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[NH2+][C@H](Cc1ccc([N+](=O)[O-])cc1)CN1CCN(CC(=O)[O-])CCN(CC(=O)[O-])CC1	ZINC000029052447	563093131	/nfs/dbraw/zinc/09/31/31/563093131.db2.gz	JYJZZHRVSXWCFL-QGZVFWFLSA-N	-2	3	481.506	-0.731	1	5		JBBFHL
O=C([O-])C[NH2+][C@@H](Cc1ccc([N+](=O)[O-])cc1)CN1CCN(CC(=O)[O-])CCN(CC(=O)[O-])CC1	ZINC000029052452	563093100	/nfs/dbraw/zinc/09/31/00/563093100.db2.gz	JYJZZHRVSXWCFL-KRWDZBQOSA-N	-2	3	481.506	-0.731	1	5		JBBFHL
O=C([O-])CN(CCN1CCN(CC(=O)[O-])CC[N@@H+](CC(=O)[O-])CC1)Cc1ccc([N+](=O)[O-])cc1	ZINC000029055275	563093564	/nfs/dbraw/zinc/09/35/64/563093564.db2.gz	VXDKCXVAZVKBOZ-UHFFFAOYSA-N	-2	3	481.506	-0.430	1	5		JBBFHL
O=C([O-])CN(CCN1CCN(CC(=O)[O-])CC[N@H+](CC(=O)[O-])CC1)Cc1ccc([N+](=O)[O-])cc1	ZINC000029055275	563093562	/nfs/dbraw/zinc/09/35/62/563093562.db2.gz	VXDKCXVAZVKBOZ-UHFFFAOYSA-N	-2	3	481.506	-0.430	1	5		JBBFHL