraw/zinc/65/42/76/570654276.db2.gz	LYYARUSSGPOJJK-WQRHYEAKSA-N	-1	0	389.367	3.507	50	5		GHBARM
O=C([O-])c1cc(-c2ccc(O)cc2)nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)c21	ZINC000020492258	207199931	/nfs/dbraw/zinc/19/99/31/207199931.db2.gz	WZJZCBRHAVTJOG-UHFFFAOYSA-N	-1	0	376.328	3.604	50	5		GHBARM
CC(C)(C)c1nc2cc([N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])ccc2o1	ZINC000032097431	207393684	/nfs/dbraw/zinc/39/36/84/207393684.db2.gz	GBKAJLJTAJOZOH-UHFFFAOYSA-N	-1	0	375.406	3.834	50	5		GHBARM
O=C([N-]c1nnc(-c2cc(Cl)sc2Cl)o1)c1ccc([N+](=O)[O-])o1	ZINC000036646818	570782352	/nfs/dbraw/zinc/78/23/52/570782352.db2.gz	ZLWLILOXYYDIPG-UHFFFAOYSA-N	-1	0	375.149	3.858	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)CCCc1ccccc1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686323	570830566	/nfs/dbraw/zinc/83/05/66/570830566.db2.gz	RPNJGEIAIQNZON-QGZVFWFLSA-N	-1	0	390.823	3.903	50	5		GHBARM
COc1cc(/C=C2/CCn3c2nc2cc(Cl)ccc2c3=O)cc([N+](=O)[O-])c1[O-]	ZINC000069842983	857094988	/nfs/dbraw/zinc/09/49/88/857094988.db2.gz	LFJKGYUSKFCMER-WDZFZDKYSA-N	-1	0	399.790	3.617	50	5		GHBARM
O=C([O-])c1cc(-c2cccc(O)c2)nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)c21	ZINC000020492296	207198717	/nfs/dbraw/zinc/19/87/17/207198717.db2.gz	AAUCGRGCFTWWTR-UHFFFAOYSA-N	-1	0	376.328	3.604	50	5		GHBARM
COc1ccccc1-c1c(C)[n-]n2c1nc(-c1ccc([N+](=O)[O-])cc1)cc2=O	ZINC000100582191	208375366	/nfs/dbraw/zinc/37/53/66/208375366.db2.gz	RNHHGVHPIYCXJV-UHFFFAOYSA-N	-1	0	376.372	3.582	50	5		GHBARM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1NCC(F)(F)F	ZINC000048324620	570235928	/nfs/dbraw/zinc/23/59/28/570235928.db2.gz	GSEVKOHSELLHGI-UHFFFAOYSA-N	-1	0	389.355	3.678	50	5		GHBARM
Cc1ccc(NC(=O)c2c(C(=O)[O-])cccc2[N+](=O)[O-])c(Br)c1	ZINC000001221134	206369251	/nfs/dbraw/zinc/36/92/51/206369251.db2.gz	HZBZCXAKSWONII-UHFFFAOYSA-N	-1	0	379.166	3.616	50	5		GHBARM
O=C([O-])[C@@H]1CS[C@@H](c2ccccc2Cl)N1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000004177939	206505830	/nfs/dbraw/zinc/50/58/30/206505830.db2.gz	VTTWMSWWFLOKML-HOCLYGCPSA-N	-1	0	392.820	3.589	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)CCCc1ccccc1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000004686321	206542420	/nfs/dbraw/zinc/54/24/20/206542420.db2.gz	RPNJGEIAIQNZON-KRWDZBQOSA-N	-1	0	390.823	3.903	50	5		GHBARM
COc1ccc(-c2cc(C(=O)[O-])c3c(n[nH]c3-c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000020492274	207199902	/nfs/dbraw/zinc/19/99/02/207199902.db2.gz	BQKFDDKHQMWOSU-UHFFFAOYSA-N	-1	0	390.355	3.907	50	5		GHBARM
O=[N+]([O-])c1cccc(CSC2=Nc3ccc(Cl)cc3S(=O)(=O)[N-]2)c1	ZINC000012361124	570391504	/nfs/dbraw/zinc/39/15/04/570391504.db2.gz	BYXVYGGBKSOJHS-UHFFFAOYSA-N	-1	0	383.838	3.652	50	5		GHBARM
O=c1[nH]c(Sc2cc(Cl)c3nsnc3c2[N+](=O)[O-])nc2ccccc12	ZINC000005129394	570420490	/nfs/dbraw/zinc/42/04/90/570420490.db2.gz	DNUZZOSVQJYDRB-UHFFFAOYSA-N	-1	0	391.821	3.641	50	5		GHBARM
Cc1nc(-c2ccc(CCNC(=O)c3ccc([N+](=O)[O-])c([O-])c3)s2)cs1	ZINC000012397194	570646643	/nfs/dbraw/zinc/64/66/43/570646643.db2.gz	RJYPAPZKNLOQKI-UHFFFAOYSA-N	-1	0	389.458	3.766	50	5		GHBARM
COc1cc(/C=C2\SC(=O)N(Cc3ccccc3)C2=O)cc([N+](=O)[O-])c1[O-]	ZINC000015010527	210142267	/nfs/dbraw/zinc/14/22/67/210142267.db2.gz	RXORRPNCAVWLFE-DHDCSXOGSA-N	-1	0	386.385	3.546	50	5		GHBARM
COc1cc(/C=C/c2nc3ccc([N+](=O)[O-])cc3s2)ccc1OCC(=O)[O-]	ZINC000006862923	209698397	/nfs/dbraw/zinc/69/83/97/209698397.db2.gz	NIIINIMYTDLHPJ-XVNBXDOJSA-N	-1	0	386.385	3.847	50	5		GHBARM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1ccc(OCc2ccccc2)cc1	ZINC000001230816	209316668	/nfs/dbraw/zinc/31/66/68/209316668.db2.gz	KJBLJLIDRXSYLK-UHFFFAOYSA-N	-1	0	384.413	3.975	50	5		GHBARM
CCc1ccc(C=Cc2nc(=O)c3c(C)c(C(=O)[O-])sc3[nH]2)cc1[N+](=O)[O-]	ZINC000033502351	209192109	/nfs/dbraw/zinc/19/21/09/209192109.db2.gz	DHBLXNMIPWYEOH-ALCCZGGFSA-N	-1	0	385.401	3.632	50	5		GHBARM
O=C(Nc1ccc2nc(N3CCCC3)sc2c1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000035262627	210675995	/nfs/dbraw/zinc/67/59/95/210675995.db2.gz	GXOFJHFSZDLLJM-UHFFFAOYSA-N	-1	0	384.417	3.763	50	5		GHBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2nc(-c3ccc(Cl)cc3)cs2)cc1	ZINC000001514692	209331866	/nfs/dbraw/zinc/33/18/66/209331866.db2.gz	HQBBAWXZEPXPMX-UHFFFAOYSA-N	-1	0	395.849	3.594	50	5		GHBARM
