smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2ccc([O-])c(Br)c2)s1	ZINC000127271108	551339248	/nfs/dbraw/zinc/33/92/48/551339248.db2.gz	FUUFDTJGLXNDRK-UHFFFAOYSA-N	-2	3	393.240	2.603	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2ccsc2)cc1[N+](=O)[O-]	ZINC000547869329	564514601	/nfs/dbraw/zinc/51/46/01/564514601.db2.gz	ILIKRXPETPCLIV-VIFPVBQESA-N	-2	3	376.437	2.521	20	5		GFBDHL
C[C@@H]1CC[C@](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)(CC(=O)[O-])C1	ZINC000547885218	564516123	/nfs/dbraw/zinc/51/61/23/564516123.db2.gz	QUSFVSXSRLHPEL-MEBBXXQBSA-N	-2	3	390.845	2.808	20	5		GFBDHL
C[C@H]1CC[C@](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])(CC(=O)[O-])C1	ZINC000548222793	564538949	/nfs/dbraw/zinc/53/89/49/564538949.db2.gz	HMKBEHDIRKIGMG-ZUZCIYMTSA-N	-2	3	390.845	2.808	20	5		GFBDHL
CCCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736495938	599039503	/nfs/dbraw/zinc/03/95/03/599039503.db2.gz	WLBBJKVIQDKHBM-UHFFFAOYSA-N	-2	3	388.409	2.528	20	5		GFBDHL
CCCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000736495938	599039507	/nfs/dbraw/zinc/03/95/07/599039507.db2.gz	WLBBJKVIQDKHBM-UHFFFAOYSA-N	-2	3	388.409	2.528	20	5		GFBDHL
CC(C)C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000262430933	604872613	/nfs/dbraw/zinc/87/26/13/604872613.db2.gz	DXICFCGIYXUDIO-VIFPVBQESA-N	-2	3	398.359	2.639	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(F)c(NC(=O)[O-])c1	ZINC000833747340	605151924	/nfs/dbraw/zinc/15/19/24/605151924.db2.gz	WLSCATKGHHYPBB-UHFFFAOYSA-N	-3	3	385.329	2.639	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)c(Cl)c2)cccc1[N+](=O)[O-]	ZINC000826242977	608101407	/nfs/dbraw/zinc/10/14/07/608101407.db2.gz	OPEVIQFHCQGLJX-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)c(Cl)c2)cccc1[N+](=O)[O-]	ZINC000826242977	608101408	/nfs/dbraw/zinc/10/14/08/608101408.db2.gz	OPEVIQFHCQGLJX-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CC(C)(CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CCC(=O)[O-]	ZINC000325616396	563453787	/nfs/dbraw/zinc/45/37/87/563453787.db2.gz	JSIKGDWURLGFHJ-UHFFFAOYSA-N	-2	3	378.834	2.808	20	5		GFBDHL
Cc1ccc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2ccc(Cl)cc2)c([N+](=O)[O-])c1	ZINC000582700863	564858118	/nfs/dbraw/zinc/85/81/18/564858118.db2.gz	GDAMPTJHJGACNG-CQSZACIVSA-N	-2	3	384.797	2.661	20	5		GFBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2cccs2)cc1C	ZINC000604275218	565925293	/nfs/dbraw/zinc/92/52/93/565925293.db2.gz	GBHRFAZYFKVEJZ-NSHDSACASA-N	-2	3	384.435	2.767	20	5		GFBDHL
CC[C@]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])(C(=O)[O-])c1ccccc1	ZINC000736920671	600136639	/nfs/dbraw/zinc/13/66/39/600136639.db2.gz	RDRSUJRIOBTLLU-MRXNPFEDSA-N	-2	3	398.824	2.917	20	5		GFBDHL
CC(C)Cn1ncc([N-]c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)c1C(F)F	ZINC000824284813	608017487	/nfs/dbraw/zinc/01/74/87/608017487.db2.gz	NOMJJZDEGSCBBX-UHFFFAOYSA-N	-2	3	379.331	2.704	20	5		GFBDHL
CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000824324106	609498953	/nfs/dbraw/zinc/49/89/53/609498953.db2.gz	GSOJOLSYOJSOOD-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000824324106	609498955	/nfs/dbraw/zinc/49/89/55/609498955.db2.gz	GSOJOLSYOJSOOD-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
C[C@@]1([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCCC[C@@H]1C(=O)[O-]	ZINC000833573083	660808487	/nfs/dbraw/zinc/80/84/87/660808487.db2.gz	ZUXJJVAEYCQFGV-QMTHXVAHSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CC[C@@H](C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])CC(F)(F)F	ZINC000569609566	564471446	/nfs/dbraw/zinc/47/14/46/564471446.db2.gz	SJMLLSUAOBYVHQ-MRVPVSSYSA-N	-2	3	384.332	2.550	20	5		GFBDHL
C[C@H]1CC[C@](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)(CC(=O)[O-])C1	ZINC000547885219	564515731	/nfs/dbraw/zinc/51/57/31/564515731.db2.gz	QUSFVSXSRLHPEL-ZUZCIYMTSA-N	-2	3	390.845	2.808	20	5		GFBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-]c2ccc(-c3nn[n-]n3)cc2)cc1[N+](=O)[O-]	ZINC000753079350	606590144	/nfs/dbraw/zinc/59/01/44/606590144.db2.gz	BZOKPNMLNYMILZ-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
O=C([N-]c1cc([N+](=O)[O-])c(F)cc1F)c1c(F)cc(-c2nn[n-]n2)cc1F	ZINC000823299283	606669054	/nfs/dbraw/zinc/66/90/54/606669054.db2.gz	PTFUJTPSESZOMG-UHFFFAOYSA-N	-2	3	382.233	2.584	20	5		GFBDHL
Cc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)c(Cl)c1	ZINC000826272568	608106925	/nfs/dbraw/zinc/10/69/25/608106925.db2.gz	QCNOWJFJWPDTTA-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)c(Cl)c1	ZINC000826272568	608106926	/nfs/dbraw/zinc/10/69/26/608106926.db2.gz	QCNOWJFJWPDTTA-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCN(C(=O)c1ccc([O-])c([N+](=O)[O-])c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1	ZINC000825385910	609268603	/nfs/dbraw/zinc/26/86/03/609268603.db2.gz	VIZKAUIXKJMTSW-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCN(C(=O)c1ccc([O-])c([N+](=O)[O-])c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000825385910	609268604	/nfs/dbraw/zinc/26/86/04/609268604.db2.gz	VIZKAUIXKJMTSW-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
CC(C)(C)[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC(=O)[O-]	ZINC000548205687	564536792	/nfs/dbraw/zinc/53/67/92/564536792.db2.gz	AJQAIJSWBDWGSO-VIFPVBQESA-N	-2	3	378.834	2.664	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2cccs2)c1C	ZINC000614314947	565106608	/nfs/dbraw/zinc/10/66/08/565106608.db2.gz	SQJGDJQAQFPXJJ-NSHDSACASA-N	-2	3	384.435	2.767	20	5		GFBDHL
O=C([O-])Cc1nc([N-]C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)n[nH]1	ZINC000739908513	600180792	/nfs/dbraw/zinc/18/07/92/600180792.db2.gz	CZSRKIJMFMMEJO-UHFFFAOYSA-N	-2	3	399.388	2.744	20	5		GFBDHL
CC(C)(C(=O)[O-])[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1	ZINC000826106100	602218900	/nfs/dbraw/zinc/21/89/00/602218900.db2.gz	RIBSBTSIAADZTR-ZDUSSCGKSA-N	-2	3	384.435	2.787	20	5		GFBDHL
CC(C)N(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000824293659	609500001	/nfs/dbraw/zinc/50/00/01/609500001.db2.gz	VSJBWEUTRNOFQM-UHFFFAOYSA-N	-2	3	382.380	2.531	20	5		GFBDHL
CC(C)N(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000824293659	609500004	/nfs/dbraw/zinc/50/00/04/609500004.db2.gz	VSJBWEUTRNOFQM-UHFFFAOYSA-N	-2	3	382.380	2.531	20	5		GFBDHL
CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000824255363	609500024	/nfs/dbraw/zinc/50/00/24/609500024.db2.gz	GWXIMGFZEOHXHW-UHFFFAOYSA-N	-2	3	396.407	2.779	20	5		GFBDHL
CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000824255363	609500025	/nfs/dbraw/zinc/50/00/25/609500025.db2.gz	GWXIMGFZEOHXHW-UHFFFAOYSA-N	-2	3	396.407	2.779	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2Cl)cc1[N+](=O)[O-]	ZINC000826291495	609524296	/nfs/dbraw/zinc/52/42/96/609524296.db2.gz	JAKPECJZHNGFKF-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2Cl)cc1[N+](=O)[O-]	ZINC000826291495	609524298	/nfs/dbraw/zinc/52/42/98/609524298.db2.gz	JAKPECJZHNGFKF-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
C[C@H](CCCC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000274969992	655209362	/nfs/dbraw/zinc/20/93/62/655209362.db2.gz	KFVPKGUYOXWLBL-MRVPVSSYSA-N	-2	3	384.332	2.535	20	5		GFBDHL
CCCC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000262462582	553171429	/nfs/dbraw/zinc/17/14/29/553171429.db2.gz	MWAFTFLPEAFAIC-JTQLQIEISA-N	-2	3	384.332	2.535	20	5		GFBDHL
O=C([O-])c1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)c1	ZINC000432183298	563576468	/nfs/dbraw/zinc/57/64/68/563576468.db2.gz	XBTMWHRDAPACAM-UHFFFAOYSA-N	-2	3	376.268	2.511	20	5		GFBDHL
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc(Cl)c1	ZINC000547910410	564519532	/nfs/dbraw/zinc/51/95/32/564519532.db2.gz	JLLHRSMUZRVOBM-GFCCVEGCSA-N	-2	3	384.797	2.743	20	5		GFBDHL
O=C([O-])C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc(Cl)c1	ZINC000547910411	564520065	/nfs/dbraw/zinc/52/00/65/564520065.db2.gz	JLLHRSMUZRVOBM-LBPRGKRZSA-N	-2	3	384.797	2.743	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2cccs2)cc1[N+](=O)[O-]	ZINC000614314818	565106807	/nfs/dbraw/zinc/10/68/07/565106807.db2.gz	LWCHCCYQAKBROR-QMMMGPOBSA-N	-2	3	376.437	2.521	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2cccc(C)c2)cc1[N+](=O)[O-]	ZINC000614320901	565107187	/nfs/dbraw/zinc/10/71/87/565107187.db2.gz	LYVAZYQHFQPLKH-LBPRGKRZSA-N	-2	3	384.435	2.767	20	5		GFBDHL
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000593945627	565369469	/nfs/dbraw/zinc/36/94/69/565369469.db2.gz	UPHIAEAYEAQZAS-DVVUODLYSA-N	-2	3	390.845	2.662	20	5		GFBDHL
Cc1cc(S(=O)(=O)[N-]c2ccc(-c3nn[n-]n3)c(Cl)c2)ccc1[N+](=O)[O-]	ZINC000826272252	608107840	/nfs/dbraw/zinc/10/78/40/608107840.db2.gz	AJPGLIYZFAEVOV-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
C[C@@]1([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCCC[C@H]1C(=O)[O-]	ZINC000833573082	660808519	/nfs/dbraw/zinc/80/85/19/660808519.db2.gz	ZUXJJVAEYCQFGV-IINYFYTJSA-N	-2	3	376.818	2.560	20	5		GFBDHL
C[C@@]1(C(=O)[O-])CCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325418554	563453719	/nfs/dbraw/zinc/45/37/19/563453719.db2.gz	HHJQQZVFUVYSLW-GXTWGEPZSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CC(=O)Nc1ccc(Cl)c([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)c1	ZINC000515695976	564485459	/nfs/dbraw/zinc/48/54/59/564485459.db2.gz	UEPRDHXMPOKKPE-UHFFFAOYSA-N	-2	3	385.785	2.713	20	5		GFBDHL
CCS[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000572650202	564604677	/nfs/dbraw/zinc/60/46/77/564604677.db2.gz	UTPGSCPFCHSEBD-WCQYABFASA-N	-2	3	388.467	2.636	20	5		GFBDHL
CCC[C@H](CCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000521763687	564635785	/nfs/dbraw/zinc/63/57/85/564635785.db2.gz	LQCKRHSVUQSZMV-LLVKDONJSA-N	-2	3	376.406	2.683	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@](C)(CCC(C)(C)C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000560078487	564948754	/nfs/dbraw/zinc/94/87/54/564948754.db2.gz	RLDGXHXNEVXLKN-AWEZNQCLSA-N	-2	3	378.472	2.913	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2cccc(C)c2)cc1[N+](=O)[O-]	ZINC000614320899	565106825	/nfs/dbraw/zinc/10/68/25/565106825.db2.gz	LYVAZYQHFQPLKH-GFCCVEGCSA-N	-2	3	384.435	2.767	20	5		GFBDHL
O=C([O-])Nc1ccc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1	ZINC000740024705	600448393	/nfs/dbraw/zinc/44/83/93/600448393.db2.gz	KIHLVAUPODAFPA-UHFFFAOYSA-N	-2	3	399.812	2.859	20	5		GFBDHL
CC(C)(C(=O)[O-])[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000826106189	602218993	/nfs/dbraw/zinc/21/89/93/602218993.db2.gz	UORSMMQGNHTACI-HNNXBMFYSA-N	-2	3	378.406	2.725	20	5		GFBDHL
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1-c1nnn[n-]1	ZINC000822035449	607154241	/nfs/dbraw/zinc/15/42/41/607154241.db2.gz	VCZKEQXGITXZLX-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000825333251	609500991	/nfs/dbraw/zinc/50/09/91/609500991.db2.gz	UDFNYYJFSGTRDX-UHFFFAOYSA-N	-2	3	383.368	2.555	20	5		GFBDHL
CCC[C@@](C)([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000574153607	655425573	/nfs/dbraw/zinc/42/55/73/655425573.db2.gz	ATCGXXKUXQYFQH-GFCCVEGCSA-N	-2	3	384.332	2.535	20	5		GFBDHL
O=C([O-])[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC1CCCC1	ZINC000776555068	656757442	/nfs/dbraw/zinc/75/74/42/656757442.db2.gz	NPAANGJCAHNVCD-NSHDSACASA-N	-2	3	390.845	2.808	20	5		GFBDHL
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1ccc([O-])c(Br)c1	ZINC000127263769	551338627	/nfs/dbraw/zinc/33/86/27/551338627.db2.gz	YXDIVPSKNBKFSS-UHFFFAOYSA-N	-2	3	387.211	2.541	20	5		GFBDHL
CCS[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414340209	563727748	/nfs/dbraw/zinc/72/77/48/563727748.db2.gz	KMJLDQZUZHGUKQ-AAEUAGOBSA-N	-2	3	388.467	2.636	20	5		GFBDHL
