smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H](O)[C@H](O)[C@H](O)C(=O)[O-]	ZINC000004096005	560193749	/nfs/dbraw/zinc/19/37/49/560193749.db2.gz	OMIXKOJEIRRAJW-CDEBNWADSA-N	-2	0	372.282	-1.725	10	10	in-vitro	FACERL
O=S(=O)([O-])c1cc(S(=O)(=O)[O-])c(S(=O)(=O)[O-])c(O)c1O	ZINC000031476231	210245481	/nfs/dbraw/zinc/24/54/81/210245481.db2.gz	QTFFUUQJZHEORK-UHFFFAOYSA-N	-3	0	350.304	-1.162	10	10		FACERL