O=[N+]([O-])c1ccc([N-]S(=O)(=O)c2cccc(F)c2F)cc1C(F)(F)F	ZINC000095457188	211242363	/nfs/dbraw/zinc/24/23/63/211242363.db2.gz	UXGRAOPSUBPAQH-UHFFFAOYSA-N	-1	0	382.266	3.693	50	5		GHBARM
COc1ccc(S(=O)(=O)Nc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-]	ZINC000004993657	570391052	/nfs/dbraw/zinc/39/10/52/570391052.db2.gz	VMUJYIQJCSSYNZ-UHFFFAOYSA-N	-1	0	377.205	3.711	50	5		GHBARM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2ccc(Br)c(Cl)c2)c1	ZINC000005027810	570730753	/nfs/dbraw/zinc/73/07/53/570730753.db2.gz	MATYCMOMWNELTK-UHFFFAOYSA-N	-1	0	391.630	3.812	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(Cl)cc1	ZINC000004653249	570806611	/nfs/dbraw/zinc/80/66/11/570806611.db2.gz	WICWWQJORHNLFZ-CYBMUJFWSA-N	-1	0	383.187	3.847	50	5		GHBARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000002737115	209381648	/nfs/dbraw/zinc/38/16/48/209381648.db2.gz	PISKCPPVSBLPFQ-CHWSQXEVSA-N	-1	0	375.406	3.548	50	5		GHBARM
COc1ccccc1-c1cc(C(=O)[O-])c2c(n[nH]c2-c2cccc([N+](=O)[O-])c2)n1	ZINC000020492252	210342110	/nfs/dbraw/zinc/34/21/10/210342110.db2.gz	HDUZWJFDVZIJKT-UHFFFAOYSA-N	-1	0	390.355	3.907	50	5		GHBARM
CCc1ccc(C=Cc2nc(=O)c3c(C)c(C(=O)[O-])sc3[nH]2)cc1[N+](=O)[O-]	ZINC000006510287	570462465	/nfs/dbraw/zinc/46/24/65/570462465.db2.gz	DHBLXNMIPWYEOH-FNORWQNLSA-N	-1	0	385.401	3.632	50	5		GHBARM
Cc1ccc(-c2nnc([N-]C(=O)c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])s2)cc1	ZINC000003073321	862170880	/nfs/dbraw/zinc/17/08/80/862170880.db2.gz	TVBGFRGBRMFGRW-UHFFFAOYSA-N	-1	0	385.361	3.582	50	5		GHBARM
O=C1[N-]C(=O)/C(=C\c2c(OCc3ccc([N+](=O)[O-])cc3)ccc3ccccc32)N1	ZINC000001145533	209307147	/nfs/dbraw/zinc/30/71/47/209307147.db2.gz	LYYARUSSGPOJJK-WOJGMQOQSA-N	-1	0	389.367	3.507	50	5		GHBARM
Cc1nc(-c2ccc(CNC(=O)c3ccc([N+](=O)[O-])c([O-])c3)s2)cs1	ZINC000036448824	570709915	/nfs/dbraw/zinc/70/99/15/570709915.db2.gz	ZWUKHYBNCHCUDA-UHFFFAOYSA-N	-1	0	375.431	3.724	50	5		GHBARM
COc1cc2ccccc2cc1C(=O)NC(=S)Nc1ccccc1[N+](=O)[O-]	ZINC000004754651	570963564	/nfs/dbraw/zinc/96/35/64/570963564.db2.gz	VNEFANRCHHWAAD-UHFFFAOYSA-N	-1	0	381.413	3.883	50	5		GHBARM
O=C1[N-]C(=O)/C(=C\c2ccc(Oc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2)N1	ZINC000016156294	210185093	/nfs/dbraw/zinc/18/50/93/210185093.db2.gz	AUOQHMSUGZAJLS-KPKJPENVSA-N	-1	0	393.277	3.586	50	5		GHBARM
O=C([O-])c1ccc(Cl)cc1NC(=O)CSCc1ccc([N+](=O)[O-])cc1	ZINC000004828762	209531352	/nfs/dbraw/zinc/53/13/52/209531352.db2.gz	XXQIYHWRDBBXSD-UHFFFAOYSA-N	-1	0	380.809	3.818	50	5		GHBARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CCCC2)[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000002580686	209370289	/nfs/dbraw/zinc/37/02/89/209370289.db2.gz	LOGQLWSGZYINEY-OALUTQOASA-N	-1	0	380.400	3.903	50	5		GHBARM
O=C([O-])c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Nc1cccc(Br)c1	ZINC000004719229	570859189	/nfs/dbraw/zinc/85/91/89/570859189.db2.gz	RDXJAHMAAUPHGM-UHFFFAOYSA-N	-1	0	382.126	3.707	50	5		GHBARM
Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2N2CCCC2)cc1[N+](=O)[O-]	ZINC000014086828	210101159	/nfs/dbraw/zinc/10/11/59/210101159.db2.gz	YPBKWANADDXIMT-UHFFFAOYSA-N	-1	0	395.868	3.958	50	5		GHBARM
CCN1c2ccc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)c3cccc(c23)C1=O	ZINC000000754538	209263586	/nfs/dbraw/zinc/26/35/86/209263586.db2.gz	WATLXAJONUUEKG-UHFFFAOYSA-N	-1	0	397.412	3.529	50	5		GHBARM
O=[N+]([O-])c1cc(F)c(S(=O)(=O)[N-]c2cccc3cccnc32)cc1Cl	ZINC000328600507	209144791	/nfs/dbraw/zinc/14/47/91/209144791.db2.gz	XZZQLGRKFANTJM-UHFFFAOYSA-N	-1	0	381.772	3.736	50	5		GHBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3cccc(C(F)(F)F)c3)[n+]2[O-])cc1F	ZINC000004927564	570370837	/nfs/dbraw/zinc/37/08/37/570370837.db2.gz	VENJJRJKTWHQQO-UHFFFAOYSA-N	-1	0	397.288	3.624	50	5		GHBARM
O=C([O-])c1ccc(CN2C(=O)S/C(=C/c3ccccc3[N+](=O)[O-])C2=O)cc1	ZINC000097998575	570908646	/nfs/dbraw/zinc/90/86/46/570908646.db2.gz	RIMRLBJDHXLMTN-OQLLNIDSSA-N	-1	0	384.369	3.530	50	5		GHBARM
