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[NH+](CC(=O)[O-])[C@@H](CCCCNC(=O)CCCCCCCCCCCS)C(=O)[O-]	ZINC000044069000	527605054	/nfs/dbraw/zinc/60/50/54/527605054.db2.gz	DFNBCRSGLOPDAH-SFHVURJKSA-N	-2	2	476.636	3.028	50	30		JGEALL