smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N[C@H](Cc1ccccc1)C(=O)NC[C@H](O)C(=O)NC[C@H]([NH3+])[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000072113838	563163636	/nfs/dbraw/zinc/16/36/36/563163636.db2.gz	KLDBPRMCEJJKCB-XWSJACJDSA-N	1	3	445.476	-0.881	1	5		IBBFHO