O=C(c1cccc([N+](=O)[O-])c1)N1NC(C2CCCCC2)=C[C@@]1(O)C(F)(F)F	ZINC000004163629	570968047	/nfs/dbraw/zinc/96/80/47/570968047.db2.gz	FNSPRIDGSYIFLI-MRXNPFEDSA-N	-1	0	385.342	3.628	50	5		GHBARM
O=C([O-])c1cc(-c2cccc([N+](=O)[O-])c2)nc2c1cnn2-c1ccccc1F	ZINC000012396049	209949229	/nfs/dbraw/zinc/94/92/29/209949229.db2.gz	YHZWQOBWGRVDBV-UHFFFAOYSA-N	-1	0	378.319	3.833	50	5		GHBARM
Cc1nc2ccc([N-]S(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2s1	ZINC000006328885	211626378	/nfs/dbraw/zinc/62/63/78/211626378.db2.gz	DEAOZJUECVDQKU-UHFFFAOYSA-N	-1	0	383.838	3.967	50	5		GHBARM
Cc1nc2ccc([N-]S(=O)(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2s1	ZINC000008036106	221024796	/nfs/dbraw/zinc/02/47/96/221024796.db2.gz	OKMPZNIJKXIJTH-UHFFFAOYSA-N	-1	0	383.838	3.967	50	5		GHBARM
CC(C)Sc1ccc(Cc2nnc([N-]C(=O)c3ccc([N+](=O)[O-])o3)o2)cc1	ZINC000036660489	570783146	/nfs/dbraw/zinc/78/31/46/570783146.db2.gz	RYKFPQVZOXVHTQ-UHFFFAOYSA-N	-1	0	388.405	3.914	50	5		GHBARM
Cc1ccc(Cl)cc1[N-]c1c([N+](=O)[O-])nn(-c2ccc(Cl)cc2)[n+]1[O-]	ZINC000004922972	570370234	/nfs/dbraw/zinc/37/02/34/570370234.db2.gz	XINGPGUROJXKLL-UHFFFAOYSA-N	-1	0	380.191	3.773	50	5		GHBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(-c3ccccc3C(F)(F)F)o2)[nH]1	ZINC000032687753	570735788	/nfs/dbraw/zinc/73/57/88/570735788.db2.gz	RIVPIDALPSUTDB-ALCCZGGFSA-N	-1	0	393.277	3.833	50	5		GHBARM
CCOc1cc(-c2nc(=O)c3c4c(sc3[nH]2)CCCC4)cc([N+](=O)[O-])c1[O-]	ZINC000015009128	210142305	/nfs/dbraw/zinc/14/23/05/210142305.db2.gz	RWZGMQXFAWJQMY-UHFFFAOYSA-N	-1	0	387.417	3.543	50	5		GHBARM
Cc1nc(-c2cccc([N-]S(=O)(=O)c3cccc([N+](=O)[O-])c3)c2)cs1	ZINC000004353997	570691522	/nfs/dbraw/zinc/69/15/22/570691522.db2.gz	QAPCUZXWAQHEGK-UHFFFAOYSA-N	-1	0	375.431	3.828	50	5		GHBARM
CCc1cc(Br)ccc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000013948524	570883839	/nfs/dbraw/zinc/88/38/39/570883839.db2.gz	LINPGAXWGWZVRN-UHFFFAOYSA-N	-1	0	385.239	3.721	50	5		GHBARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000002737116	209381236	/nfs/dbraw/zinc/38/12/36/209381236.db2.gz	PISKCPPVSBLPFQ-STQMWFEESA-N	-1	0	375.406	3.548	50	5		GHBARM
Cc1c(C(=O)Nc2ccc(Br)cc2C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000000705652	209261129	/nfs/dbraw/zinc/26/11/29/209261129.db2.gz	JHGPLOLPOAWMEH-UHFFFAOYSA-N	-1	0	379.166	3.616	50	5		GHBARM
CCC[C@H](C)N1Cc2cccc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2C1	ZINC000096013475	211294562	/nfs/dbraw/zinc/29/45/62/211294562.db2.gz	PNDALAKVAGWHOZ-AWEZNQCLSA-N	-1	0	389.477	3.900	50	5		GHBARM
Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(Br)c([N+](=O)[O-])c1	ZINC000089651296	211182411	/nfs/dbraw/zinc/18/24/11/211182411.db2.gz	HVSIMHBHBDJXJQ-UHFFFAOYSA-N	-1	0	389.202	3.606	50	5		GHBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])c(Cl)c1	ZINC000004922573	570370293	/nfs/dbraw/zinc/37/02/93/570370293.db2.gz	RXALKSNQMHIWDN-UHFFFAOYSA-N	-1	0	380.191	3.773	50	5		GHBARM
Cc1cc([N-]c2ccc(N3C(=O)[C@@H]4CC[C@H](C)C[C@H]4C3=O)cc2[N+](=O)[O-])on1	ZINC000230093699	862120736	/nfs/dbraw/zinc/12/07/36/862120736.db2.gz	ZJGNAEMHSFXWFH-ZLKJLUDKSA-N	-1	0	384.392	3.560	50	5		GHBARM
CCNc1cc(C(=O)c2ccccc2[O-])cn2c(=O)c3ccc(Cl)cc3nc12	ZINC000003426172	862400244	/nfs/dbraw/zinc/40/02/44/862400244.db2.gz	KIAWYLGBPFFHHS-UHFFFAOYSA-N	-1	0	393.830	3.870	50	5		GHBARM
Cc1nn(-c2ccccc2)c(C)c1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000008777960	856360658	/nfs/dbraw/zinc/36/06/58/856360658.db2.gz	IVGBDSCSNRCNBL-UHFFFAOYSA-N	-1	0	386.433	3.507	50	5		GHBARM
O=[N+]([O-])c1c(Br)cc(Br)c([O-])c1Br	ZINC000001605487	209334084	/nfs/dbraw/zinc/33/40/84/209334084.db2.gz	IFNFSKQWRJSFRI-UHFFFAOYSA-N	-1	0	375.798	3.588	50	5		GHBARM
COc1ccc(Br)cc1/C=C\c1ncc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000096893585	209241833	/nfs/dbraw/zinc/24/18/33/209241833.db2.gz	QGUUGWVMBSZPFU-RQOWECAXSA-N	-1	0	379.166	3.630	50	5		GHBARM
O=C([O-])c1cc(Br)ccc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000005165801	211624090	/nfs/dbraw/zinc/62/40/90/211624090.db2.gz	ATOWQPNDPZCGBY-UHFFFAOYSA-N	-1	0	399.584	3.961	50	5		GHBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])cc1Cl	ZINC000004923756	570370250	/nfs/dbraw/zinc/37/02/50/570370250.db2.gz	AWQUNOLKEOOQNU-UHFFFAOYSA-N	-1	0	380.191	3.773	50	5		GHBARM