CC(C)(C)[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC(=O)[O-]	ZINC000548205686	564536809	/nfs/dbraw/zinc/53/68/09/564536809.db2.gz	AJQAIJSWBDWGSO-SECBINFHSA-N	-2	3	378.834	2.664	20	5		GFBDHL
C[C@@H](C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])Cc1cccs1	ZINC000581729816	564815989	/nfs/dbraw/zinc/81/59/89/564815989.db2.gz	LBVYCIJZPRNBSJ-SNVBAGLBSA-N	-2	3	384.435	2.512	20	5		GFBDHL
CC(C)[C@@H](Oc1ccccc1-c1nnn[n-]1)C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000824207290	608166709	/nfs/dbraw/zinc/16/67/09/608166709.db2.gz	SQGVWOYOFROKNW-MRXNPFEDSA-N	-2	3	398.379	2.523	20	5		GFBDHL
CC(C)[C@@H](Oc1ccccc1-c1nn[n-]n1)C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000824207290	608166711	/nfs/dbraw/zinc/16/67/11/608166711.db2.gz	SQGVWOYOFROKNW-MRXNPFEDSA-N	-2	3	398.379	2.523	20	5		GFBDHL
CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000825318089	608864806	/nfs/dbraw/zinc/86/48/06/608864806.db2.gz	IOGBJQLUHJMCGR-UHFFFAOYSA-N	-2	3	382.380	2.533	20	5		GFBDHL
CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000825318089	608864808	/nfs/dbraw/zinc/86/48/08/608864808.db2.gz	IOGBJQLUHJMCGR-UHFFFAOYSA-N	-2	3	382.380	2.533	20	5		GFBDHL
CC(C)C[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC(=O)[O-]	ZINC000324934690	563453254	/nfs/dbraw/zinc/45/32/54/563453254.db2.gz	WLDPROGDFXFZIP-JTQLQIEISA-N	-2	3	378.834	2.664	20	5		GFBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1Cl	ZINC000327563474	563458913	/nfs/dbraw/zinc/45/89/13/563458913.db2.gz	UYBVZHKALHASAT-UHFFFAOYSA-N	-2	3	386.769	2.756	20	5		GFBDHL
O=C([O-])[C@@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000391771814	563525312	/nfs/dbraw/zinc/52/53/12/563525312.db2.gz	PTTZPGUKDNAFEK-PWSUYJOCSA-N	-2	3	376.818	2.560	20	5		GFBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C(=O)[O-])c1cccc(Cl)c1	ZINC000547935606	564523697	/nfs/dbraw/zinc/52/36/97/564523697.db2.gz	KNEBXCCWTXIHHD-ZDUSSCGKSA-N	-2	3	384.797	2.661	20	5		GFBDHL
O=C([O-])C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccs1	ZINC000604023581	565921485	/nfs/dbraw/zinc/92/14/85/565921485.db2.gz	GNQIKFKKKNRCJI-JTQLQIEISA-N	-2	3	390.826	2.804	20	5		GFBDHL
CCN(C(=O)c1cc([O-])cc([N+](=O)[O-])c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000821159887	607299489	/nfs/dbraw/zinc/29/94/89/607299489.db2.gz	CQSUBLBREVENDW-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
CC(C)(C)[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC(=O)[O-]	ZINC000548553811	564559540	/nfs/dbraw/zinc/55/95/40/564559540.db2.gz	HWCUADZCCRRNLH-SECBINFHSA-N	-2	3	378.834	2.664	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@](C)(CCC(C)(C)C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000560078488	564948535	/nfs/dbraw/zinc/94/85/35/564948535.db2.gz	RLDGXHXNEVXLKN-CQSZACIVSA-N	-2	3	378.472	2.913	20	5		GFBDHL
CC(C)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2[O-])cc1-c1nnn[n-]1	ZINC000820174757	607441165	/nfs/dbraw/zinc/44/11/65/607441165.db2.gz	XIUKANZLDNJWPB-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
CC(C)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2[O-])cc1-c1nn[n-]n1	ZINC000820174757	607441166	/nfs/dbraw/zinc/44/11/66/607441166.db2.gz	XIUKANZLDNJWPB-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
O=C([O-])c1cc(C(=O)NCc2ccc([O-])c(Br)c2)cc([N+](=O)[O-])c1	ZINC000833298186	604713298	/nfs/dbraw/zinc/71/32/98/604713298.db2.gz	POAGMCIVHBINEY-UHFFFAOYSA-N	-2	3	395.165	2.691	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(C)(C)C(=O)[O-])cc1	ZINC000499280390	605151634	/nfs/dbraw/zinc/15/16/34/605151634.db2.gz	KFWXABDSPADEGM-UHFFFAOYSA-N	-3	3	394.405	2.772	20	5		GFBDHL
CC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000829833620	660616240	/nfs/dbraw/zinc/61/62/40/660616240.db2.gz	DSQAKINAXBANNN-GFCCVEGCSA-N	-2	3	384.332	2.535	20	5		GFBDHL
CC[C@H](C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])CC(F)(F)F	ZINC000569609567	564471217	/nfs/dbraw/zinc/47/12/17/564471217.db2.gz	SJMLLSUAOBYVHQ-QMMMGPOBSA-N	-2	3	384.332	2.550	20	5		GFBDHL
C[C@@H]1CC[C@@](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])(CC(=O)[O-])C1	ZINC000548222790	564539325	/nfs/dbraw/zinc/53/93/25/564539325.db2.gz	HMKBEHDIRKIGMG-BMIGLBTASA-N	-2	3	390.845	2.808	20	5		GFBDHL
O=C([O-])C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1cccc(Cl)c1	ZINC000548244581	564542161	/nfs/dbraw/zinc/54/21/61/564542161.db2.gz	QIHSQUSWTIZJTK-JTQLQIEISA-N	-2	3	390.826	2.804	20	5		GFBDHL
CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000594847863	565429426	/nfs/dbraw/zinc/42/94/26/565429426.db2.gz	BTLWJHRQTBXIHP-RNCFNFMXSA-N	-2	3	390.845	2.806	20	5		GFBDHL
CCN(C(=O)c1cccc([N+](=O)[O-])c1[O-])[C@H](C)c1ccc(-c2nnn[n-]2)cc1	ZINC000821160191	607209642	/nfs/dbraw/zinc/20/96/42/607209642.db2.gz	GRUCLBVFVZCJMJ-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCN(C(=O)c1cccc([N+](=O)[O-])c1[O-])[C@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000821160191	607209643	/nfs/dbraw/zinc/20/96/43/607209643.db2.gz	GRUCLBVFVZCJMJ-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
CC(C)Cn1ncc([N-]c2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])c1C(F)F	ZINC000824284316	608017557	/nfs/dbraw/zinc/01/75/57/608017557.db2.gz	DJPYRQWDZGQHFA-UHFFFAOYSA-N	-2	3	379.331	2.704	20	5		GFBDHL
O=C([O-])[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC1CCCC1	ZINC000776553303	656756787	/nfs/dbraw/zinc/75/67/87/656756787.db2.gz	STIHRBCVICIZOL-NSHDSACASA-N	-2	3	390.845	2.808	20	5		GFBDHL
CCS[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000571049486	564533714	/nfs/dbraw/zinc/53/37/14/564533714.db2.gz	BXTSFUYQUWZMKN-RYUDHWBXSA-N	-2	3	388.467	2.636	20	5		GFBDHL
CC(C)c1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2-c2nnn[n-]2)cc1	ZINC000820192367	607153443	/nfs/dbraw/zinc/15/34/43/607153443.db2.gz	LEMLPOQVTPJCKY-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
CC(C)c1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2-c2nn[n-]n2)cc1	ZINC000820192367	607153444	/nfs/dbraw/zinc/15/34/44/607153444.db2.gz	LEMLPOQVTPJCKY-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
CC(C)(C)c1cc(C(=O)[N-]c2cc(-c3nn[n-]n3)cc([N+](=O)[O-])c2Cl)no1	ZINC000824129709	608159056	/nfs/dbraw/zinc/15/90/56/608159056.db2.gz	FKERSTGHXOTUEP-UHFFFAOYSA-N	-2	3	391.775	2.966	20	5		GFBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2ccsc2)c1[N+](=O)[O-]	ZINC000563662871	564201278	/nfs/dbraw/zinc/20/12/78/564201278.db2.gz	KNYVEIKOJWZDNB-LBPRGKRZSA-N	-2	3	384.435	2.767	20	5		GFBDHL
CCS[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000571049484	564533656	/nfs/dbraw/zinc/53/36/56/564533656.db2.gz	BXTSFUYQUWZMKN-NEPJUHHUSA-N	-2	3	388.467	2.636	20	5		GFBDHL
O=C([O-])[C@H]1CCCCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000548239726	564541489	/nfs/dbraw/zinc/54/14/89/564541489.db2.gz	QUJADBJUZVGGKW-WCQYABFASA-N	-2	3	390.845	2.950	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2cc(C)cc(C)c2)cc1[N+](=O)[O-]	ZINC000548559627	564560184	/nfs/dbraw/zinc/56/01/84/564560184.db2.gz	SILCWXHLAZSDBL-CQSZACIVSA-N	-2	3	384.435	2.686	20	5		GFBDHL
CCS[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000572650200	564604130	/nfs/dbraw/zinc/60/41/30/564604130.db2.gz	UTPGSCPFCHSEBD-AAEUAGOBSA-N	-2	3	388.467	2.636	20	5		GFBDHL
CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000594848849	565429365	/nfs/dbraw/zinc/42/93/65/565429365.db2.gz	VILRWKRAILTNLC-RNCFNFMXSA-N	-2	3	390.845	2.806	20	5		GFBDHL
COC(=O)c1cccc([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)c1Cl	ZINC000431179827	563555688	/nfs/dbraw/zinc/55/56/88/563555688.db2.gz	HUKDJSCFFSCOTQ-UHFFFAOYSA-N	-2	3	386.769	2.541	20	5		GFBDHL
COC(=O)c1ccc([O-])cc1[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000436479064	563671756	/nfs/dbraw/zinc/67/17/56/563671756.db2.gz	SEWWJNAEUWLVCC-UHFFFAOYSA-N	-2	3	386.769	2.541	20	5		GFBDHL
CC[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000563356363	564187710	/nfs/dbraw/zinc/18/77/10/564187710.db2.gz	YSJGQLMCAMJXFQ-SECBINFHSA-N	-2	3	384.332	2.535	20	5		GFBDHL
CC[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)[O-])c1)CC(F)(F)F	ZINC000569814004	564479653	/nfs/dbraw/zinc/47/96/53/564479653.db2.gz	AAZBMHDHNUOTPN-MRVPVSSYSA-N	-2	3	384.332	2.550	20	5		GFBDHL
COc1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)ccc1[N+](=O)[O-]	ZINC000571111172	564536494	/nfs/dbraw/zinc/53/64/94/564536494.db2.gz	SYSJMHTUHKLPMJ-UHFFFAOYSA-N	-2	3	386.769	2.756	20	5		GFBDHL
O=C([O-])CC[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000562968063	565050058	/nfs/dbraw/zinc/05/00/58/565050058.db2.gz	NGKFZJQWWNURQW-JQWIXIFHSA-N	-2	3	390.845	2.950	20	5		GFBDHL
Cc1ccc([C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C(=O)[O-])cc1	ZINC000738570455	600170893	/nfs/dbraw/zinc/17/08/93/600170893.db2.gz	UNPODINSAIEFFA-ZDUSSCGKSA-N	-2	3	398.824	2.703	20	5		GFBDHL
C[C@]1(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000840893894	661201043	/nfs/dbraw/zinc/20/10/43/661201043.db2.gz	MECWLDITANGMGW-LBPRGKRZSA-N	-2	3	397.236	2.545	20	5		GFBDHL
C[C@@]1(CC[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CC1(Cl)Cl	ZINC000844890057	661446297	/nfs/dbraw/zinc/44/62/97/661446297.db2.gz	SWBZPBATLXNVMY-GFCCVEGCSA-N	-2	3	397.236	2.545	20	5		GFBDHL
CS(=O)(=O)c1csc(C(=O)[N-]c2cc(Cl)cc([N+](=O)[O-])c2[O-])c1	ZINC000542763736	564324837	/nfs/dbraw/zinc/32/48/37/564324837.db2.gz	GAJKWCIOMKIWSW-UHFFFAOYSA-N	-2	3	376.799	2.671	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-]C[C@@]2(CC(=O)[O-])CC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000547885259	564516000	/nfs/dbraw/zinc/51/60/00/564516000.db2.gz	FJDMGQKIPHCSQY-OTYXRUKQSA-N	-2	3	376.456	2.524	20	5		GFBDHL
C[C@H]1CC[C@@](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])(CC(=O)[O-])C1	ZINC000548222791	564539164	/nfs/dbraw/zinc/53/91/64/564539164.db2.gz	HMKBEHDIRKIGMG-BONVTDFDSA-N	-2	3	390.845	2.808	20	5		GFBDHL
O=C([O-])c1csc(S(=O)(=O)[N-]CCCCc2ccc([N+](=O)[O-])cc2)c1	ZINC000520402229	564603786	/nfs/dbraw/zinc/60/37/86/564603786.db2.gz	DWPABSNPIPWYNN-UHFFFAOYSA-N	-2	3	384.435	2.656	20	5		GFBDHL
C[C@@H](C(=O)[O-])[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	ZINC000547906890	601128189	/nfs/dbraw/zinc/12/81/89/601128189.db2.gz	XFABDVBGMZACLD-BMIGLBTASA-N	-2	3	398.824	2.989	20	5		GFBDHL
O=C([O-])C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000013343117	601394519	/nfs/dbraw/zinc/39/45/19/601394519.db2.gz	ZQAJXAFBSPWCBX-LBPRGKRZSA-N	-2	3	384.797	2.743	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CN(C)C(=O)[O-])cc1	ZINC000833747095	605152212	/nfs/dbraw/zinc/15/22/12/605152212.db2.gz	QJSIBYHCIRCTIR-UHFFFAOYSA-N	-3	3	395.393	2.519	20	5		GFBDHL
CCCc1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2-c2nnn[n-]2)cc1	ZINC000821143430	607153988	/nfs/dbraw/zinc/15/39/88/607153988.db2.gz	VFDFVXJWKLNHAF-UHFFFAOYSA-N	-2	3	388.409	2.528	20	5		GFBDHL
CCCc1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2-c2nn[n-]n2)cc1	ZINC000821143430	607153990	/nfs/dbraw/zinc/15/39/90/607153990.db2.gz	VFDFVXJWKLNHAF-UHFFFAOYSA-N	-2	3	388.409	2.528	20	5		GFBDHL
CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000825318304	609268112	/nfs/dbraw/zinc/26/81/12/609268112.db2.gz	LDGWTPZAEFKJQO-UHFFFAOYSA-N	-2	3	382.380	2.533	20	5		GFBDHL
CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000825318304	609268114	/nfs/dbraw/zinc/26/81/14/609268114.db2.gz	LDGWTPZAEFKJQO-UHFFFAOYSA-N	-2	3	382.380	2.533	20	5		GFBDHL
C[C@@]1(CC[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000844888459	661446279	/nfs/dbraw/zinc/44/62/79/661446279.db2.gz	FMBIATDPHMMUOS-GFCCVEGCSA-N	-2	3	397.236	2.545	20	5		GFBDHL
