smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=P(N=P([O-])([O-])[O-])(Oc1ccc(Br)cc1)Oc1ccc(Br)cc1	ZINC000003172388	194234395	/nfs/dbraw/zinc/23/43/95/194234395.db2.gz	IRRGJZLDVBAPIA-UHFFFAOYSA-N	-3	3	486.977	4.460	10	0		JIAEHL
COc1c(C)c(O)c(Cc2c([O-])c(C=O)c([O-])c(C(=O)CC(C)C)c2[O-])c(O)c1C(=O)C(C)C	ZINC000004098456	560195697	/nfs/dbraw/zinc/19/56/97/560195697.db2.gz	VQIUVVRPDIFIPV-UHFFFAOYSA-N	-3	3	474.506	4.002	10	0	biogenic,in-vitro	JIAEHL
O=C([O-])c1ccc2c(c1)[C@H](SCC[N-]S(=O)(=O)c1cccs1)c1ccccc1CO2	ZINC000003790708	562928161	/nfs/dbraw/zinc/92/81/61/562928161.db2.gz	FWAIMJFFTBLKLA-HXUWFJFHSA-N	-2	3	461.586	4.140	10	0		JIAEHL
Cc1noc(C)c1CCN(C)c1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1C(=O)[O-]	ZINC000021883421	526488860	/nfs/dbraw/zinc/48/88/60/526488860.db2.gz	UFLLZCGJQCPYOR-UHFFFAOYSA-N	-2	3	457.552	4.086	10	0		JIAEHL
O=C([O-])c1ccc2c(c1)[C@@H](SCC[N-]S(=O)(=O)c1cccs1)c1ccccc1CO2	ZINC000002022174	562924636	/nfs/dbraw/zinc/92/46/36/562924636.db2.gz	FWAIMJFFTBLKLA-FQEVSTJZSA-N	-2	3	461.586	4.140	10	0		JIAEHL