CCn1ncc2ccc([N-]S(=O)(=O)c3cc([N+](=O)[O-])cc(Cl)c3F)cc21	ZINC000225554256	861182110	/nfs/dbraw/zinc/18/21/10/861182110.db2.gz	USIYRSCNUKWIJB-UHFFFAOYSA-N	-1	0	398.803	3.558	50	5		GHBARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000002737114	209380778	/nfs/dbraw/zinc/38/07/78/209380778.db2.gz	PISKCPPVSBLPFQ-QWHCGFSZSA-N	-1	0	375.406	3.548	50	5		GHBARM
O=c1nc2n(-c3cccc(C(F)(F)F)c3)c3cc(Cl)ccc3cc-2c(=O)[n-]1	ZINC000002254158	209352938	/nfs/dbraw/zinc/35/29/38/209352938.db2.gz	YOQRPOSJGRGMMK-UHFFFAOYSA-N	-1	0	391.736	3.851	50	5		GHBARM
O=C([O-])CCCC(=O)N1N=C(c2ccccc2)C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000000907721	209278304	/nfs/dbraw/zinc/27/83/04/209278304.db2.gz	KVTYHYDIPOCBEI-GOSISDBHSA-N	-1	0	381.388	3.527	50	5		GHBARM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1ccc(Br)c(Cl)c1	ZINC000006083653	570238513	/nfs/dbraw/zinc/23/85/13/570238513.db2.gz	FKPGNGJPLSLEQP-UHFFFAOYSA-N	-1	0	391.630	3.812	50	5		GHBARM
O=C(c1cnn(-c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1)c1ccccc1[O-]	ZINC000035684411	570414010	/nfs/dbraw/zinc/41/40/10/570414010.db2.gz	KQGVENSRINGFHK-UHFFFAOYSA-N	-1	0	377.278	3.736	50	5		GHBARM
O=C([O-])c1cnn(-c2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1C(F)(F)F	ZINC000004014459	862714850	/nfs/dbraw/zinc/71/48/50/862714850.db2.gz	IGDMGZSQPCSPBR-UHFFFAOYSA-N	-1	0	384.295	3.621	50	5		GHBARM
CC(C)(C)c1nc2cc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc2o1	ZINC000032097444	862810937	/nfs/dbraw/zinc/81/09/37/862810937.db2.gz	QTIVGGNMWLKRKO-UHFFFAOYSA-N	-1	0	375.406	3.834	50	5		GHBARM
CCN1c2ccc([N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])c3cccc(c23)C1=O	ZINC000000754473	209263324	/nfs/dbraw/zinc/26/33/24/209263324.db2.gz	NOKOBHQXTDNZFM-UHFFFAOYSA-N	-1	0	397.412	3.529	50	5		GHBARM
Cc1ccc(C(=O)[O-])cc1N1C(=O)c2cccc3c([N+](=O)[O-])ccc(c32)C1=O	ZINC000000822796	526233925	/nfs/dbraw/zinc/23/39/25/526233925.db2.gz	YDBMUMGYEAEOKL-UHFFFAOYSA-N	-1	0	376.324	3.555	50	5		GHBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ccc(-c3cn4ccccc4n3)cc2)cc1	ZINC000004806013	570996235	/nfs/dbraw/zinc/99/62/35/570996235.db2.gz	DNNIFVYYFCNFFG-UHFFFAOYSA-N	-1	0	394.412	3.710	50	5		GHBARM
Cc1ccc(S(=O)(=O)[N-]c2c3ccccc3c([N+](=O)[O-])cc2[N+](=O)[O-])cc1	ZINC000004558436	209497340	/nfs/dbraw/zinc/49/73/40/209497340.db2.gz	JSEQBQKZIDGOBK-UHFFFAOYSA-N	-1	0	387.373	3.765	50	5		GHBARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CCCC2)[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000003883491	209456740	/nfs/dbraw/zinc/45/67/40/209456740.db2.gz	LOGQLWSGZYINEY-MOPGFXCFSA-N	-1	0	380.400	3.903	50	5		GHBARM
COc1cccc(-c2cc(C(=O)[O-])c3c(n[nH]c3-c3ccc([N+](=O)[O-])cc3)n2)c1	ZINC000020904213	210369090	/nfs/dbraw/zinc/36/90/90/210369090.db2.gz	XGTYUCMWKHHEFH-UHFFFAOYSA-N	-1	0	390.355	3.907	50	5		GHBARM
CCOC(=O)NC([N-]c1ccc([N+](=O)[O-])cc1)(C(F)(F)F)C(F)(F)F	ZINC000003878816	862621427	/nfs/dbraw/zinc/62/14/27/862621427.db2.gz	ANVKUTZUSCJLKL-UHFFFAOYSA-N	-1	0	375.225	3.574	50	5		GHBARM
O=[N+]([O-])c1cc(Cl)c(Cl)c(S(=O)(=O)[N-]c2ccc3c(c2)CCO3)c1	ZINC000253405926	915960882	/nfs/dbraw/zinc/96/08/82/915960882.db2.gz	UCCKCRSVJOMVIS-UHFFFAOYSA-N	-1	0	389.216	3.637	50	5		GHBARM
O=c1nc2n(-c3cccc(C(F)(F)F)c3)c3cccc(Cl)c3cc-2c(=O)[n-]1	ZINC000002247998	209352682	/nfs/dbraw/zinc/35/26/82/209352682.db2.gz	ZNTNBDDCMOLBOO-UHFFFAOYSA-N	-1	0	391.736	3.851	50	5		GHBARM
CC(C)CCn1c2ccccc2c([O-])c(C(=O)Nc2ccc([N+](=O)[O-])cc2)c1=O	ZINC000100461435	211385877	/nfs/dbraw/zinc/38/58/77/211385877.db2.gz	DBGPBVWTXQBVHK-UHFFFAOYSA-N	-1	0	395.415	3.914	50	5		GHBARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000004828565	570284265	/nfs/dbraw/zinc/28/42/65/570284265.db2.gz	NLMOENVMGPSTBJ-UHFFFAOYSA-N	-1	0	377.205	3.711	50	5		GHBARM
O=c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)[n-]c2ccsc21	ZINC000005643658	570679180	/nfs/dbraw/zinc/67/91/80/570679180.db2.gz	RMSHZWCYDRQYBW-UHFFFAOYSA-N	-1	0	376.444	3.795	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1Cl	ZINC000004717969	570856520	/nfs/dbraw/zinc/85/65/20/570856520.db2.gz	SVASWLVOGPBBHE-CQSZACIVSA-N	-1	0	383.187	3.847	50	5		GHBARM