CCS[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000572650203	564604503	/nfs/dbraw/zinc/60/45/03/564604503.db2.gz	UTPGSCPFCHSEBD-YPMHNXCESA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1sc([N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])c(C(=O)[O-])c1C	ZINC000833758016	605302977	/nfs/dbraw/zinc/30/29/77/605302977.db2.gz	IFRZFQCXQIMFPJ-UHFFFAOYSA-N	-2	3	384.435	2.956	20	5		GFBDHL
CCS[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC000414336068	563727555	/nfs/dbraw/zinc/72/75/55/563727555.db2.gz	HNQKEPOVLQHTKG-VXGBXAGGSA-N	-2	3	388.467	2.636	20	5		GFBDHL
O=C([O-])C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccsc1	ZINC000548196293	564534801	/nfs/dbraw/zinc/53/48/01/564534801.db2.gz	DSUWATJIIHLGKS-NSHDSACASA-N	-2	3	390.826	2.804	20	5		GFBDHL
Cc1noc(C(F)F)c1C(=O)[N-]c1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000826337976	608160598	/nfs/dbraw/zinc/16/05/98/608160598.db2.gz	HNFLWCNUKVGJMU-UHFFFAOYSA-N	-2	3	399.701	2.915	20	5		GFBDHL
Cc1cc([C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])ccc1Cl	ZINC000548213912	564537819	/nfs/dbraw/zinc/53/78/19/564537819.db2.gz	DDZHRAKOCABBDO-AWEZNQCLSA-N	-2	3	384.797	2.661	20	5		GFBDHL
O=C([O-])CC[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000562968065	565049791	/nfs/dbraw/zinc/04/97/91/565049791.db2.gz	NGKFZJQWWNURQW-ZYHUDNBSSA-N	-2	3	390.845	2.950	20	5		GFBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C(=O)[O-])c1ccccc1Cl	ZINC000393182277	563528597	/nfs/dbraw/zinc/52/85/97/563528597.db2.gz	ULMJPIDRLKSPCY-CYBMUJFWSA-N	-2	3	384.797	2.661	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2cccs2)cc1[N+](=O)[O-]	ZINC000614314816	565106481	/nfs/dbraw/zinc/10/64/81/565106481.db2.gz	LWCHCCYQAKBROR-MRVPVSSYSA-N	-2	3	376.437	2.521	20	5		GFBDHL
Cc1ccc([C@H](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C(=O)[O-])cc1	ZINC000738570790	600170866	/nfs/dbraw/zinc/17/08/66/600170866.db2.gz	WDPYOZGBTWNOLV-ZDUSSCGKSA-N	-2	3	398.824	2.703	20	5		GFBDHL
Cc1cc([N-]S(=O)(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)ccc1[N+](=O)[O-]	ZINC000826271179	608757414	/nfs/dbraw/zinc/75/74/14/608757414.db2.gz	GVCKNFKIAKVBNR-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N-]S(=O)(=O)c2ccc(Cl)c(-c3nn[n-]n3)c2)ccc1[N+](=O)[O-]	ZINC000826271179	608757415	/nfs/dbraw/zinc/75/74/15/608757415.db2.gz	GVCKNFKIAKVBNR-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCS[C@H]1CCC[C@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])C1	ZINC000565428584	564280824	/nfs/dbraw/zinc/28/08/24/564280824.db2.gz	QHVLSNNJJFNRIK-QWRGUYRKSA-N	-2	3	388.467	2.636	20	5		GFBDHL
CCC(CC)([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000566183982	564315492	/nfs/dbraw/zinc/31/54/92/564315492.db2.gz	HDNCGVRSWCJXSS-UHFFFAOYSA-N	-2	3	384.332	2.535	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])C2(C)CCCCC2)cc1[N+](=O)[O-]	ZINC000548030643	564528240	/nfs/dbraw/zinc/52/82/40/564528240.db2.gz	RPSNLDRXXHYXDK-LBPRGKRZSA-N	-2	3	376.456	2.667	20	5		GFBDHL
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1cccc(Cl)c1	ZINC000548244582	564542221	/nfs/dbraw/zinc/54/22/21/564542221.db2.gz	QIHSQUSWTIZJTK-SNVBAGLBSA-N	-2	3	390.826	2.804	20	5		GFBDHL
CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000821104836	607299006	/nfs/dbraw/zinc/29/90/06/607299006.db2.gz	SNBIJXRVBQKZNE-UHFFFAOYSA-N	-2	3	382.380	2.533	20	5		GFBDHL
Cc1c([N-]c2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])cnn1-c1ccccc1F	ZINC000822129484	607383692	/nfs/dbraw/zinc/38/36/92/607383692.db2.gz	KJNOQZLYWPIIGU-UHFFFAOYSA-N	-2	3	381.331	2.547	20	5		GFBDHL
C[C@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCC[C@H]1C(=O)[O-]	ZINC000833571163	605245647	/nfs/dbraw/zinc/24/56/47/605245647.db2.gz	LLZCOVLRRPESSB-HZMBPMFUSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CC(C)[C@H](Oc1ccccc1-c1nnn[n-]1)C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000824207286	608165601	/nfs/dbraw/zinc/16/56/01/608165601.db2.gz	SQGVWOYOFROKNW-INIZCTEOSA-N	-2	3	398.379	2.523	20	5		GFBDHL
CC(C)[C@H](Oc1ccccc1-c1nn[n-]n1)C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000824207286	608165602	/nfs/dbraw/zinc/16/56/02/608165602.db2.gz	SQGVWOYOFROKNW-INIZCTEOSA-N	-2	3	398.379	2.523	20	5		GFBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]c2ccc(-c3nn[n-]n3)cc2)c1	ZINC000783821669	608538980	/nfs/dbraw/zinc/53/89/80/608538980.db2.gz	NHHGGRUFRSWHQJ-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H]2C[C@H](C(=O)[O-])c3ccccc32)cc1[N+](=O)[O-]	ZINC000575349044	564696401	/nfs/dbraw/zinc/69/64/01/564696401.db2.gz	SRWVAYJBEATSKA-RYUDHWBXSA-N	-2	3	382.419	2.556	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(Cl)c1	ZINC000499152283	564919574	/nfs/dbraw/zinc/91/95/74/564919574.db2.gz	RGGKDXQUXCLJGD-UHFFFAOYSA-N	-3	3	386.769	2.761	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2cccs2)c1C	ZINC000614314945	565107090	/nfs/dbraw/zinc/10/70/90/565107090.db2.gz	SQJGDJQAQFPXJJ-LLVKDONJSA-N	-2	3	384.435	2.767	20	5		GFBDHL
CC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000829833586	660616080	/nfs/dbraw/zinc/61/60/80/660616080.db2.gz	DCFQVYQKXQCMTH-GFCCVEGCSA-N	-2	3	384.332	2.535	20	5		GFBDHL
O=C([O-])[C@@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000391735425	563525202	/nfs/dbraw/zinc/52/52/02/563525202.db2.gz	OHTZNKHSHONJOA-MNOVXSKESA-N	-2	3	376.818	2.560	20	5		GFBDHL
C[C@@]1(C(=O)[O-])CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000392006057	563526444	/nfs/dbraw/zinc/52/64/44/563526444.db2.gz	MCUBOVHXGBELTB-GXTWGEPZSA-N	-2	3	376.818	2.560	20	5		GFBDHL
Cc1ccc(S(=O)(=O)[N-]c2ccc(N[C@@H](C)C(=O)[O-])cc2)cc1[N+](=O)[O-]	ZINC000738295524	600731877	/nfs/dbraw/zinc/73/18/77/600731877.db2.gz	PAZSSCWQGCZUGS-NSHDSACASA-N	-2	3	379.394	2.589	20	5		GFBDHL
CC(C)(C(=O)[O-])[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1	ZINC000826106244	602217392	/nfs/dbraw/zinc/21/73/92/602217392.db2.gz	VUAMYZQBBVNSKC-HNNXBMFYSA-N	-2	3	396.396	2.864	20	5		GFBDHL
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1-c1nnn[n-]1	ZINC000822239982	607154229	/nfs/dbraw/zinc/15/42/29/607154229.db2.gz	NEYMVYXIXQXKTR-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC1CCCC1	ZINC000776555067	656757157	/nfs/dbraw/zinc/75/71/57/656757157.db2.gz	NPAANGJCAHNVCD-LLVKDONJSA-N	-2	3	390.845	2.808	20	5		GFBDHL
O=C([N-]c1n[n-]c(C(F)(F)F)n1)c1ccc(Br)cc1[N+](=O)[O-]	ZINC000431169562	563555742	/nfs/dbraw/zinc/55/57/42/563555742.db2.gz	MDECUNMNJBKDCX-UHFFFAOYSA-N	-2	3	380.080	2.747	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)cc1C(=O)[O-]	ZINC000542727177	564322649	/nfs/dbraw/zinc/32/26/49/564322649.db2.gz	AIUOZJDFZNTYIU-UHFFFAOYSA-N	-3	3	386.769	2.761	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])c2ccccc2)cc1[N+](=O)[O-]	ZINC000548591736	564564819	/nfs/dbraw/zinc/56/48/19/564564819.db2.gz	MQQNYFWVABNEAB-GFCCVEGCSA-N	-2	3	384.435	2.502	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(N(C)C(=O)[O-])cc1	ZINC000833746846	605152268	/nfs/dbraw/zinc/15/22/68/605152268.db2.gz	JWRAERRBPQLGJQ-UHFFFAOYSA-N	-3	3	381.366	2.524	20	5		GFBDHL
C[C@H](CCC[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000325665857	563453975	/nfs/dbraw/zinc/45/39/75/563453975.db2.gz	LFLGJVVCXWAAMX-ZJUUUORDSA-N	-2	3	378.834	2.806	20	5		GFBDHL
CCS[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC000414336062	563727759	/nfs/dbraw/zinc/72/77/59/563727759.db2.gz	HNQKEPOVLQHTKG-NEPJUHHUSA-N	-2	3	388.467	2.636	20	5		GFBDHL
CCS[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000565307572	564275148	/nfs/dbraw/zinc/27/51/48/564275148.db2.gz	MPYPIKRNYQFHKB-NWDGAFQWSA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H]2C[C@@H](C(=O)[O-])c3ccccc32)cc1[N+](=O)[O-]	ZINC000575349042	564696909	/nfs/dbraw/zinc/69/69/09/564696909.db2.gz	SRWVAYJBEATSKA-NEPJUHHUSA-N	-2	3	382.419	2.556	20	5		GFBDHL
C[C@]1([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCCC[C@@H]1C(=O)[O-]	ZINC000833573084	660808448	/nfs/dbraw/zinc/80/84/48/660808448.db2.gz	ZUXJJVAEYCQFGV-YGRLFVJLSA-N	-2	3	376.818	2.560	20	5		GFBDHL
C[C@@H](CCCC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000274969994	655209419	/nfs/dbraw/zinc/20/94/19/655209419.db2.gz	KFVPKGUYOXWLBL-QMMMGPOBSA-N	-2	3	384.332	2.535	20	5		GFBDHL
COc1ccc(Cl)c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)c1	ZINC000471124499	564186613	/nfs/dbraw/zinc/18/66/13/564186613.db2.gz	XRXSOFFKUOFVOK-UHFFFAOYSA-N	-2	3	386.769	2.756	20	5		GFBDHL
C[C@@H]1CC[C@@](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)(CC(=O)[O-])C1	ZINC000547885216	564516070	/nfs/dbraw/zinc/51/60/70/564516070.db2.gz	QUSFVSXSRLHPEL-BMIGLBTASA-N	-2	3	390.845	2.808	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])c2ccccc2)cc1[N+](=O)[O-]	ZINC000548591737	564564841	/nfs/dbraw/zinc/56/48/41/564564841.db2.gz	MQQNYFWVABNEAB-LBPRGKRZSA-N	-2	3	384.435	2.502	20	5		GFBDHL
O=C([O-])CC[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000574615974	564681797	/nfs/dbraw/zinc/68/17/97/564681797.db2.gz	PTUPTBJCPSDZCW-GWCFXTLKSA-N	-2	3	390.845	2.950	20	5		GFBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2cccs2)cc1C	ZINC000604275211	565925456	/nfs/dbraw/zinc/92/54/56/565925456.db2.gz	GBHRFAZYFKVEJZ-LLVKDONJSA-N	-2	3	384.435	2.767	20	5		GFBDHL
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)[N-]c1cccc2ccccc21	ZINC000738358184	599040105	/nfs/dbraw/zinc/04/01/05/599040105.db2.gz	AJFNDLNRJDSUJT-UHFFFAOYSA-N	-2	3	396.388	2.729	20	5		GFBDHL
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)[N-]c1cccc2ccccc21	ZINC000738358184	599040107	/nfs/dbraw/zinc/04/01/07/599040107.db2.gz	AJFNDLNRJDSUJT-UHFFFAOYSA-N	-2	3	396.388	2.729	20	5		GFBDHL
CC(C)Oc1ccc(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)cc1-c1nnn[n-]1	ZINC000820168875	607440633	/nfs/dbraw/zinc/44/06/33/607440633.db2.gz	DOONFANOTIXPKG-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
CC(C)Oc1ccc(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)cc1-c1nn[n-]n1	ZINC000820168875	607440634	/nfs/dbraw/zinc/44/06/34/607440634.db2.gz	DOONFANOTIXPKG-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2-c2nnn[n-]2)cc1Cl	ZINC000822258783	607154205	/nfs/dbraw/zinc/15/42/05/607154205.db2.gz	CLYNNQUSNHTWFG-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
O=C(CCCCOc1cccc(-c2nnn[n-]2)c1)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000826405955	608166606	/nfs/dbraw/zinc/16/66/06/608166606.db2.gz	AROMNYPPKGWEMA-UHFFFAOYSA-N	-2	3	398.379	2.668	20	5		GFBDHL
O=C(CCCCOc1cccc(-c2nn[n-]n2)c1)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000826405955	608166608	/nfs/dbraw/zinc/16/66/08/608166608.db2.gz	AROMNYPPKGWEMA-UHFFFAOYSA-N	-2	3	398.379	2.668	20	5		GFBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]c1ccc(-c2nnn[n-]2)c(Cl)c1	ZINC000826304385	609338259	/nfs/dbraw/zinc/33/82/59/609338259.db2.gz	JJZDGLKYUDGZAM-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]c1ccc(-c2nn[n-]n2)c(Cl)c1	ZINC000826304385	609338261	/nfs/dbraw/zinc/33/82/61/609338261.db2.gz	JJZDGLKYUDGZAM-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-]C[C@]2(CC(=O)[O-])CC[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000547885258	564516250	/nfs/dbraw/zinc/51/62/50/564516250.db2.gz	FJDMGQKIPHCSQY-LKFCYVNXSA-N	-2	3	376.456	2.524	20	5		GFBDHL
O=C([O-])[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccc(Cl)c(F)c1	ZINC000547937204	564523873	/nfs/dbraw/zinc/52/38/73/564523873.db2.gz	XVZDRQXKHNJSQC-LLVKDONJSA-N	-2	3	394.789	2.553	20	5		GFBDHL
Cc1cccc([C@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000548536786	564557204	/nfs/dbraw/zinc/55/72/04/564557204.db2.gz	UHIMBKBANGWNEK-AWEZNQCLSA-N	-2	3	384.797	2.661	20	5		GFBDHL
CCS[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000572650201	564604315	/nfs/dbraw/zinc/60/43/15/564604315.db2.gz	UTPGSCPFCHSEBD-DGCLKSJQSA-N	-2	3	388.467	2.636	20	5		GFBDHL
