smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(S(=O)(=O)Nc2ncc3[nH]c4ccccc4n32)c([S-])cc1Cl	ZINC000005889045	204155783	/nfs/dbraw/zinc/15/57/83/204155783.db2.gz	PZPKZGOUEZNQNG-UHFFFAOYSA-N	-1	2	392.893	2.983	1	0		GFAFLM
COc1c2ccoc2c(NS(=O)(=O)c2ccc(C)cc2)c(O)c1C(=O)[O-]	ZINC000064527842	222072478	/nfs/dbraw/zinc/07/24/78/222072478.db2.gz	ZPMRUJAOQRGOOB-UHFFFAOYSA-N	-1	2	377.374	2.954	1	0		GFAFLM
COc1ccc(S(=O)(=O)N(Cc2ccc(F)nc2)[C@@H](C(=O)[O-])C(C)C)cc1	ZINC000028865165	221685892	/nfs/dbraw/zinc/68/58/92/221685892.db2.gz	JOIDQCSRISGBOH-QGZVFWFLSA-N	-1	2	396.440	2.529	1	0		GFAFLM
O=S(=O)(c1sc([O-])nc1O)c1cccc2c(Br)cccc21	ZINC000029214367	207358139	/nfs/dbraw/zinc/35/81/39/207358139.db2.gz	NHGDNRXYCKECLZ-GFCCVEGCSA-N	-1	2	386.248	2.685	1	0		GFAFLM
O=S(=O)(c1sc(O)nc1[O-])c1cccc2c(Br)cccc21	ZINC000029214367	207358144	/nfs/dbraw/zinc/35/81/44/207358144.db2.gz	NHGDNRXYCKECLZ-GFCCVEGCSA-N	-1	2	386.248	2.685	1	0		GFAFLM
CS(=O)(=O)[N-]c1ccccc1S(=O)(=O)Nc1cccc2c(Cl)c[nH]c21	ZINC000027213967	207323514	/nfs/dbraw/zinc/32/35/14/207323514.db2.gz	LPTNTAAXZTVFRG-UHFFFAOYSA-N	-1	2	399.881	2.994	1	0		GFAFLM
O=S(=O)(c1sc([O-])nc1O)c1ccc2ccccc2c1Br	ZINC000029215630	207357581	/nfs/dbraw/zinc/35/75/81/207357581.db2.gz	HGYCRWNWEDNOBN-GFCCVEGCSA-N	-1	2	386.248	2.685	1	0		GFAFLM
O=S(=O)(c1sc(O)nc1[O-])c1ccc2ccccc2c1Br	ZINC000029215630	207357587	/nfs/dbraw/zinc/35/75/87/207357587.db2.gz	HGYCRWNWEDNOBN-GFCCVEGCSA-N	-1	2	386.248	2.685	1	0		GFAFLM
Cc1cn(CCCCCCCCCC(F)(F)[P@](=O)([O-])O)c(=O)[nH]c1=O	ZINC000084652977	211172879	/nfs/dbraw/zinc/17/28/79/211172879.db2.gz	WEWRBVLYCZRBSR-UHFFFAOYSA-N	-1	2	382.344	2.736	1	0		GFAFLM
Cc1cn(CCCCCCCCCC(F)(F)[P@@](=O)([O-])O)c(=O)[nH]c1=O	ZINC000084652977	211172873	/nfs/dbraw/zinc/17/28/73/211172873.db2.gz	WEWRBVLYCZRBSR-UHFFFAOYSA-N	-1	2	382.344	2.736	1	0		GFAFLM
CCNC(=O)C1=C(C)N(CC)C(C(=O)[O-])=C(C(=O)O)[C@@H]1c1ccccc1Cl	ZINC000013553489	221272831	/nfs/dbraw/zinc/27/28/31/221272831.db2.gz	LXKAQMWETQWIPQ-CQSZACIVSA-N	-1	2	392.839	2.593	1	0		GFAFLM
CCNC(=O)C1=C(C)N(CC)C(C(=O)[O-])=C(C(=O)O)[C@H]1c1ccccc1Cl	ZINC000013553490	221273631	/nfs/dbraw/zinc/27/36/31/221273631.db2.gz	LXKAQMWETQWIPQ-AWEZNQCLSA-N	-1	2	392.839	2.593	1	0		GFAFLM