CC(=O)Nc1c2ccccc2c([N-]S(=O)(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000004148315	570964842	/nfs/dbraw/zinc/96/48/42/570964842.db2.gz	CQRSKOUWGCUMBJ-UHFFFAOYSA-N	-1	0	385.401	3.507	50	5		GHBARM
O=C([O-])/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(Cl)cc1Cl	ZINC000001200855	209312842	/nfs/dbraw/zinc/31/28/42/209312842.db2.gz	UTNYSGFYUYYADJ-VGOFMYFVSA-N	-1	0	381.171	3.757	50	5		GHBARM
Cc1nccn1-c1c(Cl)cccc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000328594080	209145281	/nfs/dbraw/zinc/14/52/81/209145281.db2.gz	OAHHBDHLDBPYLL-UHFFFAOYSA-N	-1	0	392.824	3.543	50	5		GHBARM
CCC[C@@H](C)N1Cc2cccc([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2C1	ZINC000096013474	211294343	/nfs/dbraw/zinc/29/43/43/211294343.db2.gz	PNDALAKVAGWHOZ-CQSZACIVSA-N	-1	0	389.477	3.900	50	5		GHBARM
Cc1noc([N-]C(=O)c2c(C)onc2-c2c(F)cccc2Cl)c1[N+](=O)[O-]	ZINC000004350255	570676014	/nfs/dbraw/zinc/67/60/14/570676014.db2.gz	SWBVJZOOBJJAOI-UHFFFAOYSA-N	-1	0	380.719	3.899	50	5		GHBARM
COc1cc(/C=C/c2ccc3cccc([N+](=O)[O-])c3n2)ccc1OCC(=O)[O-]	ZINC000005636854	570677899	/nfs/dbraw/zinc/67/78/99/570677899.db2.gz	PTOFYNLLKNLRKG-VMPITWQZSA-N	-1	0	380.356	3.785	50	5		GHBARM
Cc1ccccc1NC(=O)C[C@H]([N-]C(=O)C(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000006997419	570732966	/nfs/dbraw/zinc/73/29/66/570732966.db2.gz	NFSDUJHQBKROQN-HNNXBMFYSA-N	-1	0	395.337	3.652	50	5		GHBARM
O=C([O-])C(=Cc1ccc([N+](=O)[O-])cc1)Sc1nnc2c(n1)[nH]c1ccccc12	ZINC000020814217	860648625	/nfs/dbraw/zinc/64/86/25/860648625.db2.gz	SLMUCHIREKLOJR-ZROIWOOFSA-N	-1	0	393.384	3.632	50	5		GHBARM
O=C([O-])c1ccc2c(=O)n3c(nc2c1)/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)CC3	ZINC000033497235	212159596	/nfs/dbraw/zinc/15/95/96/212159596.db2.gz	NPMCGXHCFGTNNO-XFFZJAGNSA-N	-1	0	397.774	3.601	50	5		GHBARM
COc1cc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)ccc1OCC(=O)[O-]	ZINC000033496960	212117199	/nfs/dbraw/zinc/11/71/99/212117199.db2.gz	PTOFYNLLKNLRKG-YVMONPNESA-N	-1	0	380.356	3.785	50	5		GHBARM
Cc1ccc([N-]c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])cc1Cl	ZINC000004923114	220792891	/nfs/dbraw/zinc/79/28/91/220792891.db2.gz	YISFFFWYJPWJPO-UHFFFAOYSA-N	-1	0	380.191	3.773	50	5		GHBARM
Cc1nn(-c2ccc(C)cc2)c(C)c1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000012536172	221203827	/nfs/dbraw/zinc/20/38/27/221203827.db2.gz	HISXFQSQEGQCGL-UHFFFAOYSA-N	-1	0	386.433	3.507	50	5		GHBARM
Cc1cc([N+](=O)[O-])c(Cl)cc1[N-]S(=O)(=O)c1ccc2c(c1)N(C)CCC2	ZINC000097376405	136188427	/nfs/dbraw/zinc/18/84/27/136188427.db2.gz	OTEHZEVJRLAQNT-UHFFFAOYSA-N	-1	0	395.868	3.740	50	5		GHBARM
CC(=O)Nc1cc([N+](=O)[O-])c([N-]S(=O)(=O)c2ccccc2)c2ccccc12	ZINC000004526660	570841064	/nfs/dbraw/zinc/84/10/64/570841064.db2.gz	DPMOCQDIQBGLBA-UHFFFAOYSA-N	-1	0	385.401	3.507	50	5		GHBARM
COC(=O)c1c([N-]c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])sc2c1CCCC2	ZINC000004797801	570991514	/nfs/dbraw/zinc/99/15/14/570991514.db2.gz	QSRAYAPSWKVQLO-UHFFFAOYSA-N	-1	0	377.378	3.974	50	5		GHBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2cccc(-c3nc4ccccc4[nH]3)c2)cc1	ZINC000001304041	212233925	/nfs/dbraw/zinc/23/39/25/212233925.db2.gz	NRTKHARBQLZWNT-UHFFFAOYSA-N	-1	0	394.412	3.939	50	5		GHBARM
O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CCC[C@@H](c2nc3ccccc3s2)C1	ZINC000012989366	221252945	/nfs/dbraw/zinc/25/29/45/221252945.db2.gz	ZEWNFSSCIOYPIZ-CYBMUJFWSA-N	-1	0	383.429	3.930	50	5		GHBARM
O=c1[nH]c(C=Cc2ccccc2OCc2ccccc2Cl)nc([O-])c1[N+](=O)[O-]	ZINC000016361513	221360152	/nfs/dbraw/zinc/36/01/52/221360152.db2.gz	OMYRRGHOXRZUGQ-KTKRTIGZSA-N	-1	0	399.790	3.787	50	5		GHBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ccc(Br)c(Cl)c2)cc1	ZINC000001111067	570753944	/nfs/dbraw/zinc/75/39/44/570753944.db2.gz	IXGHLBRSNGDFEG-UHFFFAOYSA-N	-1	0	391.630	3.812	50	5		GHBARM
O=C([O-])c1ccc(/C=C2\SC(=O)N(Cc3ccccc3[N+](=O)[O-])C2=O)cc1	ZINC000004691134	570840034	/nfs/dbraw/zinc/84/00/34/570840034.db2.gz	LUPJWSFAWRWZMN-DHDCSXOGSA-N	-1	0	384.369	3.530	50	5		GHBARM
COc1cc(/C=C2/CCn3c2nc2sc(C)c(C)c2c3=O)cc([N+](=O)[O-])c1[O-]	ZINC000069842989	222174293	/nfs/dbraw/zinc/17/42/93/222174293.db2.gz	FEIIWYXWRISMCA-SDQBBNPISA-N	-1	0	399.428	3.642	50	5		GHBARM
