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-])c1cc(C(c2ccc(O)c(C(=O)[O-])c2)[C@@H]2C=CC(=O)C(C(=O)[O-])=C2)ccc1O	ZINC000031297648	526345241	/nfs/dbraw/zinc/34/52/41/526345241.db2.gz	YETAHXYTPZCNBG-SNVBAGLBSA-N	-3	0	424.361	2.392	3	30	in-vitro	HEEFRL
O=C(NCCS)/C(Cc1cc(Br)c([O-])c(Br)c1)=N/[O-]	ZINC000044091397	1060224182	/nfs/dbraw/zinc/22/41/82/1060224182.db2.gz	AHMDLJINAVKCDM-OQLLNIDSSA-N	-2	0	412.103	2.336	1	30		HEEFRL
O=C([O-])c1cc(C(c2ccc(O)c(C(=O)[O-])c2)[C@H]2C=CC(=O)C(C(=O)[O-])=C2)ccc1O	ZINC000100175698	526345121	/nfs/dbraw/zinc/34/51/21/526345121.db2.gz	YETAHXYTPZCNBG-JTQLQIEISA-N	-3	0	424.361	2.392	3	30	in-vitro	HEEFRL