C[C@H](C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])Cc1cccs1	ZINC000581729815	564816259	/nfs/dbraw/zinc/81/62/59/564816259.db2.gz	LBVYCIJZPRNBSJ-JTQLQIEISA-N	-2	3	384.435	2.512	20	5		GFBDHL
O=C([O-])[C@@H](CC1CCCC1)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000562320065	565024221	/nfs/dbraw/zinc/02/42/21/565024221.db2.gz	RZZSAIHBPOBOCE-LLVKDONJSA-N	-2	3	376.818	2.560	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cccc1-c1nnn[n-]1	ZINC000822121191	607255036	/nfs/dbraw/zinc/25/50/36/607255036.db2.gz	BECLGLAEUBRRNR-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cccc1-c1nn[n-]n1	ZINC000822121191	607255037	/nfs/dbraw/zinc/25/50/37/607255037.db2.gz	BECLGLAEUBRRNR-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)[N-]c1ccc2ccccc2c1	ZINC000738361720	599040860	/nfs/dbraw/zinc/04/08/60/599040860.db2.gz	ZDZUZOOZGMPECH-UHFFFAOYSA-N	-2	3	396.388	2.729	20	5		GFBDHL
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)[N-]c1ccc2ccccc2c1	ZINC000738361720	599040863	/nfs/dbraw/zinc/04/08/63/599040863.db2.gz	ZDZUZOOZGMPECH-UHFFFAOYSA-N	-2	3	396.388	2.729	20	5		GFBDHL
C[C@@H](C(=O)[O-])[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	ZINC000547906892	601128241	/nfs/dbraw/zinc/12/82/41/601128241.db2.gz	XFABDVBGMZACLD-MEBBXXQBSA-N	-2	3	398.824	2.989	20	5		GFBDHL
CC(C)(CCC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000261702728	604872537	/nfs/dbraw/zinc/87/25/37/604872537.db2.gz	OGZILOMVNIURMU-UHFFFAOYSA-N	-2	3	384.332	2.535	20	5		GFBDHL
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1ccc(-c2nn[n-]n2)c(Cl)c1	ZINC000826272372	608107850	/nfs/dbraw/zinc/10/78/50/608107850.db2.gz	GEXZLBFWCHEWSB-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2ccsc2)cc1C	ZINC000548521617	564555790	/nfs/dbraw/zinc/55/57/90/564555790.db2.gz	CLCFQNSCVFSNAL-LBPRGKRZSA-N	-2	3	384.435	2.767	20	5		GFBDHL
CC1(C)CC[C@@]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)(C(=O)[O-])C1	ZINC000556772917	564839381	/nfs/dbraw/zinc/83/93/81/564839381.db2.gz	JEHODUAMGVANIW-AWEZNQCLSA-N	-2	3	376.818	2.560	20	5		GFBDHL
O=C([O-])Nc1ccc(CC[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000740025704	600447251	/nfs/dbraw/zinc/44/72/51/600447251.db2.gz	UIMNSAUHRUABAA-UHFFFAOYSA-N	-2	3	399.812	2.859	20	5		GFBDHL
CC(C)C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000262430929	604872620	/nfs/dbraw/zinc/87/26/20/604872620.db2.gz	DXICFCGIYXUDIO-SECBINFHSA-N	-2	3	398.359	2.639	20	5		GFBDHL
COc1cc(CNc2ccc(Cl)c(-c3nnn[n-]3)c2)cc([N+](=O)[O-])c1[O-]	ZINC000826179233	609199432	/nfs/dbraw/zinc/19/94/32/609199432.db2.gz	FNPCUHJAINBNHG-UHFFFAOYSA-N	-2	3	376.760	2.755	20	5		GFBDHL
COc1cc(CNc2ccc(Cl)c(-c3nn[n-]n3)c2)cc([N+](=O)[O-])c1[O-]	ZINC000826179233	609199433	/nfs/dbraw/zinc/19/94/33/609199433.db2.gz	FNPCUHJAINBNHG-UHFFFAOYSA-N	-2	3	376.760	2.755	20	5		GFBDHL
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC1CCCC1	ZINC000776553301	656756623	/nfs/dbraw/zinc/75/66/23/656756623.db2.gz	STIHRBCVICIZOL-LLVKDONJSA-N	-2	3	390.845	2.808	20	5		GFBDHL
C[C@H](CCC[C@@H](C)C(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325665854	563453771	/nfs/dbraw/zinc/45/37/71/563453771.db2.gz	LFLGJVVCXWAAMX-NXEZZACHSA-N	-2	3	378.834	2.806	20	5		GFBDHL
O=C([O-])CC1(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCCCC1	ZINC000392856687	563528016	/nfs/dbraw/zinc/52/80/16/563528016.db2.gz	RZQPESHFNWKSPK-UHFFFAOYSA-N	-2	3	390.845	2.952	20	5		GFBDHL
O=c1nc(C=Cc2ccc(I)cc2)c([N+](=O)[O-])c([O-])[n-]1	ZINC000478108395	564395271	/nfs/dbraw/zinc/39/52/71/564395271.db2.gz	GDNKOHLGTFMPTG-UTCJRWHESA-N	-2	3	385.117	2.571	20	5		GFBDHL
CCS[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000571049485	564533528	/nfs/dbraw/zinc/53/35/28/564533528.db2.gz	BXTSFUYQUWZMKN-NWDGAFQWSA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1ccc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2ccc(Cl)cc2)c([N+](=O)[O-])c1	ZINC000582700862	564858000	/nfs/dbraw/zinc/85/80/00/564858000.db2.gz	GDAMPTJHJGACNG-AWEZNQCLSA-N	-2	3	384.797	2.661	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2ccccc2Cl)cc1[N+](=O)[O-]	ZINC000530526044	564885713	/nfs/dbraw/zinc/88/57/13/564885713.db2.gz	XZXWMYVPXKJRBN-GFCCVEGCSA-N	-2	3	390.826	2.722	20	5		GFBDHL
O=C([O-])[C@H](CC1CCCC1)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000562320066	565024405	/nfs/dbraw/zinc/02/44/05/565024405.db2.gz	RZZSAIHBPOBOCE-NSHDSACASA-N	-2	3	376.818	2.560	20	5		GFBDHL
O=C([O-])CC[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000562968064	565049754	/nfs/dbraw/zinc/04/97/54/565049754.db2.gz	NGKFZJQWWNURQW-PWSUYJOCSA-N	-2	3	390.845	2.950	20	5		GFBDHL
CCC[C@@](C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000592145634	565260363	/nfs/dbraw/zinc/26/03/63/565260363.db2.gz	VEHZWRWQXUSKLA-GFCCVEGCSA-N	-2	3	384.332	2.535	20	5		GFBDHL
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000593945628	565369383	/nfs/dbraw/zinc/36/93/83/565369383.db2.gz	UPHIAEAYEAQZAS-INTQDDNPSA-N	-2	3	390.845	2.662	20	5		GFBDHL
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccs1	ZINC000604023582	565921534	/nfs/dbraw/zinc/92/15/34/565921534.db2.gz	GNQIKFKKKNRCJI-SNVBAGLBSA-N	-2	3	390.826	2.804	20	5		GFBDHL
Cc1ccc([C@@H](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C(=O)[O-])cc1	ZINC000738570789	600170815	/nfs/dbraw/zinc/17/08/15/600170815.db2.gz	WDPYOZGBTWNOLV-CYBMUJFWSA-N	-2	3	398.824	2.703	20	5		GFBDHL
Cc1ccc([C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C(=O)[O-])cc1	ZINC000548203326	564536056	/nfs/dbraw/zinc/53/60/56/564536056.db2.gz	YRJFGCCLNQOPAL-AWEZNQCLSA-N	-2	3	384.797	2.661	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2cccc(Cl)c2)cc1[N+](=O)[O-]	ZINC000548262799	564544620	/nfs/dbraw/zinc/54/46/20/564544620.db2.gz	APEJBMAJRMNYKU-LBPRGKRZSA-N	-2	3	390.826	2.722	20	5		GFBDHL
CC[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000582710213	564858346	/nfs/dbraw/zinc/85/83/46/564858346.db2.gz	HAHOSYZXKMVVMF-MRVPVSSYSA-N	-2	3	384.332	2.535	20	5		GFBDHL
CSc1ccc([C@H](CC(=O)[O-])[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000738214329	599879334	/nfs/dbraw/zinc/87/93/34/599879334.db2.gz	YBGKJLVSRDAYLQ-ZDUSSCGKSA-N	-2	3	396.446	2.811	20	5		GFBDHL
C[C@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCC[C@@H]1C(=O)[O-]	ZINC000833571168	605245396	/nfs/dbraw/zinc/24/53/96/605245396.db2.gz	LLZCOVLRRPESSB-YGRLFVJLSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CCN(C(=O)c1cccc([N+](=O)[O-])c1[O-])[C@@H](C)c1ccc(-c2nnn[n-]2)cc1	ZINC000821160192	607209407	/nfs/dbraw/zinc/20/94/07/607209407.db2.gz	GRUCLBVFVZCJMJ-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCN(C(=O)c1cccc([N+](=O)[O-])c1[O-])[C@@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000821160192	607209408	/nfs/dbraw/zinc/20/94/08/607209408.db2.gz	GRUCLBVFVZCJMJ-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cc(OC)c([O-])c([N+](=O)[O-])c1	ZINC000825782867	607975248	/nfs/dbraw/zinc/97/52/48/607975248.db2.gz	SGHBXWREYSUPAT-UHFFFAOYSA-N	-2	3	381.352	2.526	20	5		GFBDHL
CCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cc(OC)c([O-])c([N+](=O)[O-])c1	ZINC000825782867	607975249	/nfs/dbraw/zinc/97/52/49/607975249.db2.gz	SGHBXWREYSUPAT-UHFFFAOYSA-N	-2	3	381.352	2.526	20	5		GFBDHL
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(-c2nn[n-]n2)c(Cl)c1	ZINC000826243001	608107955	/nfs/dbraw/zinc/10/79/55/608107955.db2.gz	PJWKOWQGQXTCGO-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)c(Cl)c2)ccc1[N+](=O)[O-]	ZINC000826271153	608757403	/nfs/dbraw/zinc/75/74/03/608757403.db2.gz	FTPQGRGLUOFHTP-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)c(Cl)c2)ccc1[N+](=O)[O-]	ZINC000826271153	608757404	/nfs/dbraw/zinc/75/74/04/608757404.db2.gz	FTPQGRGLUOFHTP-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](c2ccccc2)[C@H](C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548595936	564565454	/nfs/dbraw/zinc/56/54/54/564565454.db2.gz	CPKMCEZIFZUJIY-XPTSAGLGSA-N	-2	3	384.435	2.705	20	5		GFBDHL
CC(C)(C)CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000485064694	564605476	/nfs/dbraw/zinc/60/54/76/564605476.db2.gz	TZRLKEUJAOFOQT-NSHDSACASA-N	-2	3	378.834	2.806	20	5		GFBDHL
CCC[C@@H](CCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000521763692	564635700	/nfs/dbraw/zinc/63/57/00/564635700.db2.gz	LQCKRHSVUQSZMV-NSHDSACASA-N	-2	3	376.406	2.683	20	5		GFBDHL
O=C([O-])CC[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000574615976	564682075	/nfs/dbraw/zinc/68/20/75/564682075.db2.gz	PTUPTBJCPSDZCW-MFKMUULPSA-N	-2	3	390.845	2.950	20	5		GFBDHL
Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1-c1nnn[n-]1	ZINC000822202063	607154437	/nfs/dbraw/zinc/15/44/37/607154437.db2.gz	JJMYIMCOLVXFIY-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CC[C@@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)CC(F)(F)F	ZINC000414397278	563733489	/nfs/dbraw/zinc/73/34/89/563733489.db2.gz	UDQNPNSJLCBNSR-MRVPVSSYSA-N	-2	3	384.332	2.550	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2cccc(C)c2C)cc1[N+](=O)[O-]	ZINC000547964688	564526511	/nfs/dbraw/zinc/52/65/11/564526511.db2.gz	VSHBQXPCBBQUDV-AWEZNQCLSA-N	-2	3	384.435	2.686	20	5		GFBDHL
CCC[C@H](C)C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000548263382	564545510	/nfs/dbraw/zinc/54/55/10/564545510.db2.gz	AAXODTSKTWABBQ-CABZTGNLSA-N	-2	3	378.834	2.806	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2cc(C)cc(C)c2)cc1[N+](=O)[O-]	ZINC000548559622	564560370	/nfs/dbraw/zinc/56/03/70/564560370.db2.gz	SILCWXHLAZSDBL-AWEZNQCLSA-N	-2	3	384.435	2.686	20	5		GFBDHL
Cc1oc(C[N-]S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cc1C(=O)[O-]	ZINC000327091632	563457285	/nfs/dbraw/zinc/45/72/85/563457285.db2.gz	IPCNCECSKXHLFJ-UHFFFAOYSA-N	-2	3	388.785	2.635	20	5		GFBDHL
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)ccc1[N+](=O)[O-]	ZINC000471106769	564185413	/nfs/dbraw/zinc/18/54/13/564185413.db2.gz	CBJSHCBFUQOKLC-UHFFFAOYSA-N	-2	3	376.268	2.511	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](CC2CCCCC2)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548981620	564583069	/nfs/dbraw/zinc/58/30/69/564583069.db2.gz	WAZLSXPLFKRAAX-LLVKDONJSA-N	-2	3	376.456	2.667	20	5		GFBDHL
CC(C)(C)CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000485064693	564605681	/nfs/dbraw/zinc/60/56/81/564605681.db2.gz	TZRLKEUJAOFOQT-LLVKDONJSA-N	-2	3	378.834	2.806	20	5		GFBDHL
O=c1nc(C=Cc2cc(Br)c3c(c2)OCCO3)c([N+](=O)[O-])c([O-])[n-]1	ZINC000486051802	564636830	/nfs/dbraw/zinc/63/68/30/564636830.db2.gz	MBYYRTMHXLBXDZ-UPHRSURJSA-N	-2	3	396.153	2.500	20	5		GFBDHL
CSc1ccc([C@@H](CC(=O)[O-])[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000738214327	599879425	/nfs/dbraw/zinc/87/94/25/599879425.db2.gz	YBGKJLVSRDAYLQ-CYBMUJFWSA-N	-2	3	396.446	2.811	20	5		GFBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2ccsc2)c1[N+](=O)[O-]	ZINC000563662857	564201408	/nfs/dbraw/zinc/20/14/08/564201408.db2.gz	KNYVEIKOJWZDNB-GFCCVEGCSA-N	-2	3	384.435	2.767	20	5		GFBDHL
CCN(C(=O)c1cc([O-])cc([N+](=O)[O-])c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000821159888	607299663	/nfs/dbraw/zinc/29/96/63/607299663.db2.gz	CQSUBLBREVENDW-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
Cc1ccc([C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C(=O)[O-])cc1	ZINC000738570454	600170830	/nfs/dbraw/zinc/17/08/30/600170830.db2.gz	UNPODINSAIEFFA-CYBMUJFWSA-N	-2	3	398.824	2.703	20	5		GFBDHL
CC(C)(C(=O)[O-])[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1	ZINC000826106099	602219103	/nfs/dbraw/zinc/21/91/03/602219103.db2.gz	RIBSBTSIAADZTR-CYBMUJFWSA-N	-2	3	384.435	2.787	20	5		GFBDHL