O=C([O-])c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Nc1ccccc1Br	ZINC000071195819	222178667	/nfs/dbraw/zinc/17/86/67/222178667.db2.gz	GEIGNXBPVGTFNW-UHFFFAOYSA-N	-1	0	382.126	3.707	50	5		GHBARM
O=C([O-])c1c(F)c(F)c(SCC(=O)c2cccc([N+](=O)[O-])c2)c(F)c1F	ZINC000004300617	570217945	/nfs/dbraw/zinc/21/79/45/570217945.db2.gz	LVYGONAUOFBCRI-UHFFFAOYSA-N	-1	0	389.282	3.824	50	5		GHBARM
Cc1c(Cl)cccc1[N-]c1c([N+](=O)[O-])nn(-c2cccc(Cl)c2)[n+]1[O-]	ZINC000004923749	570370022	/nfs/dbraw/zinc/37/00/22/570370022.db2.gz	BZJQUCREMTYTNT-UHFFFAOYSA-N	-1	0	380.191	3.773	50	5		GHBARM
CCOC(=O)c1cnc(/C=C\c2ccc(Cl)c([N+](=O)[O-])c2)c(C(=O)[O-])c1	ZINC000222079053	901575479	/nfs/dbraw/zinc/57/54/79/901575479.db2.gz	PLPUAWMWVFVLKS-XQRVVYSFSA-N	-1	0	376.752	3.689	50	5		GHBARM
COc1cccc2cc(-c3nnc([N-]C(=O)c4ccc([N+](=O)[O-])s4)o3)oc21	ZINC000009166805	212164175	/nfs/dbraw/zinc/16/41/75/212164175.db2.gz	AMDJKHCHSAMIOY-UHFFFAOYSA-N	-1	0	386.345	3.713	50	5		GHBARM
O=C([O-])c1cccc(CN2C(=O)S/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)c1	ZINC000002328492	220523675	/nfs/dbraw/zinc/52/36/75/220523675.db2.gz	CKVJBQJWIBGJNO-DHDCSXOGSA-N	-1	0	384.369	3.530	50	5		GHBARM
O=C([O-])[C@H]1CS[C@H](c2ccccc2Cl)N1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000004177947	220689928	/nfs/dbraw/zinc/68/99/28/220689928.db2.gz	VTTWMSWWFLOKML-GDBMZVCRSA-N	-1	0	392.820	3.589	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)c1c(Cl)cccc1Cl)c1cccc([N+](=O)[O-])c1	ZINC000004602036	570656166	/nfs/dbraw/zinc/65/61/66/570656166.db2.gz	IRRIXZZRBRMQMX-ZDUSSCGKSA-N	-1	0	383.187	3.847	50	5		GHBARM
COc1cc(/C=C2/C(=O)Nc3ccc(Br)cc32)cc([N+](=O)[O-])c1[O-]	ZINC000096551505	570758570	/nfs/dbraw/zinc/75/85/70/570758570.db2.gz	LBWNPEJGCUOVKK-NYYWCZLTSA-N	-1	0	391.177	3.564	50	5		GHBARM
COc1cc(/C=C/c2ccc3c(cccc3[N+](=O)[O-])n2)ccc1OCC(=O)[O-]	ZINC000005935916	570805809	/nfs/dbraw/zinc/80/58/09/570805809.db2.gz	LWTHWWUDJAWPEX-FNORWQNLSA-N	-1	0	380.356	3.785	50	5		GHBARM
O=C([O-])CCC(=O)Nc1nc(-c2cc3c(ccc4ccccc43)oc2=O)cs1	ZINC000001127256	918451217	/nfs/dbraw/zinc/45/12/17/918451217.db2.gz	KVJUYOYKECRTEH-UHFFFAOYSA-N	-1	0	394.408	3.873	50	5		GHBARM
O=C([O-])c1ccc2c(c1)C(=O)N(c1ccc(-c3ccc([N+](=O)[O-])cc3)cc1)C2=O	ZINC000001085701	212215379	/nfs/dbraw/zinc/21/53/79/212215379.db2.gz	CDKNSBNMWSWACR-UHFFFAOYSA-N	-1	0	388.335	3.761	50	5		GHBARM
O=C1CCCc2oc3ccc([N-]S(=O)(=O)c4cccc([N+](=O)[O-])c4)cc3c21	ZINC000005009356	220809590	/nfs/dbraw/zinc/80/95/90/220809590.db2.gz	CHXXPNNPICZRSU-UHFFFAOYSA-N	-1	0	386.385	3.661	50	5		GHBARM
CCNc1cc(C(=O)c2cc(Cl)ccc2[O-])cn2c(=O)c3ccccc3nc12	ZINC000009578689	221085917	/nfs/dbraw/zinc/08/59/17/221085917.db2.gz	WWMCBDTZRXUJOI-UHFFFAOYSA-N	-1	0	393.830	3.870	50	5		GHBARM
Cc1csc(Nc2cccc([N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])c2)n1	ZINC000048312124	570233873	/nfs/dbraw/zinc/23/38/73/570233873.db2.gz	RTTJEOVWLVKICO-UHFFFAOYSA-N	-1	0	390.446	3.904	50	5		GHBARM
Cc1c(NC(=O)Cc2c3cc(Cl)ccc3[nH]c2C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000004920625	570370203	/nfs/dbraw/zinc/37/02/03/570370203.db2.gz	XFIRUFICMTZWKS-UHFFFAOYSA-N	-1	0	387.779	3.917	50	5		GHBARM
CCCCn1c2ccccc2c([O-])c(C(=O)Nc2ccc([N+](=O)[O-])cc2)c1=O	ZINC000100502082	570373858	/nfs/dbraw/zinc/37/38/58/570373858.db2.gz	NEKOZJDHDBCNHH-UHFFFAOYSA-N	-1	0	381.388	3.668	50	5		GHBARM
O=[N+]([O-])c1ccc(CSC2=Nc3ccc(Cl)cc3S(=O)(=O)[N-]2)cc1	ZINC000012361110	570391495	/nfs/dbraw/zinc/39/14/95/570391495.db2.gz	WTSHWJNGMACDAY-UHFFFAOYSA-N	-1	0	383.838	3.652	50	5		GHBARM
Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c1	ZINC000058343842	222051022	/nfs/dbraw/zinc/05/10/22/222051022.db2.gz	QKQHYUCEZVWPRY-UHFFFAOYSA-N	-1	0	385.239	3.775	50	5		GHBARM
O=[N+]([O-])c1cc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)ccc1[O-]	ZINC000004980402	570385899	/nfs/dbraw/zinc/38/58/99/570385899.db2.gz	CIQHZJDCXUEBPZ-UHFFFAOYSA-N	-1	0	381.354	3.641	50	5		GHBARM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2nc(-c3ccc(Cl)cc3)cs2)c1	ZINC000005582775	570661034	/nfs/dbraw/zinc/66/10/34/570661034.db2.gz	SLPKSULAAAEETP-UHFFFAOYSA-N	-1	0	395.849	3.594	50	5		GHBARM
