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(=O)[O-])cc(S(=O)(=O)[N-]c2ccc([O-])c(Cl)c2)c1Br	ZINC000323010236	972707538	/nfs/dbraw/zinc/70/75/38/972707538.db2.gz	GCVNAGYFHAPFRO-UHFFFAOYSA-N	-3	3	420.668	3.616	20	10		HHCDHL
Cc1c(Br)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc([O-])c(Cl)c1	ZINC000323001732	972705628	/nfs/dbraw/zinc/70/56/28/972705628.db2.gz	DDLKGXYAMWSVCU-UHFFFAOYSA-N	-3	3	420.668	3.616	20	10		HHCDHL
Cc1cc(O)ccc1[N-]S(=O)(=O)c1cc(Br)c(Cl)c(C(=O)[O-])c1	ZINC000391515892	972841051	/nfs/dbraw/zinc/84/10/51/972841051.db2.gz	OLJAKHXEOUFSKR-UHFFFAOYSA-N	-2	3	420.668	3.616	20	10		HHCDHL
Cc1ccc(S(=O)(=O)[N-]c2ccc([N-]S(=O)(=O)c3cccs3)cc2)cc1	ZINC000014253387	962454139	/nfs/dbraw/zinc/45/41/39/962454139.db2.gz	JBUHMRBGYZILHE-UHFFFAOYSA-N	-2	3	408.526	3.658	20	10		HHCDHL
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc([O-])c(Cl)c2)cc1Br	ZINC000780397695	1074140485	/nfs/dbraw/zinc/14/04/85/1074140485.db2.gz	PAOUCNOYTACUGC-UHFFFAOYSA-N	-2	3	419.684	3.567	20	10		HHCDHL
Cc1c(Br)cc(S(=O)(=O)[N-]c2ccc([O-])c(Cl)c2)cc1C(=O)[O-]	ZINC000322866015	972704933	/nfs/dbraw/zinc/70/49/33/972704933.db2.gz	DRXNOLNAARBSKG-UHFFFAOYSA-N	-3	3	420.668	3.616	20	10		HHCDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]Cc2cc(Cl)cc(Cl)c2[O-])cc1F	ZINC001212054630	1071936589	/nfs/dbraw/zinc/93/65/89/1071936589.db2.gz	JTTVYLXJQOUJJJ-UHFFFAOYSA-N	-2	3	409.222	3.533	20	10		HHCDHL