C[C@@H](c1ccccc1)n1ccc([N-]c2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])n1	ZINC000820571299	606720541	/nfs/dbraw/zinc/72/05/41/606720541.db2.gz	XRGQTKMQUVMRKH-NSHDSACASA-N	-2	3	377.368	2.719	20	5		GFBDHL
CC(C)c1cccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2-c2nnn[n-]2)c1	ZINC000820198299	607153238	/nfs/dbraw/zinc/15/32/38/607153238.db2.gz	VAJPCXKHPQZNFP-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
CC(C)C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC(=O)[O-]	ZINC000325148650	563453764	/nfs/dbraw/zinc/45/37/64/563453764.db2.gz	LLXFXEDOUHKLNB-JTQLQIEISA-N	-2	3	378.834	2.664	20	5		GFBDHL
CC(C)(CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CCC(=O)[O-]	ZINC000325470666	563453926	/nfs/dbraw/zinc/45/39/26/563453926.db2.gz	AECAUMMLWNLFJL-UHFFFAOYSA-N	-2	3	378.834	2.808	20	5		GFBDHL
CC[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)[O-])c1)CC(F)(F)F	ZINC000569814005	564479188	/nfs/dbraw/zinc/47/91/88/564479188.db2.gz	AAZBMHDHNUOTPN-QMMMGPOBSA-N	-2	3	384.332	2.550	20	5		GFBDHL
COc1cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Cl)ccc1[N+](=O)[O-]	ZINC000548525800	564555807	/nfs/dbraw/zinc/55/58/07/564555807.db2.gz	LHQDQILSFAZDHF-UHFFFAOYSA-N	-2	3	386.769	2.756	20	5		GFBDHL
Cc1cc([N-]S(=O)(=O)c2cccc(Cl)c2-c2nnn[n-]2)ccc1[N+](=O)[O-]	ZINC000826271420	608757980	/nfs/dbraw/zinc/75/79/80/608757980.db2.gz	QMQJAPZHJJQUJW-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N-]S(=O)(=O)c2cccc(Cl)c2-c2nn[n-]n2)ccc1[N+](=O)[O-]	ZINC000826271420	608757982	/nfs/dbraw/zinc/75/79/82/608757982.db2.gz	QMQJAPZHJJQUJW-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000829833780	660616320	/nfs/dbraw/zinc/61/63/20/660616320.db2.gz	DSQAKINAXBANNN-LBPRGKRZSA-N	-2	3	384.332	2.535	20	5		GFBDHL
O=C([O-])CCCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000270407132	655043492	/nfs/dbraw/zinc/04/34/92/655043492.db2.gz	BCGIZOKKFYQKHJ-UHFFFAOYSA-N	-2	3	384.332	2.537	20	5		GFBDHL
CCCC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000262664616	553173367	/nfs/dbraw/zinc/17/33/67/553173367.db2.gz	MWAFTFLPEAFAIC-SNVBAGLBSA-N	-2	3	384.332	2.535	20	5		GFBDHL
O=C1CCc2cc(Cl)c([N-]S(=O)(=O)c3ccc([O-])c([N+](=O)[O-])c3)cc21	ZINC000432072652	563574602	/nfs/dbraw/zinc/57/46/02/563574602.db2.gz	BAZHENRMPLEZTL-UHFFFAOYSA-N	-2	3	382.781	2.884	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2cccc(Cl)c2)cc1[N+](=O)[O-]	ZINC000548262798	564544687	/nfs/dbraw/zinc/54/46/87/564544687.db2.gz	APEJBMAJRMNYKU-GFCCVEGCSA-N	-2	3	390.826	2.722	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1C(=O)[O-]	ZINC000499290714	564923245	/nfs/dbraw/zinc/92/32/45/564923245.db2.gz	KPNOFQPWSCIVLX-UHFFFAOYSA-N	-3	3	386.769	2.761	20	5		GFBDHL
Cc1csc(C2([N-]S(=O)(=O)c3ccc([O-])c([N+](=O)[O-])c3)CCCC2)n1	ZINC000591260852	565220086	/nfs/dbraw/zinc/22/00/86/565220086.db2.gz	WQJJMGMKOQUSOL-UHFFFAOYSA-N	-2	3	383.451	2.813	20	5		GFBDHL
CC(C)(CCC(=O)[O-])[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000592144002	565260184	/nfs/dbraw/zinc/26/01/84/565260184.db2.gz	XUCVVSJRYROPMS-UHFFFAOYSA-N	-2	3	384.332	2.535	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H]2C[C@@H](CCC(=O)[O-])C2(C)C)cc1[N+](=O)[O-]	ZINC000594847874	565429308	/nfs/dbraw/zinc/42/93/08/565429308.db2.gz	CBTAGEDHLOIHND-KOLCDFICSA-N	-2	3	376.456	2.523	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2ccc(NCCC(=O)[O-])c([N+](=O)[O-])c2)c(C)c1	ZINC000484319215	597139976	/nfs/dbraw/zinc/13/99/76/597139976.db2.gz	OKFYHCMHCJVLJS-UHFFFAOYSA-N	-2	3	393.421	2.899	20	5		GFBDHL
O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2ccc(OC(F)(F)F)cc2)ccc1[O-]	ZINC000024101048	654542247	/nfs/dbraw/zinc/54/22/47/654542247.db2.gz	WGUXDEYOBKRARL-UHFFFAOYSA-N	-2	3	378.284	3.000	20	5		GFBDHL
CC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)cc1Cl	ZINC000021868963	551116640	/nfs/dbraw/zinc/11/66/40/551116640.db2.gz	TZRFMGGIHQTPOJ-UHFFFAOYSA-N	-2	3	385.785	2.713	20	5		GFBDHL
C[C@@H](CCC[C@H](C)C(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325665855	563453828	/nfs/dbraw/zinc/45/38/28/563453828.db2.gz	LFLGJVVCXWAAMX-UWVGGRQHSA-N	-2	3	378.834	2.806	20	5		GFBDHL
O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2F)ccc1[O-]	ZINC000509372714	564294827	/nfs/dbraw/zinc/29/48/27/564294827.db2.gz	BKOFTLWBJZCJAR-UHFFFAOYSA-N	-2	3	378.284	2.842	20	5		GFBDHL
C[C@H]1CC[C@@](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)(CC(=O)[O-])C1	ZINC000547885217	564516288	/nfs/dbraw/zinc/51/62/88/564516288.db2.gz	QUSFVSXSRLHPEL-BONVTDFDSA-N	-2	3	390.845	2.808	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](C(=O)[O-])C2(C)CCCCC2)cc1[N+](=O)[O-]	ZINC000548030642	564528558	/nfs/dbraw/zinc/52/85/58/564528558.db2.gz	RPSNLDRXXHYXDK-GFCCVEGCSA-N	-2	3	376.456	2.667	20	5		GFBDHL
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccsc1	ZINC000548196292	564535056	/nfs/dbraw/zinc/53/50/56/564535056.db2.gz	DSUWATJIIHLGKS-LLVKDONJSA-N	-2	3	390.826	2.804	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])cccc1-c1nnn[n-]1	ZINC000822123197	607255776	/nfs/dbraw/zinc/25/57/76/607255776.db2.gz	VSDDGNFKZLCUIY-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])cccc1-c1nn[n-]n1	ZINC000822123197	607255777	/nfs/dbraw/zinc/25/57/77/607255777.db2.gz	VSDDGNFKZLCUIY-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCCc1ccc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cc1	ZINC000736496931	599039559	/nfs/dbraw/zinc/03/95/59/599039559.db2.gz	MHHXAQRIJHIMTI-UHFFFAOYSA-N	-2	3	388.409	2.528	20	5		GFBDHL
CCCc1ccc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cc1	ZINC000736496931	599039562	/nfs/dbraw/zinc/03/95/62/599039562.db2.gz	MHHXAQRIJHIMTI-UHFFFAOYSA-N	-2	3	388.409	2.528	20	5		GFBDHL
C[C@]1(C(=O)[O-])CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325418556	563453641	/nfs/dbraw/zinc/45/36/41/563453641.db2.gz	HHJQQZVFUVYSLW-OCCSQVGLSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CC(C)(C)C[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000392345945	563526472	/nfs/dbraw/zinc/52/64/72/563526472.db2.gz	FAOXMVHAJNQCPZ-VIFPVBQESA-N	-2	3	378.834	2.806	20	5		GFBDHL
O=C([O-])CCCCC[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000519588884	564582588	/nfs/dbraw/zinc/58/25/88/564582588.db2.gz	FHZRGZYHOYORNN-UHFFFAOYSA-N	-2	3	384.332	2.537	20	5		GFBDHL
CCC[C@](C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000592145635	565260859	/nfs/dbraw/zinc/26/08/59/565260859.db2.gz	VEHZWRWQXUSKLA-LBPRGKRZSA-N	-2	3	384.332	2.535	20	5		GFBDHL
C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000593945873	565369916	/nfs/dbraw/zinc/36/99/16/565369916.db2.gz	ZZIBQVLGDALMCQ-DVVUODLYSA-N	-2	3	390.845	2.662	20	5		GFBDHL
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2ccc3ccccc3c2)c1-c1nnn[n-]1	ZINC000823647112	607154151	/nfs/dbraw/zinc/15/41/51/607154151.db2.gz	GCKUAGYZJBFHSK-UHFFFAOYSA-N	-2	3	396.388	2.729	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1Cl	ZINC000826293234	609524429	/nfs/dbraw/zinc/52/44/29/609524429.db2.gz	HEVZBAZNHIQDLU-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1Cl	ZINC000826293234	609524431	/nfs/dbraw/zinc/52/44/31/609524431.db2.gz	HEVZBAZNHIQDLU-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2ccsc2)c1C	ZINC000547870292	564514133	/nfs/dbraw/zinc/51/41/33/564514133.db2.gz	NBKRSFUYDZOBNW-LBPRGKRZSA-N	-2	3	384.435	2.767	20	5		GFBDHL
O=C([O-])[C@H](CC1CCCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000548221330	564538076	/nfs/dbraw/zinc/53/80/76/564538076.db2.gz	URPBTOBTEOMGJO-LBPRGKRZSA-N	-2	3	376.818	2.560	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cccc1-c1nn[n-]n1	ZINC000822128678	607255432	/nfs/dbraw/zinc/25/54/32/607255432.db2.gz	FJSCUGQAZXAYCC-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
C[C@@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCC[C@@H]1C(=O)[O-]	ZINC000833571166	605245672	/nfs/dbraw/zinc/24/56/72/605245672.db2.gz	LLZCOVLRRPESSB-QMTHXVAHSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000821123192	606283067	/nfs/dbraw/zinc/28/30/67/606283067.db2.gz	MJLLFGQPQFQIFF-UHFFFAOYSA-N	-2	3	383.368	2.555	20	5		GFBDHL
Cc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(Cl)c(-c2nnn[n-]2)c1	ZINC000826272714	608757631	/nfs/dbraw/zinc/75/76/31/608757631.db2.gz	XXVCVRVGMDNBMG-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(Cl)c(-c2nn[n-]n2)c1	ZINC000826272714	608757634	/nfs/dbraw/zinc/75/76/34/608757634.db2.gz	XXVCVRVGMDNBMG-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C)c1ccc(-c2nnn[n-]2)cc1	ZINC000825380559	608865648	/nfs/dbraw/zinc/86/56/48/608865648.db2.gz	QUORPBQOXFMEGA-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000825380559	608865651	/nfs/dbraw/zinc/86/56/51/608865651.db2.gz	QUORPBQOXFMEGA-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
C[C@]1(CC[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CC1(Cl)Cl	ZINC000844890059	661446251	/nfs/dbraw/zinc/44/62/51/661446251.db2.gz	SWBZPBATLXNVMY-LBPRGKRZSA-N	-2	3	397.236	2.545	20	5		GFBDHL
O=C([O-])CC[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000562968061	565050199	/nfs/dbraw/zinc/05/01/99/565050199.db2.gz	NGKFZJQWWNURQW-CMPLNLGQSA-N	-2	3	390.845	2.950	20	5		GFBDHL
O=C([N-]c1nc(-c2ccc(Br)cc2)n[n-]1)c1ccc([N+](=O)[O-])o1	ZINC000120750885	551221444	/nfs/dbraw/zinc/22/14/44/551221444.db2.gz	QMRLLMRSQQPNQA-UHFFFAOYSA-N	-2	3	378.142	2.988	20	5		GFBDHL
CC(C)(C)CC[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000219436689	553054501	/nfs/dbraw/zinc/05/45/01/553054501.db2.gz	FGAQILXOFFISPI-JTQLQIEISA-N	-2	3	378.834	2.806	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-]C[C@]2(CC(=O)[O-])CC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000547885262	564515805	/nfs/dbraw/zinc/51/58/05/564515805.db2.gz	FJDMGQKIPHCSQY-YMTOWFKASA-N	-2	3	376.456	2.524	20	5		GFBDHL
CC(C)(C)[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC(=O)[O-]	ZINC000548553812	564559402	/nfs/dbraw/zinc/55/94/02/564559402.db2.gz	HWCUADZCCRRNLH-VIFPVBQESA-N	-2	3	378.834	2.664	20	5		GFBDHL
C[C@H](CCCC(=O)[O-])[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000520539023	564607008	/nfs/dbraw/zinc/60/70/08/564607008.db2.gz	LEAAMWRWXJSIAB-MRVPVSSYSA-N	-2	3	384.332	2.535	20	5		GFBDHL
CCS[C@H]1CCC[C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC000414336066	563727845	/nfs/dbraw/zinc/72/78/45/563727845.db2.gz	HNQKEPOVLQHTKG-RYUDHWBXSA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cccc1-c1nnn[n-]1	ZINC000822121299	607254961	/nfs/dbraw/zinc/25/49/61/607254961.db2.gz	CZBVJPTWZYDHMU-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cccc1-c1nn[n-]n1	ZINC000822121299	607254962	/nfs/dbraw/zinc/25/49/62/607254962.db2.gz	CZBVJPTWZYDHMU-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]c2cccc(-c3nn[n-]n3)c2)c1	ZINC000826272290	608540133	/nfs/dbraw/zinc/54/01/33/608540133.db2.gz	CFBJKXUEGRSKHV-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CC(C)Oc1ccc(NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)cc1-c1nnn[n-]1	ZINC000824329183	609162558	/nfs/dbraw/zinc/16/25/58/609162558.db2.gz	KQICKRNPXQZRKN-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
CC(C)Oc1ccc(NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)cc1-c1nn[n-]n1	ZINC000824329183	609162559	/nfs/dbraw/zinc/16/25/59/609162559.db2.gz	KQICKRNPXQZRKN-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
CC(C)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2[O-])cc1-c1nnn[n-]1	ZINC000824329968	609500047	/nfs/dbraw/zinc/50/00/47/609500047.db2.gz	ZJPZPQVCQPVOQU-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
CC(C)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2[O-])cc1-c1nn[n-]n1	ZINC000824329968	609500048	/nfs/dbraw/zinc/50/00/48/609500048.db2.gz	ZJPZPQVCQPVOQU-UHFFFAOYSA-N	-2	3	384.352	2.520	20	5		GFBDHL