COc1ccc(/C=C/c2nc(C(=O)[O-])c(Br)s2)cc1[N+](=O)[O-]	ZINC000253426226	915994887	/nfs/dbraw/zinc/99/48/87/915994887.db2.gz	QWBLJYOWUMOEPW-HWKANZROSA-N	-1	0	385.195	3.691	50	5		GHBARM
Cc1ccc(-c2ccc(CCC(=O)[O-])n2NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000001138323	212222321	/nfs/dbraw/zinc/22/23/21/212222321.db2.gz	SPZORXFAJQZABQ-UHFFFAOYSA-N	-1	0	393.399	3.773	50	5		GHBARM
O=C1C[C@H](Sc2ccc(Cl)cc2)C([O-])=C1Nc1ccccc1[N+](=O)[O-]	ZINC000006995836	220981926	/nfs/dbraw/zinc/98/19/26/220981926.db2.gz	PWOIUWKQGPSXLO-JKSUJKDBSA-N	-1	0	376.821	3.732	50	5		GHBARM
Cc1sc(NC(=O)c2cccc([N+](=O)[O-])c2C(=O)[O-])nc1-c1ccccc1	ZINC000004426534	570760163	/nfs/dbraw/zinc/76/01/63/570760163.db2.gz	PEAORGRZJXVHQV-UHFFFAOYSA-N	-1	0	383.385	3.977	50	5		GHBARM
CCc1ccc(-c2csc([N-]S(=O)(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000008195496	221030879	/nfs/dbraw/zinc/03/08/79/221030879.db2.gz	HJUFINVVHZZSGC-UHFFFAOYSA-N	-1	0	389.458	3.503	50	5		GHBARM
C[C@H](SCc1nc2cc([N+](=O)[O-])ccc2n1-c1ccc(F)cc1)C(=O)[O-]	ZINC000025106696	221625596	/nfs/dbraw/zinc/62/55/96/221625596.db2.gz	NEQUIIHUSLAORW-JTQLQIEISA-N	-1	0	375.381	3.779	50	5		GHBARM
O=C([O-])c1ccc(CN2C(=O)S/C(=C\c3ccccc3[N+](=O)[O-])C2=O)cc1	ZINC000006590770	570488246	/nfs/dbraw/zinc/48/82/46/570488246.db2.gz	RIMRLBJDHXLMTN-DHDCSXOGSA-N	-1	0	384.369	3.530	50	5		GHBARM
Cc1cc(C)c(S(=O)(=O)[N-]c2nsc(-c3ccccc3)n2)cc1[N+](=O)[O-]	ZINC000170617353	570876467	/nfs/dbraw/zinc/87/64/67/570876467.db2.gz	YEDMXWULLSYOPY-UHFFFAOYSA-N	-1	0	390.446	3.531	50	5		GHBARM
COc1ccc(Br)cc1/C=C/c1ncc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000039983760	856615566	/nfs/dbraw/zinc/61/55/66/856615566.db2.gz	QGUUGWVMBSZPFU-DUXPYHPUSA-N	-1	0	379.166	3.630	50	5		GHBARM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000000854672	212190330	/nfs/dbraw/zinc/19/03/30/212190330.db2.gz	LVEDUOGXGSFLNW-UHFFFAOYSA-N	-1	0	377.205	3.711	50	5		GHBARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CCCC2)[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000003883493	570817420	/nfs/dbraw/zinc/81/74/20/570817420.db2.gz	LOGQLWSGZYINEY-RTBURBONSA-N	-1	0	380.400	3.903	50	5		GHBARM
COc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)c([N+](=O)[O-])c1	ZINC000003833299	862596103	/nfs/dbraw/zinc/59/61/03/862596103.db2.gz	FXTQTJZNACHXQK-UHFFFAOYSA-N	-1	0	377.205	3.711	50	5		GHBARM
CCOC(=O)NC([N-]c1ccccc1[N+](=O)[O-])(C(F)(F)F)C(F)(F)F	ZINC000003878815	862621360	/nfs/dbraw/zinc/62/13/60/862621360.db2.gz	OOVAZHKTNXTDBY-UHFFFAOYSA-N	-1	0	375.225	3.574	50	5		GHBARM
O=C(c1cnc2cc(-c3ccc(Cl)cc3)nn2c1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000013362330	221266781	/nfs/dbraw/zinc/26/67/81/221266781.db2.gz	YFTLJCSWWTWMRX-UHFFFAOYSA-N	-1	0	394.774	3.895	50	5		GHBARM
O=C1C[C@@H](Sc2ccc(Cl)cc2)C([O-])=C1Nc1ccccc1[N+](=O)[O-]	ZINC000006995840	570730739	/nfs/dbraw/zinc/73/07/39/570730739.db2.gz	PWOIUWKQGPSXLO-CVEARBPZSA-N	-1	0	376.821	3.732	50	5		GHBARM
O=C([N-]c1nnc(CCSc2ccccc2)o1)c1ccc([N+](=O)[O-])s1	ZINC000010690428	221106572	/nfs/dbraw/zinc/10/65/72/221106572.db2.gz	UEMVFJQJXHSCCS-UHFFFAOYSA-N	-1	0	376.419	3.626	50	5		GHBARM
Cc1nc(-c2ccc([N-]S(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cs1	ZINC000004949839	570379789	/nfs/dbraw/zinc/37/97/89/570379789.db2.gz	BYKANHGNZAQZCQ-UHFFFAOYSA-N	-1	0	375.431	3.828	50	5		GHBARM
O=C([O-])C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1cccc([N+](=O)[O-])c1	ZINC000004619073	570675505	/nfs/dbraw/zinc/67/55/05/570675505.db2.gz	CGOFMHUIODUDMT-CQSZACIVSA-N	-1	0	383.187	3.847	50	5		GHBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ccc(Br)cc2)cc1Cl	ZINC000003264010	862292135	/nfs/dbraw/zinc/29/21/35/862292135.db2.gz	OGSHWWUTIAUKLT-UHFFFAOYSA-N	-1	0	391.630	3.812	50	5		GHBARM
COc1ccc([N-]S(=O)(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)cc1Cl	ZINC000020491972	860587219	/nfs/dbraw/zinc/58/72/19/860587219.db2.gz	VDEVYJNUTOVGKR-UHFFFAOYSA-N	-1	0	381.797	3.539	50	5		GHBARM
COc1ccc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)cc2)c([N+](=O)[O-])c1	ZINC000028260744	900374677	/nfs/dbraw/zinc/37/46/77/900374677.db2.gz	DIJHIXXWRYQEBZ-UHFFFAOYSA-N	-1	0	392.433	3.726	50	5		GHBARM
