smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CO[C@@H]1C[C@](C)(O)Cc2cc3c(c([O-])c21)C(=O)c1c(O)cc2c(c1C3=O)O[C@@H]1O[C@@]2(C)[C@H](O)[C@@H](N(C)C)[C@@H]1O	ZINC000004216845	561694505	/nfs/dbraw/zinc/69/45/05/561694505.db2.gz	LWYJUZBXGAFFLP-OCNCTQISSA-N	-1	1	541.553	0.874	10	10	in-man	KCCEMM