smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+][C@@H]1C[C@H]([NH3+])CN(c2nc(Nc3ccc([N+](=O)[O-])cc3)nc(N3C[C@H]([NH3+])C[C@H]([NH3+])C3)n2)C1	ZINC000038320430	563097415	/nfs/dbraw/zinc/09/74/15/563097415.db2.gz	PYUHVUSBZOMJPW-KPWCQOOUSA-N	4	0	443.516	-0.747	1	5		IBBFRP
[NH3+][C@H](Cc1ccccc1)C(=O)NC[C@H](O)C(=O)NC[C@H]([NH3+])[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000072113838	563163632	/nfs/dbraw/zinc/16/36/32/563163632.db2.gz	KLDBPRMCEJJKCB-XWSJACJDSA-N	2	0	445.476	-0.881	1	5		IBBFRP
[NH3+][C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)NC[C@H]([NH3+])[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000072114105	563163605	/nfs/dbraw/zinc/16/36/05/563163605.db2.gz	PMHUDQFQCOGSDH-XWSJACJDSA-N	2	0	445.476	-0.881	1	5		IBBFRP