CC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000829833588	660616261	/nfs/dbraw/zinc/61/62/61/660616261.db2.gz	DCFQVYQKXQCMTH-LBPRGKRZSA-N	-2	3	384.332	2.535	20	5		GFBDHL
CCC[C@@H](CCCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(=O)[O-]	ZINC000555954956	564809520	/nfs/dbraw/zinc/80/95/20/564809520.db2.gz	IQYUAVVMCVJAJB-NSHDSACASA-N	-2	3	378.472	2.914	20	5		GFBDHL
CCC(CC)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000583083211	564875717	/nfs/dbraw/zinc/87/57/17/564875717.db2.gz	KJFAPRJTHIEWLS-UHFFFAOYSA-N	-2	3	384.332	2.535	20	5		GFBDHL
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000737215222	599039742	/nfs/dbraw/zinc/03/97/42/599039742.db2.gz	FITMVHQDXBXWFL-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000737215222	599039745	/nfs/dbraw/zinc/03/97/45/599039745.db2.gz	FITMVHQDXBXWFL-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCS[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414340212	563727534	/nfs/dbraw/zinc/72/75/34/563727534.db2.gz	KMJLDQZUZHGUKQ-YPMHNXCESA-N	-2	3	388.467	2.636	20	5		GFBDHL
O=C([O-])CC[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000574615977	564681594	/nfs/dbraw/zinc/68/15/94/564681594.db2.gz	PTUPTBJCPSDZCW-ZWNOBZJWSA-N	-2	3	390.845	2.950	20	5		GFBDHL
CC(C)(C(=O)[O-])[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1	ZINC000826106245	602217562	/nfs/dbraw/zinc/21/75/62/602217562.db2.gz	VUAMYZQBBVNSKC-OAHLLOKOSA-N	-2	3	396.396	2.864	20	5		GFBDHL
CCS[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])C1	ZINC000565428571	564279621	/nfs/dbraw/zinc/27/96/21/564279621.db2.gz	QHVLSNNJJFNRIK-GHMZBOCLSA-N	-2	3	388.467	2.636	20	5		GFBDHL
COc1cc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000548198100	564535122	/nfs/dbraw/zinc/53/51/22/564535122.db2.gz	CESCZIXOILJXDO-UHFFFAOYSA-N	-2	3	386.769	2.756	20	5		GFBDHL
C[C@@H](C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])Cc1cccs1	ZINC000519768984	564590330	/nfs/dbraw/zinc/59/03/30/564590330.db2.gz	YROPQXYOIYBACE-SNVBAGLBSA-N	-2	3	384.435	2.512	20	5		GFBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2cccs2)c1[N+](=O)[O-]	ZINC000616328585	565197211	/nfs/dbraw/zinc/19/72/11/565197211.db2.gz	KNJZLFONXGEFBC-NSHDSACASA-N	-2	3	384.435	2.767	20	5		GFBDHL
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1Cl	ZINC000619470474	565343713	/nfs/dbraw/zinc/34/37/13/565343713.db2.gz	VCKLFRDYLYVFCU-UHFFFAOYSA-N	-2	3	386.769	2.756	20	5		GFBDHL
CC[C@@]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])(C(=O)[O-])c1ccccc1	ZINC000736920669	600136663	/nfs/dbraw/zinc/13/66/63/600136663.db2.gz	RDRSUJRIOBTLLU-INIZCTEOSA-N	-2	3	398.824	2.917	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2cccc(Cl)c2-c2nnn[n-]2)cccc1[N+](=O)[O-]	ZINC000826242795	608101197	/nfs/dbraw/zinc/10/11/97/608101197.db2.gz	GSQJZYVOXAKTRD-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2cccc(Cl)c2-c2nn[n-]n2)cccc1[N+](=O)[O-]	ZINC000826242795	608101198	/nfs/dbraw/zinc/10/11/98/608101198.db2.gz	GSQJZYVOXAKTRD-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCS[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414340210	563727864	/nfs/dbraw/zinc/72/78/64/563727864.db2.gz	KMJLDQZUZHGUKQ-DGCLKSJQSA-N	-2	3	388.467	2.636	20	5		GFBDHL
O=C([O-])[C@@H]1CCCCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000548239727	564541344	/nfs/dbraw/zinc/54/13/44/564541344.db2.gz	QUJADBJUZVGGKW-YPMHNXCESA-N	-2	3	390.845	2.950	20	5		GFBDHL
O=C([O-])[C@H]1CCCCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000548239724	564541393	/nfs/dbraw/zinc/54/13/93/564541393.db2.gz	QUJADBJUZVGGKW-AAEUAGOBSA-N	-2	3	390.845	2.950	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)c(Cl)c2)cc1[N+](=O)[O-]	ZINC000826291765	608101263	/nfs/dbraw/zinc/10/12/63/608101263.db2.gz	VIAZCOBWTQKHAN-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)c(Cl)c2)cc1[N+](=O)[O-]	ZINC000826291765	608101264	/nfs/dbraw/zinc/10/12/64/608101264.db2.gz	VIAZCOBWTQKHAN-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1cccc(Cl)c1-c1nnn[n-]1	ZINC000826272591	608757354	/nfs/dbraw/zinc/75/73/54/608757354.db2.gz	RDMXMHRYOSETSW-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([N+](=O)[O-])ccc1[N-]S(=O)(=O)c1cccc(Cl)c1-c1nn[n-]n1	ZINC000826272591	608757355	/nfs/dbraw/zinc/75/73/55/608757355.db2.gz	RDMXMHRYOSETSW-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
C[C@]1(CC[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000844888460	661446223	/nfs/dbraw/zinc/44/62/23/661446223.db2.gz	FMBIATDPHMMUOS-LBPRGKRZSA-N	-2	3	397.236	2.545	20	5		GFBDHL
Cc1cc([C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])ccc1Cl	ZINC000548213913	564537607	/nfs/dbraw/zinc/53/76/07/564537607.db2.gz	DDZHRAKOCABBDO-CQSZACIVSA-N	-2	3	384.797	2.661	20	5		GFBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cccc(-c3nnn[n-]3)c2C)cc1C	ZINC000822212984	607255385	/nfs/dbraw/zinc/25/53/85/607255385.db2.gz	PKWFFFQZMTXCRG-UHFFFAOYSA-N	-2	3	388.409	2.501	20	5		GFBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cccc(-c3nn[n-]n3)c2C)cc1C	ZINC000822212984	607255386	/nfs/dbraw/zinc/25/53/86/607255386.db2.gz	PKWFFFQZMTXCRG-UHFFFAOYSA-N	-2	3	388.409	2.501	20	5		GFBDHL
C[C@H](C(=O)[O-])[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	ZINC000547906893	601128258	/nfs/dbraw/zinc/12/82/58/601128258.db2.gz	XFABDVBGMZACLD-ZUZCIYMTSA-N	-2	3	398.824	2.989	20	5		GFBDHL
CC(C)c1ccccc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1-c1nnn[n-]1	ZINC000820198191	607153179	/nfs/dbraw/zinc/15/31/79/607153179.db2.gz	SBWIGLDWFXRKSB-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826291810	608101367	/nfs/dbraw/zinc/10/13/67/608101367.db2.gz	WUTJDHCDJKZBTL-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000826291810	608101368	/nfs/dbraw/zinc/10/13/68/608101368.db2.gz	WUTJDHCDJKZBTL-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCC[C@](C)([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000574153608	655425566	/nfs/dbraw/zinc/42/55/66/655425566.db2.gz	ATCGXXKUXQYFQH-LBPRGKRZSA-N	-2	3	384.332	2.535	20	5		GFBDHL
C[C@H](C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])Cc1cccs1	ZINC000519768978	564590222	/nfs/dbraw/zinc/59/02/22/564590222.db2.gz	YROPQXYOIYBACE-JTQLQIEISA-N	-2	3	384.435	2.512	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H]2C[C@H](C(=O)[O-])c3ccccc32)cc1[N+](=O)[O-]	ZINC000575349043	564696537	/nfs/dbraw/zinc/69/65/37/564696537.db2.gz	SRWVAYJBEATSKA-NWDGAFQWSA-N	-2	3	382.419	2.556	20	5		GFBDHL
CC(C)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)[O-])CC(F)(F)F	ZINC000596089859	565513438	/nfs/dbraw/zinc/51/34/38/565513438.db2.gz	LBWTYFOBDGWZHK-UHFFFAOYSA-N	-2	3	384.332	2.550	20	5		GFBDHL
CC(C)c1cc(C(=O)[N-]c2cc(-c3nn[n-]n3)cc([N+](=O)[O-])c2Cl)on1	ZINC000824342045	607522332	/nfs/dbraw/zinc/52/23/32/607522332.db2.gz	KFYRWJPHJFOMRQ-UHFFFAOYSA-N	-2	3	377.748	2.792	20	5		GFBDHL
CCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@@H](C)c1ccc(-c2nnn[n-]2)cc1	ZINC000825380560	608865787	/nfs/dbraw/zinc/86/57/87/608865787.db2.gz	QUORPBQOXFMEGA-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000825380560	608865788	/nfs/dbraw/zinc/86/57/88/608865788.db2.gz	QUORPBQOXFMEGA-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
CS(=O)(=O)[N-]c1ccc(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2[O-])cc1	ZINC000541822167	564290602	/nfs/dbraw/zinc/29/06/02/564290602.db2.gz	JWNXYHYHGMPYNI-UHFFFAOYSA-N	-2	3	385.785	2.578	20	5		GFBDHL
C[C@@H]1CC[C@](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])(CC(=O)[O-])C1	ZINC000548222792	564539307	/nfs/dbraw/zinc/53/93/07/564539307.db2.gz	HMKBEHDIRKIGMG-MEBBXXQBSA-N	-2	3	390.845	2.808	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](c2ccccc2)[C@@H](C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548595935	564565744	/nfs/dbraw/zinc/56/57/44/564565744.db2.gz	CPKMCEZIFZUJIY-OTYXRUKQSA-N	-2	3	384.435	2.705	20	5		GFBDHL
CC1(C)CC[C@]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)(C(=O)[O-])C1	ZINC000556772918	564839090	/nfs/dbraw/zinc/83/90/90/564839090.db2.gz	JEHODUAMGVANIW-CQSZACIVSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CCCC[C@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000556888703	564844940	/nfs/dbraw/zinc/84/49/40/564844940.db2.gz	QGGPANPQHZXOOX-VIFPVBQESA-N	-2	3	384.332	2.535	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cc1Cl	ZINC000737361579	599039668	/nfs/dbraw/zinc/03/96/68/599039668.db2.gz	KKBJKRHYRZNAPU-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cc1Cl	ZINC000737361579	599039671	/nfs/dbraw/zinc/03/96/71/599039671.db2.gz	KKBJKRHYRZNAPU-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CCCN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000821104798	607192538	/nfs/dbraw/zinc/19/25/38/607192538.db2.gz	REIHWVGKJXNNHA-UHFFFAOYSA-N	-2	3	382.380	2.533	20	5		GFBDHL
CCCN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000821104798	607192539	/nfs/dbraw/zinc/19/25/39/607192539.db2.gz	REIHWVGKJXNNHA-UHFFFAOYSA-N	-2	3	382.380	2.533	20	5		GFBDHL
O=C([N-]c1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl)c1ccc([N+](=O)[O-])s1	ZINC000826450734	608163871	/nfs/dbraw/zinc/16/38/71/608163871.db2.gz	BCUZCOLTJMCGGH-UHFFFAOYSA-N	-2	3	395.744	2.650	20	5		GFBDHL
O=C([N-]c1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl)c1scnc1Cl	ZINC000826451156	608164151	/nfs/dbraw/zinc/16/41/51/608164151.db2.gz	SGEDXOFCWWHGBI-UHFFFAOYSA-N	-2	3	386.180	2.791	20	5		GFBDHL
CCS[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000565307574	564275114	/nfs/dbraw/zinc/27/51/14/564275114.db2.gz	MPYPIKRNYQFHKB-VXGBXAGGSA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1ccc([C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C(=O)[O-])cc1	ZINC000548203327	564535720	/nfs/dbraw/zinc/53/57/20/564535720.db2.gz	YRJFGCCLNQOPAL-CQSZACIVSA-N	-2	3	384.797	2.661	20	5		GFBDHL
CCC[C@@H](C)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000548263377	564545265	/nfs/dbraw/zinc/54/52/65/564545265.db2.gz	AAXODTSKTWABBQ-BXKDBHETSA-N	-2	3	378.834	2.806	20	5		GFBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2ccsc2)cc1C	ZINC000548521616	564555792	/nfs/dbraw/zinc/55/57/92/564555792.db2.gz	CLCFQNSCVFSNAL-GFCCVEGCSA-N	-2	3	384.435	2.767	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548595937	564565308	/nfs/dbraw/zinc/56/53/08/564565308.db2.gz	CPKMCEZIFZUJIY-YMTOWFKASA-N	-2	3	384.435	2.705	20	5		GFBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C(=O)[O-])c1ccc(Cl)cc1	ZINC000573301639	564631882	/nfs/dbraw/zinc/63/18/82/564631882.db2.gz	VUAQTZOZJGXWII-ZDUSSCGKSA-N	-2	3	384.797	2.661	20	5		GFBDHL
Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(-c3nnn[n-]3)c2)ccc1[N+](=O)[O-]	ZINC000737284102	599018390	/nfs/dbraw/zinc/01/83/90/599018390.db2.gz	ZETSTTDHZMPVGY-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(-c3nn[n-]n3)c2)ccc1[N+](=O)[O-]	ZINC000737284102	599018392	/nfs/dbraw/zinc/01/83/92/599018392.db2.gz	ZETSTTDHZMPVGY-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CSc1ccc(C(=O)[N-]c2nnc(CCCC(=O)[O-])s2)cc1[N+](=O)[O-]	ZINC000738198889	600536887	/nfs/dbraw/zinc/53/68/87/600536887.db2.gz	GZLZKFVYNVHWMD-UHFFFAOYSA-N	-2	3	382.423	2.828	20	5		GFBDHL
O=C([O-])N1CCCc2cc([N-]S(=O)(=O)c3ccc([O-])c([N+](=O)[O-])c3)ccc21	ZINC000740524209	602646828	/nfs/dbraw/zinc/64/68/28/602646828.db2.gz	RGKAIWCESUKVQV-UHFFFAOYSA-N	-3	3	393.377	2.532	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(NC(=O)[O-])c(F)c1	ZINC000833747089	605265406	/nfs/dbraw/zinc/26/54/06/605265406.db2.gz	PXUIHWYMHJOTNT-UHFFFAOYSA-N	-3	3	385.329	2.639	20	5		GFBDHL
C[C@@H](c1ccccc1)n1ccc([N-]c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000820570347	607118749	/nfs/dbraw/zinc/11/87/49/607118749.db2.gz	HTXXSXQMQONAOX-NSHDSACASA-N	-2	3	377.368	2.719	20	5		GFBDHL
