smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(C)c([N-]S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])c(C(=O)[O-])c1	ZINC000438777010	864270642	/nfs/dbraw/zinc/27/06/42/864270642.db2.gz	UQLVXIJLYOEBJU-UHFFFAOYSA-N	-2	0	419.242	4.017	20	5		HIBDRL
Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(Cl)c(Cl)c(C(=O)[O-])c2)c1[N+](=O)[O-]	ZINC000479200797	894466160	/nfs/dbraw/zinc/46/61/60/894466160.db2.gz	WREPGGUASJMJBO-UHFFFAOYSA-N	-2	0	419.242	4.017	20	5		HIBDRL
O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2ccccc2Oc2cccc(F)c2)ccc1[O-]	ZINC000518086258	927013071	/nfs/dbraw/zinc/01/30/71/927013071.db2.gz	ZSGQGNNSZIRKLT-UHFFFAOYSA-N	-2	0	404.375	4.033	20	5		HIBDRL
Cc1cc(Cl)c2ccccc2c1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000462385678	875498191	/nfs/dbraw/zinc/49/81/91/875498191.db2.gz	XMZGJPZAQUQJEZ-UHFFFAOYSA-N	-2	0	420.830	4.209	20	5		HIBDRL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cc(Cl)c(Cl)c(C(=O)[O-])c2)cc1C	ZINC000485034056	900375053	/nfs/dbraw/zinc/37/50/53/900375053.db2.gz	MISKGCNHMLNJCY-UHFFFAOYSA-N	-2	0	419.242	4.017	20	5		HIBDRL
COc1cc2c(cc1[N-]S(=O)(=O)c1ccc([O-])c([N+](=O)[O-])c1)oc1ccccc12	ZINC000024101157	846790272	/nfs/dbraw/zinc/79/02/72/846790272.db2.gz	PPMKICXOGZJIQB-UHFFFAOYSA-N	-2	0	414.395	4.009	20	5		HIBDRL
O=C([O-])c1ccccc1COc1cccc(/C=C/c2ncc([N+](=O)[O-])cc2C(=O)[O-])c1	ZINC000518302559	927162944	/nfs/dbraw/zinc/16/29/44/927162944.db2.gz	RFIPGHXYPYLIOX-CMDGGOBGSA-N	-2	0	420.377	4.136	20	5		HIBDRL
O=C([O-])c1ccccc1COc1cccc(/C=C\c2ncc([N+](=O)[O-])cc2C(=O)[O-])c1	ZINC000518302560	927162505	/nfs/dbraw/zinc/16/25/05/927162505.db2.gz	RFIPGHXYPYLIOX-HJWRWDBZSA-N	-2	0	420.377	4.136	20	5		HIBDRL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cc(Cl)c(Cl)c(C(=O)[O-])c2)c1C	ZINC000481601539	896981799	/nfs/dbraw/zinc/98/17/99/896981799.db2.gz	CWFABIOUOAFDMU-UHFFFAOYSA-N	-2	0	419.242	4.017	20	5		HIBDRL
Cc1cc(C)c(C(=O)[O-])cc1[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000548202113	941092140	/nfs/dbraw/zinc/09/21/40/941092140.db2.gz	DYLJNJJJWWSFLK-UHFFFAOYSA-N	-2	0	419.242	4.017	20	5		HIBDRL
Cc1c(CSC(C)C)cccc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000471117797	885654109	/nfs/dbraw/zinc/65/41/09/885654109.db2.gz	XJAAQAOODDQPAL-UHFFFAOYSA-N	-2	0	424.500	4.044	20	5		HIBDRL
Cc1cc(-c2ccccc2)ccc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000532110646	931316401	/nfs/dbraw/zinc/31/64/01/931316401.db2.gz	BUVUELAHJVGGLV-UHFFFAOYSA-N	-2	0	412.423	4.069	20	5		HIBDRL
CC[C@@H](C)Sc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)c(C)c1	ZINC000471137372	885679482	/nfs/dbraw/zinc/67/94/82/885679482.db2.gz	PJNIUXJBWAHQJN-GFCCVEGCSA-N	-2	0	424.500	4.293	20	5		HIBDRL
CC[C@H](C)Sc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)c(C)c1	ZINC000471137373	885679871	/nfs/dbraw/zinc/67/98/71/885679871.db2.gz	PJNIUXJBWAHQJN-LBPRGKRZSA-N	-2	0	424.500	4.293	20	5		HIBDRL