smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1csc(C(=O)[N-]c2nnc([N-]S(=O)(=O)c3ccccc3)s2)c1Br	ZINC001306387868	1068822020	/nfs/dbraw/zinc/82/20/20/1068822020.db2.gz	JAEGKXNCCOVKFQ-UHFFFAOYSA-N	-2	3	459.372	3.724	20	0		JHADHL
O=C(Nc1ccc(F)cc1[O-])c1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	ZINC001306800091	1069604831	/nfs/dbraw/zinc/60/48/31/1069604831.db2.gz	VOTHAMKIWRAQGH-UHFFFAOYSA-N	-2	3	458.467	3.746	20	0		JHADHL
C[N-]S(=O)(=O)c1cc(C(=O)[N-]c2nc(-c3cccc(Oc4ccccc4)c3)ns2)co1	ZINC001306599854	1069275586	/nfs/dbraw/zinc/27/55/86/1069275586.db2.gz	DUEINMWRANYZCJ-UHFFFAOYSA-N	-2	3	456.505	3.751	20	0		JHADHL
O=C([N-]CC[C@H]1CN(C(=O)c2ccc(Br)c([O-])c2)c2ccccc21)C(F)(F)F	ZINC001306887753	1069674581	/nfs/dbraw/zinc/67/45/81/1069674581.db2.gz	MKXZMUVSDDDUND-LBPRGKRZSA-N	-2	3	457.246	3.967	20	0		JHADHL
O=C([N-]CC[C@@H]1CN(C(=O)c2ccc(Br)c([O-])c2)c2ccccc21)C(F)(F)F	ZINC001306887750	1069674538	/nfs/dbraw/zinc/67/45/38/1069674538.db2.gz	MKXZMUVSDDDUND-GFCCVEGCSA-N	-2	3	457.246	3.967	20	0		JHADHL
COc1cnc(C2([N-]S(=O)(=O)c3c(Cl)cccc3C(F)(F)F)CCCC2)[n-]c1=O	ZINC001309897804	1071008633	/nfs/dbraw/zinc/00/86/33/1071008633.db2.gz	MOQUODYDRXXCNK-UHFFFAOYSA-N	-2	3	451.854	3.611	20	0		JHADHL
O=C(Nc1cc(Cl)ccc1[O-])C1CCN(C(=O)c2nn(-c3cccc(F)c3)cc2[O-])CC1	ZINC001306817308	1069638818	/nfs/dbraw/zinc/63/88/18/1069638818.db2.gz	HQCHLZTWAMTYKT-UHFFFAOYSA-N	-2	3	458.877	3.567	20	0		JHADHL