COC(=O)c1ccc([O-])cc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000436478761	563671283	/nfs/dbraw/zinc/67/12/83/563671283.db2.gz	QOHJPSZAZLJNQD-UHFFFAOYSA-N	-2	3	386.769	2.541	20	5		GFBDHL
C[C@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])Cc1cccs1	ZINC000414325339	563726108	/nfs/dbraw/zinc/72/61/08/563726108.db2.gz	WWWCBCPSJMORBR-JTQLQIEISA-N	-2	3	384.435	2.512	20	5		GFBDHL
CC[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000563356364	564187769	/nfs/dbraw/zinc/18/77/69/564187769.db2.gz	YSJGQLMCAMJXFQ-VIFPVBQESA-N	-2	3	384.332	2.535	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)cc1[N+](=O)[O-]	ZINC000575349045	564696240	/nfs/dbraw/zinc/69/62/40/564696240.db2.gz	SRWVAYJBEATSKA-VXGBXAGGSA-N	-2	3	382.419	2.556	20	5		GFBDHL
O=C([O-])CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1	ZINC000548205125	599980843	/nfs/dbraw/zinc/98/08/43/599980843.db2.gz	GHFMKDZOJLFANR-AWEZNQCLSA-N	-2	3	382.369	2.618	20	5		GFBDHL
COc1ccc(S(=O)(=O)[N-]c2cc(NC(=O)[O-])ccc2F)cc1[N+](=O)[O-]	ZINC000739930764	602654606	/nfs/dbraw/zinc/65/46/06/602654606.db2.gz	AOQCTEDNWCXXIP-UHFFFAOYSA-N	-2	3	385.329	2.633	20	5		GFBDHL
C[C@H](c1ccccc1)n1ccc([N-]c2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])n1	ZINC000820571298	606720798	/nfs/dbraw/zinc/72/07/98/606720798.db2.gz	XRGQTKMQUVMRKH-LLVKDONJSA-N	-2	3	377.368	2.719	20	5		GFBDHL
CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000824255459	609156274	/nfs/dbraw/zinc/15/62/74/609156274.db2.gz	KNHUZLVIJVAQLE-UHFFFAOYSA-N	-2	3	396.407	2.779	20	5		GFBDHL
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)cc1[N+](=O)[O-]	ZINC000327457219	563458455	/nfs/dbraw/zinc/45/84/55/563458455.db2.gz	DAAKSXFNDNRORE-UHFFFAOYSA-N	-2	3	386.769	2.756	20	5		GFBDHL
O=C([O-])CC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCCC1	ZINC000392803338	563527651	/nfs/dbraw/zinc/52/76/51/563527651.db2.gz	SQIVMHUQAXUXBJ-UHFFFAOYSA-N	-2	3	390.845	2.952	20	5		GFBDHL
O=C([O-])c1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)c1	ZINC000432204394	563577057	/nfs/dbraw/zinc/57/70/57/563577057.db2.gz	ZWIGRMXKXXHIJF-UHFFFAOYSA-N	-2	3	376.268	2.511	20	5		GFBDHL
CCS[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414340211	563727874	/nfs/dbraw/zinc/72/78/74/563727874.db2.gz	KMJLDQZUZHGUKQ-WCQYABFASA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C(=O)[O-])c1cccc(Cl)c1	ZINC000547935605	564523898	/nfs/dbraw/zinc/52/38/98/564523898.db2.gz	KNEBXCCWTXIHHD-CYBMUJFWSA-N	-2	3	384.797	2.661	20	5		GFBDHL
O=C([O-])[C@@H](CC1CCCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000548221329	564538233	/nfs/dbraw/zinc/53/82/33/564538233.db2.gz	URPBTOBTEOMGJO-GFCCVEGCSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CCC[C@H](C)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000548263384	564545353	/nfs/dbraw/zinc/54/53/53/564545353.db2.gz	AAXODTSKTWABBQ-JOYOIKCWSA-N	-2	3	378.834	2.806	20	5		GFBDHL
CC1(C)CC[C@]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])(C(=O)[O-])C1	ZINC000551911460	564668247	/nfs/dbraw/zinc/66/82/47/564668247.db2.gz	FKZCVJKPZDYJKH-CQSZACIVSA-N	-2	3	376.818	2.560	20	5		GFBDHL
Cc1ccc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2ccccc2Cl)c([N+](=O)[O-])c1	ZINC000530423896	564880151	/nfs/dbraw/zinc/88/01/51/564880151.db2.gz	FDLGTCMYTQIGRD-CQSZACIVSA-N	-2	3	384.797	2.661	20	5		GFBDHL
Cc1nc(C=Cc2ccc(Br)cc2[N+](=O)[O-])[n-]c(=O)c1CC(=O)[O-]	ZINC000504734264	565043530	/nfs/dbraw/zinc/04/35/30/565043530.db2.gz	XTPYTCAXKXKWMN-HYXAFXHYSA-N	-2	3	394.181	2.959	20	5		GFBDHL
CCN(C(=O)c1ccc([N+](=O)[O-])c([O-])c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1	ZINC000821161272	599456308	/nfs/dbraw/zinc/45/63/08/599456308.db2.gz	YCEFSJFCVWSUHB-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCN(C(=O)c1ccc([N+](=O)[O-])c([O-])c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000821161272	599456309	/nfs/dbraw/zinc/45/63/09/599456309.db2.gz	YCEFSJFCVWSUHB-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
C[C@H](C(=O)[O-])[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	ZINC000547906891	601128062	/nfs/dbraw/zinc/12/80/62/601128062.db2.gz	XFABDVBGMZACLD-BONVTDFDSA-N	-2	3	398.824	2.989	20	5		GFBDHL
O=c1nc(C=Cc2cc(Br)c3c(c2)OCCO3)c([N+](=O)[O-])c([O-])[n-]1	ZINC000486051798	564637013	/nfs/dbraw/zinc/63/70/13/564637013.db2.gz	MBYYRTMHXLBXDZ-OWOJBTEDSA-N	-2	3	396.153	2.500	20	5		GFBDHL
CC1(C)CC[C@@]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])(C(=O)[O-])C1	ZINC000551911459	564667877	/nfs/dbraw/zinc/66/78/77/564667877.db2.gz	FKZCVJKPZDYJKH-AWEZNQCLSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000735830852	599494641	/nfs/dbraw/zinc/49/46/41/599494641.db2.gz	KCSXSJSJQPAVLP-UHFFFAOYSA-N	-2	3	396.407	2.779	20	5		GFBDHL
CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000735830852	599494643	/nfs/dbraw/zinc/49/46/43/599494643.db2.gz	KCSXSJSJQPAVLP-UHFFFAOYSA-N	-2	3	396.407	2.779	20	5		GFBDHL
O=C([O-])CCSCc1cccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)c1	ZINC000739753511	600110060	/nfs/dbraw/zinc/11/00/60/600110060.db2.gz	ONFRBUYDIDCWQQ-UHFFFAOYSA-N	-2	3	377.378	2.656	20	5		GFBDHL
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1cc(C(=O)[O-])c(F)cc1F	ZINC000833745240	605289171	/nfs/dbraw/zinc/28/91/71/605289171.db2.gz	ZAFRLTAUTAONIL-UHFFFAOYSA-N	-2	3	390.295	2.820	20	5		GFBDHL
C[C@]1([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCCC[C@H]1C(=O)[O-]	ZINC000833573081	660808499	/nfs/dbraw/zinc/80/84/99/660808499.db2.gz	ZUXJJVAEYCQFGV-HZMBPMFUSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CC(C)(C)C[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000392345939	563526331	/nfs/dbraw/zinc/52/63/31/563526331.db2.gz	FAOXMVHAJNQCPZ-SECBINFHSA-N	-2	3	378.834	2.806	20	5		GFBDHL
CC(C)(C)C[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000392357944	563526825	/nfs/dbraw/zinc/52/68/25/563526825.db2.gz	PHJSCOJUPDFEHV-JTQLQIEISA-N	-2	3	378.834	2.806	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](CCC(=O)[O-])c2ccccc2)cc1[N+](=O)[O-]	ZINC000547875285	564514928	/nfs/dbraw/zinc/51/49/28/564514928.db2.gz	BDJUXGBSBZCMCH-LBPRGKRZSA-N	-2	3	384.435	2.849	20	5		GFBDHL
CCc1ccc([C@@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C(=O)[O-])cc1	ZINC000547875868	564515098	/nfs/dbraw/zinc/51/50/98/564515098.db2.gz	SJQJGWZIFQYRRD-CQSZACIVSA-N	-2	3	384.435	2.631	20	5		GFBDHL
CC(C)c1cccc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])c1	ZINC000735932440	599038205	/nfs/dbraw/zinc/03/82/05/599038205.db2.gz	LAQAKGQXKFEOGN-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
CC(C)c1cccc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])c1	ZINC000735932440	599038208	/nfs/dbraw/zinc/03/82/08/599038208.db2.gz	LAQAKGQXKFEOGN-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
CCOc1ccc(C(=O)[N-]c2nnc(CCCC(=O)[O-])s2)cc1[N+](=O)[O-]	ZINC000737195206	600538010	/nfs/dbraw/zinc/53/80/10/600538010.db2.gz	LTXYRFLICSXLBK-UHFFFAOYSA-N	-2	3	380.382	2.505	20	5		GFBDHL
CCN(C(=O)c1ccc([O-])c([N+](=O)[O-])c1)[C@@H](C)c1ccc(-c2nnn[n-]2)cc1	ZINC000825385911	609268467	/nfs/dbraw/zinc/26/84/67/609268467.db2.gz	VIZKAUIXKJMTSW-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCN(C(=O)c1ccc([O-])c([N+](=O)[O-])c1)[C@@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000825385911	609268469	/nfs/dbraw/zinc/26/84/69/609268469.db2.gz	VIZKAUIXKJMTSW-NSHDSACASA-N	-2	3	382.380	2.704	20	5		GFBDHL
C[C@]1(C(=O)[O-])CCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325418555	563453831	/nfs/dbraw/zinc/45/38/31/563453831.db2.gz	HHJQQZVFUVYSLW-JSGCOSHPSA-N	-2	3	376.818	2.560	20	5		GFBDHL
CCS[C@H]1CCC[C@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000565307573	564274790	/nfs/dbraw/zinc/27/47/90/564274790.db2.gz	MPYPIKRNYQFHKB-RYUDHWBXSA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2ccsc2)c1C	ZINC000547870291	564514484	/nfs/dbraw/zinc/51/44/84/564514484.db2.gz	NBKRSFUYDZOBNW-GFCCVEGCSA-N	-2	3	384.435	2.767	20	5		GFBDHL
C[C@@H](CCCC(=O)[O-])[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000520539024	564607017	/nfs/dbraw/zinc/60/70/17/564607017.db2.gz	LEAAMWRWXJSIAB-QMMMGPOBSA-N	-2	3	384.332	2.535	20	5		GFBDHL
C[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000593945874	565369714	/nfs/dbraw/zinc/36/97/14/565369714.db2.gz	ZZIBQVLGDALMCQ-INTQDDNPSA-N	-2	3	390.845	2.662	20	5		GFBDHL
C[C@@]1(C(=O)[O-])CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325418557	563453867	/nfs/dbraw/zinc/45/38/67/563453867.db2.gz	HHJQQZVFUVYSLW-TZMCWYRMSA-N	-2	3	376.818	2.560	20	5		GFBDHL
C[C@]1(C(=O)[O-])CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000392006058	563526389	/nfs/dbraw/zinc/52/63/89/563526389.db2.gz	MCUBOVHXGBELTB-JSGCOSHPSA-N	-2	3	376.818	2.560	20	5		GFBDHL
COc1ccc(Cl)c([N-]S(=O)(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000432177488	563576402	/nfs/dbraw/zinc/57/64/02/563576402.db2.gz	NGFMAILRQBTJOY-UHFFFAOYSA-N	-2	3	386.769	2.756	20	5		GFBDHL
CCc1ccc([C@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C(=O)[O-])cc1	ZINC000547875864	564515184	/nfs/dbraw/zinc/51/51/84/564515184.db2.gz	SJQJGWZIFQYRRD-AWEZNQCLSA-N	-2	3	384.435	2.631	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-]C[C@@]2(CC(=O)[O-])CC[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000547885260	564515820	/nfs/dbraw/zinc/51/58/20/564515820.db2.gz	FJDMGQKIPHCSQY-XPTSAGLGSA-N	-2	3	376.456	2.524	20	5		GFBDHL
CCC[C@H](CCCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(=O)[O-]	ZINC000555954953	564809610	/nfs/dbraw/zinc/80/96/10/564809610.db2.gz	IQYUAVVMCVJAJB-LLVKDONJSA-N	-2	3	378.472	2.914	20	5		GFBDHL
CCN(C(=O)c1ccc([N+](=O)[O-])c([O-])c1)[C@H](C)c1ccc(-c2nnn[n-]2)cc1	ZINC000821161271	599456178	/nfs/dbraw/zinc/45/61/78/599456178.db2.gz	YCEFSJFCVWSUHB-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCN(C(=O)c1ccc([N+](=O)[O-])c([O-])c1)[C@H](C)c1ccc(-c2nn[n-]n2)cc1	ZINC000821161271	599456180	/nfs/dbraw/zinc/45/61/80/599456180.db2.gz	YCEFSJFCVWSUHB-LLVKDONJSA-N	-2	3	382.380	2.704	20	5		GFBDHL
CCCn1c2ccc(-c3nnn[n-]3)cc2nc1-c1cc(OC)c([O-])c([N+](=O)[O-])c1	ZINC000825352405	607974945	/nfs/dbraw/zinc/97/49/45/607974945.db2.gz	MZFRKOQYHGGAIF-UHFFFAOYSA-N	-2	3	395.379	2.916	20	5		GFBDHL
CCCn1c2ccc(-c3nn[n-]n3)cc2nc1-c1cc(OC)c([O-])c([N+](=O)[O-])c1	ZINC000825352405	607974946	/nfs/dbraw/zinc/97/49/46/607974946.db2.gz	MZFRKOQYHGGAIF-UHFFFAOYSA-N	-2	3	395.379	2.916	20	5		GFBDHL
CCCC[C@@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000563351748	564187388	/nfs/dbraw/zinc/18/73/88/564187388.db2.gz	QGGPANPQHZXOOX-SECBINFHSA-N	-2	3	384.332	2.535	20	5		GFBDHL
O=C([O-])CC[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000574615975	564681581	/nfs/dbraw/zinc/68/15/81/564681581.db2.gz	PTUPTBJCPSDZCW-GXFFZTMASA-N	-2	3	390.845	2.950	20	5		GFBDHL
O=C([O-])CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1	ZINC000548205126	599980399	/nfs/dbraw/zinc/98/03/99/599980399.db2.gz	GHFMKDZOJLFANR-CQSZACIVSA-N	-2	3	382.369	2.618	20	5		GFBDHL
C[C@@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])Cc1cccs1	ZINC000414325340	563725999	/nfs/dbraw/zinc/72/59/99/563725999.db2.gz	WWWCBCPSJMORBR-SNVBAGLBSA-N	-2	3	384.435	2.512	20	5		GFBDHL
CC[C@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)CC(F)(F)F	ZINC000414397279	563733695	/nfs/dbraw/zinc/73/36/95/563733695.db2.gz	UDQNPNSJLCBNSR-QMMMGPOBSA-N	-2	3	384.332	2.550	20	5		GFBDHL
O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2ccc(OC(F)F)c(F)c2)ccc1[O-]	ZINC000515633199	564484095	/nfs/dbraw/zinc/48/40/95/564484095.db2.gz	GBDLICUJJPOQJB-UHFFFAOYSA-N	-2	3	378.284	2.842	20	5		GFBDHL
CC[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000582710214	564857946	/nfs/dbraw/zinc/85/79/46/564857946.db2.gz	HAHOSYZXKMVVMF-QMMMGPOBSA-N	-2	3	384.332	2.535	20	5		GFBDHL