COc1ccc(/C=C\c2nc(C(=O)[O-])c(Br)s2)cc1[N+](=O)[O-]	ZINC000486002681	1022388022	/nfs/dbraw/zinc/38/80/22/1022388022.db2.gz	QWBLJYOWUMOEPW-HYXAFXHYSA-N	-1	0	385.195	3.691	50	5		GHBARM
COc1cc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(Cl)cc1C(=O)[O-]	ZINC000000941238	212196515	/nfs/dbraw/zinc/19/65/15/212196515.db2.gz	QYNIYGPHQVQMBO-UHFFFAOYSA-N	-1	0	385.159	3.861	50	5		GHBARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CCCC2)[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000003883492	570817375	/nfs/dbraw/zinc/81/73/75/570817375.db2.gz	LOGQLWSGZYINEY-RBUKOAKNSA-N	-1	0	380.400	3.903	50	5		GHBARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000002737117	861551786	/nfs/dbraw/zinc/55/17/86/861551786.db2.gz	PISKCPPVSBLPFQ-OLZOCXBDSA-N	-1	0	375.406	3.548	50	5		GHBARM
Cc1cc(C)n(-c2ccccc2[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)n1	ZINC000032086636	862803295	/nfs/dbraw/zinc/80/32/95/862803295.db2.gz	BOBIKYFUKCDKAP-UHFFFAOYSA-N	-1	0	386.433	3.507	50	5		GHBARM
COc1cccc(-c2[nH]nc3nc(-c4cccc([N+](=O)[O-])c4)cc(C(=O)[O-])c32)c1	ZINC000020850109	860655798	/nfs/dbraw/zinc/65/57/98/860655798.db2.gz	OJKLWEOISVPPCX-UHFFFAOYSA-N	-1	0	390.355	3.907	50	5		GHBARM
O=[N+]([O-])c1ccc(Cl)c([N-]c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])c1	ZINC000104234953	212083380	/nfs/dbraw/zinc/08/33/80/212083380.db2.gz	OBUBYIZDFMOJDZ-UHFFFAOYSA-N	-1	0	383.660	3.716	50	5		GHBARM
CCOc1cc(C=Cc2[nH]c(=O)[n-]c(=O)c2[N+](=O)[O-])ccc1O[C@@H](C)CC	ZINC000013468246	221269583	/nfs/dbraw/zinc/26/95/83/221269583.db2.gz	DSADXIMEVUBUNH-JYKYSHPRSA-N	-1	0	375.381	3.542	50	5		GHBARM
O=C1S/C(=C\c2ccc([O-])c([N+](=O)[O-])c2)C(=O)N1CCCc1ccccc1	ZINC000037219702	570849779	/nfs/dbraw/zinc/84/97/79/570849779.db2.gz	DDEYFOUPZMMJET-ATVHPVEESA-N	-1	0	384.413	3.970	50	5		GHBARM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ccc(-c3nc4ccccc4[nH]3)cc2)cc1	ZINC000001140094	212221848	/nfs/dbraw/zinc/22/18/48/212221848.db2.gz	HOCZJXRSIXLPID-UHFFFAOYSA-N	-1	0	394.412	3.939	50	5		GHBARM
O=c1[n-]c(=O)c([N+](=O)[O-])c(C=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)[nH]1	ZINC000015009189	221325866	/nfs/dbraw/zinc/32/58/66/221325866.db2.gz	NEMDOYZLNBBOSV-GQCTYLIASA-N	-1	0	393.277	3.833	50	5		GHBARM
O=C([O-])C1CCN(c2nc3ccc([N+](=O)[O-])cc3c(-c3ccccc3)n2)CC1	ZINC000005775597	570378558	/nfs/dbraw/zinc/37/85/58/570378558.db2.gz	BDNDOTKDFFXORD-UHFFFAOYSA-N	-1	0	378.388	3.506	50	5		GHBARM
O=C([O-])C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1ccc(Cl)cc1	ZINC000004653263	570806725	/nfs/dbraw/zinc/80/67/25/570806725.db2.gz	LSYKWXKLQMNVEU-AWEZNQCLSA-N	-1	0	383.187	3.847	50	5		GHBARM
O=C([O-])c1cccc(Sc2cc3c(cc2[N+](=O)[O-])c(=O)nc2sccn23)c1	ZINC000004709768	570986710	/nfs/dbraw/zinc/98/67/10/570986710.db2.gz	VOJXHOBRXQVBPT-UHFFFAOYSA-N	-1	0	399.409	3.667	50	5		GHBARM
O=C([O-])[C@H]1CS[C@@H](c2ccccc2Cl)N1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000004177952	898211613	/nfs/dbraw/zinc/21/16/13/898211613.db2.gz	VTTWMSWWFLOKML-ZBFHGGJFSA-N	-1	0	392.820	3.589	50	5		GHBARM
CC(C)CNc1nnc(Sc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])s1	ZINC000096930541	915215009	/nfs/dbraw/zinc/21/50/09/915215009.db2.gz	BZLWHICOJUZACD-XQRVVYSFSA-N	-1	0	380.451	3.763	50	5		GHBARM
O=C([O-])C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1nc2ccccc2s1	ZINC000008937088	221064602	/nfs/dbraw/zinc/06/46/02/221064602.db2.gz	PCMRYWUJAUHQNU-VZUCSPMQSA-N	-1	0	384.369	3.949	50	5		GHBARM
O=C(Nc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2[O-])cc1)c1cccs1	ZINC000013843349	221292056	/nfs/dbraw/zinc/29/20/56/221292056.db2.gz	SZPUSUNROPUHJU-UHFFFAOYSA-N	-1	0	383.385	3.867	50	5		GHBARM
O=C(CSc1ccc(Br)cc1)Nc1ccc([N+](=O)[O-])cc1[O-]	ZINC000004869291	570350961	/nfs/dbraw/zinc/35/09/61/570350961.db2.gz	MVFNZLZIJMRZCF-UHFFFAOYSA-N	-1	0	383.223	3.794	50	5		GHBARM
Cc1cc(Br)ccc1NC(=O)c1c(C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000521398264	570457639	/nfs/dbraw/zinc/45/76/39/570457639.db2.gz	QPHAOLUUZXLJFJ-UHFFFAOYSA-N	-1	0	379.166	3.616	50	5		GHBARM
O=C([N-]c1nnc(-c2ccc(Br)cc2)o1)c1ccc([N+](=O)[O-])s1	ZINC000005169710	570491173	/nfs/dbraw/zinc/49/11/73/570491173.db2.gz	YAZHREMPRIXZLT-UHFFFAOYSA-N	-1	0	395.194	3.721	50	5		GHBARM