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)[N-]c1cccc(C(F)F)c1	ZINC000738358259	599042552	/nfs/dbraw/zinc/04/25/52/599042552.db2.gz	DCRKQVRPRDHYKQ-UHFFFAOYSA-N	-2	3	396.335	2.513	20	5		GFBDHL
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)[N-]c1cccc(C(F)F)c1	ZINC000738358259	599042554	/nfs/dbraw/zinc/04/25/54/599042554.db2.gz	DCRKQVRPRDHYKQ-UHFFFAOYSA-N	-2	3	396.335	2.513	20	5		GFBDHL
Cc1ccc(S(=O)(=O)[N-]c2ccc(N[C@H](C)C(=O)[O-])cc2)cc1[N+](=O)[O-]	ZINC000738295522	600731731	/nfs/dbraw/zinc/73/17/31/600731731.db2.gz	PAZSSCWQGCZUGS-LLVKDONJSA-N	-2	3	379.394	2.589	20	5		GFBDHL
COc1cccc(-c2nc(C(=O)[N-]c3cc(C(=O)[O-])cc([N+](=O)[O-])c3)no2)c1	ZINC000832514533	602167238	/nfs/dbraw/zinc/16/72/38/602167238.db2.gz	GADQAVAGMJEVEQ-UHFFFAOYSA-N	-2	3	384.304	2.604	20	5		GFBDHL
C[C@@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCC[C@H]1C(=O)[O-]	ZINC000833571165	605245371	/nfs/dbraw/zinc/24/53/71/605245371.db2.gz	LLZCOVLRRPESSB-IINYFYTJSA-N	-2	3	376.818	2.560	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cc(-c3nn[n-]n3)ccc2C)c1C	ZINC000822221167	607001532	/nfs/dbraw/zinc/00/15/32/607001532.db2.gz	DDYIIUFVEDXXNM-UHFFFAOYSA-N	-2	3	388.409	2.501	20	5		GFBDHL
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c1-c1nnn[n-]1	ZINC000823647909	607155910	/nfs/dbraw/zinc/15/59/10/607155910.db2.gz	PTNXJKFUNHOPFI-UHFFFAOYSA-N	-2	3	396.335	2.513	20	5		GFBDHL
CCS[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])C1	ZINC000565428585	564281001	/nfs/dbraw/zinc/28/10/01/564281001.db2.gz	QHVLSNNJJFNRIK-WDEREUQCSA-N	-2	3	388.467	2.636	20	5		GFBDHL
O=C([O-])[C@@H]1CCCCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000548239725	564541366	/nfs/dbraw/zinc/54/13/66/564541366.db2.gz	QUJADBJUZVGGKW-DGCLKSJQSA-N	-2	3	390.845	2.950	20	5		GFBDHL
CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000735931649	599038270	/nfs/dbraw/zinc/03/82/70/599038270.db2.gz	AXVCCPPEPWNUJB-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000735931649	599038272	/nfs/dbraw/zinc/03/82/72/599038272.db2.gz	AXVCCPPEPWNUJB-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
CC(C)c1ccc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cc1	ZINC000735928406	599038452	/nfs/dbraw/zinc/03/84/52/599038452.db2.gz	LJQFRXAJVDOETA-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
CC(C)c1ccc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cc1	ZINC000735928406	599038455	/nfs/dbraw/zinc/03/84/55/599038455.db2.gz	LJQFRXAJVDOETA-UHFFFAOYSA-N	-2	3	388.409	2.699	20	5		GFBDHL
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000737342920	599039271	/nfs/dbraw/zinc/03/92/71/599039271.db2.gz	IYHVZDFNFPRUGX-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000737342920	599039274	/nfs/dbraw/zinc/03/92/74/599039274.db2.gz	IYHVZDFNFPRUGX-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)c([N+](=O)[O-])c2)c1-c1nnn[n-]1	ZINC000826304057	607532898	/nfs/dbraw/zinc/53/28/98/607532898.db2.gz	UKJLRABWIXMCBI-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)c([N+](=O)[O-])c2)c1-c1nn[n-]n1	ZINC000826304057	607532899	/nfs/dbraw/zinc/53/28/99/607532899.db2.gz	UKJLRABWIXMCBI-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
C[C@H](c1ccccc1)n1ccc([N-]c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000820570346	607118646	/nfs/dbraw/zinc/11/86/46/607118646.db2.gz	HTXXSXQMQONAOX-LLVKDONJSA-N	-2	3	377.368	2.719	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2Cl)cccc1[N+](=O)[O-]	ZINC000826242702	609524326	/nfs/dbraw/zinc/52/43/26/609524326.db2.gz	BILKSMMCLQVEPY-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2Cl)cccc1[N+](=O)[O-]	ZINC000826242702	609524328	/nfs/dbraw/zinc/52/43/28/609524328.db2.gz	BILKSMMCLQVEPY-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
C[C@@]1(C(=O)[O-])CCCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000392006060	563526029	/nfs/dbraw/zinc/52/60/29/563526029.db2.gz	MCUBOVHXGBELTB-TZMCWYRMSA-N	-2	3	376.818	2.560	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2cccc(C)c2C)cc1[N+](=O)[O-]	ZINC000547964689	564526124	/nfs/dbraw/zinc/52/61/24/564526124.db2.gz	VSHBQXPCBBQUDV-CQSZACIVSA-N	-2	3	384.435	2.686	20	5		GFBDHL
Cc1nc(C=Cc2ccc(Br)cc2[N+](=O)[O-])[n-]c(=O)c1CC(=O)[O-]	ZINC000504734255	565043673	/nfs/dbraw/zinc/04/36/73/565043673.db2.gz	XTPYTCAXKXKWMN-HWKANZROSA-N	-2	3	394.181	2.959	20	5		GFBDHL
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)[N-]c1cc(C(=O)[O-])c(F)cc1F	ZINC000832905155	601475240	/nfs/dbraw/zinc/47/52/40/601475240.db2.gz	FKZRMQZCIZRZOL-UHFFFAOYSA-N	-2	3	386.332	2.989	20	5		GFBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-]c2cccc(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000778660146	606590229	/nfs/dbraw/zinc/59/02/29/606590229.db2.gz	IFUMMCBPSMXZGB-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
CC(C)CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000820086837	607206968	/nfs/dbraw/zinc/20/69/68/607206968.db2.gz	GZKZCSLKXZTNNC-UHFFFAOYSA-N	-2	3	396.407	2.779	20	5		GFBDHL
CC(C)CN(Cc1ccc(-c2nn[n-]n2)cc1)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000820086837	607206969	/nfs/dbraw/zinc/20/69/69/607206969.db2.gz	GZKZCSLKXZTNNC-UHFFFAOYSA-N	-2	3	396.407	2.779	20	5		GFBDHL
O=C([N-]c1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl)c1nc(Cl)ccc1F	ZINC000826451203	608162232	/nfs/dbraw/zinc/16/22/32/608162232.db2.gz	VSGSJAVKZKYXGP-UHFFFAOYSA-N	-2	3	398.141	2.868	20	5		GFBDHL
Nc1c(Cl)cc([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)cc1Cl	ZINC000045499920	654669169	/nfs/dbraw/zinc/66/91/69/654669169.db2.gz	KRYRFTDZLXHHSV-UHFFFAOYSA-N	-2	3	378.193	2.990	20	5		GFBDHL
C[C@]1(C(=O)[O-])CCCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000392006059	563525979	/nfs/dbraw/zinc/52/59/79/563525979.db2.gz	MCUBOVHXGBELTB-OCCSQVGLSA-N	-2	3	376.818	2.560	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)c(C(=O)[O-])c1	ZINC000508256044	564259353	/nfs/dbraw/zinc/25/93/53/564259353.db2.gz	UTZFJWTTXIAVPS-UHFFFAOYSA-N	-3	3	386.769	2.761	20	5		GFBDHL
O=C([O-])[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccc(Cl)c(F)c1	ZINC000547937205	564523449	/nfs/dbraw/zinc/52/34/49/564523449.db2.gz	XVZDRQXKHNJSQC-NSHDSACASA-N	-2	3	394.789	2.553	20	5		GFBDHL
CCC[C@@H](C)C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000548263385	564545305	/nfs/dbraw/zinc/54/53/05/564545305.db2.gz	AAXODTSKTWABBQ-SKDRFNHKSA-N	-2	3	378.834	2.806	20	5		GFBDHL
CCCc1ccccc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1-c1nnn[n-]1	ZINC000821142131	607153606	/nfs/dbraw/zinc/15/36/06/607153606.db2.gz	FBXVGBUZONCGPX-UHFFFAOYSA-N	-2	3	388.409	2.528	20	5		GFBDHL
CCCNc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000821123699	607209690	/nfs/dbraw/zinc/20/96/90/607209690.db2.gz	WBFRABZGSVCUNU-UHFFFAOYSA-N	-2	3	383.368	2.555	20	5		GFBDHL
C[C@@]1(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000840893893	661201081	/nfs/dbraw/zinc/20/10/81/661201081.db2.gz	MECWLDITANGMGW-GFCCVEGCSA-N	-2	3	397.236	2.545	20	5		GFBDHL
CCS[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC000414336064	563727489	/nfs/dbraw/zinc/72/74/89/563727489.db2.gz	HNQKEPOVLQHTKG-NWDGAFQWSA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2ccsc2)cc1[N+](=O)[O-]	ZINC000547869328	564514180	/nfs/dbraw/zinc/51/41/80/564514180.db2.gz	ILIKRXPETPCLIV-SECBINFHSA-N	-2	3	376.437	2.521	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@H](CCC(=O)[O-])c2ccccc2)cc1[N+](=O)[O-]	ZINC000547875284	564515386	/nfs/dbraw/zinc/51/53/86/564515386.db2.gz	BDJUXGBSBZCMCH-GFCCVEGCSA-N	-2	3	384.435	2.849	20	5		GFBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2cccs2)c1[N+](=O)[O-]	ZINC000616328584	565196969	/nfs/dbraw/zinc/19/69/69/565196969.db2.gz	KNJZLFONXGEFBC-LLVKDONJSA-N	-2	3	384.435	2.767	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cccc(-c3nnn[n-]3)c2C)c1C	ZINC000822271209	607256110	/nfs/dbraw/zinc/25/61/10/607256110.db2.gz	QNUQISBDMMPKQC-UHFFFAOYSA-N	-2	3	388.409	2.501	20	5		GFBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cccc(-c3nn[n-]n3)c2C)c1C	ZINC000822271209	607256111	/nfs/dbraw/zinc/25/61/11/607256111.db2.gz	QNUQISBDMMPKQC-UHFFFAOYSA-N	-2	3	388.409	2.501	20	5		GFBDHL
CCS[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000571049487	564533447	/nfs/dbraw/zinc/53/34/47/564533447.db2.gz	BXTSFUYQUWZMKN-VXGBXAGGSA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-]CC2(CC(=O)[O-])CCCCC2)cc1[N+](=O)[O-]	ZINC000548241428	564541334	/nfs/dbraw/zinc/54/13/34/564541334.db2.gz	BTTFMRUCZUZZLF-UHFFFAOYSA-N	-2	3	376.456	2.668	20	5		GFBDHL
O=C([N-]c1nnc(C2CCOCC2)s1)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000571566553	564556952	/nfs/dbraw/zinc/55/69/52/564556952.db2.gz	WJPJQHRKZDSQQU-UHFFFAOYSA-N	-2	3	384.801	2.952	20	5		GFBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C(=O)[O-])c1ccc(Cl)cc1	ZINC000573301638	564632009	/nfs/dbraw/zinc/63/20/09/564632009.db2.gz	VUAQTZOZJGXWII-CYBMUJFWSA-N	-2	3	384.797	2.661	20	5		GFBDHL
O=C([O-])c1sc2ccccc2c1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000740281781	599880236	/nfs/dbraw/zinc/88/02/36/599880236.db2.gz	ZJFVMGNRTJPLCG-UHFFFAOYSA-N	-2	3	392.414	2.986	20	5		GFBDHL
CC(C)(C(=O)[O-])[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000826106190	602218820	/nfs/dbraw/zinc/21/88/20/602218820.db2.gz	UORSMMQGNHTACI-OAHLLOKOSA-N	-2	3	378.406	2.725	20	5		GFBDHL
CC(C)(C)C[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000392357945	563526901	/nfs/dbraw/zinc/52/69/01/563526901.db2.gz	PHJSCOJUPDFEHV-SNVBAGLBSA-N	-2	3	378.834	2.806	20	5		GFBDHL
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)ccc1[N+](=O)[O-]	ZINC000471112145	564185713	/nfs/dbraw/zinc/18/57/13/564185713.db2.gz	HBZSRXDGJPUKDK-UHFFFAOYSA-N	-2	3	376.268	2.511	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-]C2(C(=O)[O-])CCC(C)(C)CC2)cc1[N+](=O)[O-]	ZINC000541001438	564263436	/nfs/dbraw/zinc/26/34/36/564263436.db2.gz	YMXVIDQIAAYWPY-UHFFFAOYSA-N	-2	3	376.456	2.667	20	5		GFBDHL
CCS[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])C1	ZINC000565428583	564280399	/nfs/dbraw/zinc/28/03/99/564280399.db2.gz	QHVLSNNJJFNRIK-MNOVXSKESA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000737265752	599039776	/nfs/dbraw/zinc/03/97/76/599039776.db2.gz	YIARQJRMASTXOF-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000737265752	599039778	/nfs/dbraw/zinc/03/97/78/599039778.db2.gz	YIARQJRMASTXOF-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL
Cc1cc([O-])c([N+](=O)[O-])cc1S(=O)(=O)[N-]c1cc(Cl)cc(C(=O)[O-])c1	ZINC000833746940	605152428	/nfs/dbraw/zinc/15/24/28/605152428.db2.gz	MBKZEGVDVPGBHI-UHFFFAOYSA-N	-3	3	386.769	2.761	20	5		GFBDHL
C[C@H](CCC[C@H](C)C(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325665856	563453751	/nfs/dbraw/zinc/45/37/51/563453751.db2.gz	LFLGJVVCXWAAMX-VHSXEESVSA-N	-2	3	378.834	2.806	20	5		GFBDHL
CCS[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000565307571	564274589	/nfs/dbraw/zinc/27/45/89/564274589.db2.gz	MPYPIKRNYQFHKB-NEPJUHHUSA-N	-2	3	388.467	2.636	20	5		GFBDHL
Cc1cccc([C@@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000548536787	564557003	/nfs/dbraw/zinc/55/70/03/564557003.db2.gz	UHIMBKBANGWNEK-CQSZACIVSA-N	-2	3	384.797	2.661	20	5		GFBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](c2ccccc2)[C@H](C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548595934	564565662	/nfs/dbraw/zinc/56/56/62/564565662.db2.gz	CPKMCEZIFZUJIY-LKFCYVNXSA-N	-2	3	384.435	2.705	20	5		GFBDHL
Cc1c([N-]S(=O)(=O)c2ccc(Cl)c(-c3nnn[n-]3)c2)cccc1[N+](=O)[O-]	ZINC000826243135	608101277	/nfs/dbraw/zinc/10/12/77/608101277.db2.gz	WAFJFXRXJCJXTM-UHFFFAOYSA-N	-2	3	394.800	2.538	20	5		GFBDHL