smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(NC[C@H]2C[NH2+]CCO2)c2cc([N+](=O)[O-])ccc2n1	ZINC000262390154	407821937	/nfs/dbraw/zinc/82/19/37/407821937.db2.gz	ZRDJKUWMIQRKEP-GFCCVEGCSA-N	1	3	302.334	1.852	10	5		DDBEHO
Cc1cc(NC[C@@H]2C[NH2+]CCO2)c2cc([N+](=O)[O-])ccc2n1	ZINC000262390156	407822431	/nfs/dbraw/zinc/82/24/31/407822431.db2.gz	ZRDJKUWMIQRKEP-LBPRGKRZSA-N	1	3	302.334	1.852	10	5		DDBEHO
O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1NC[C@H]1C[NH2+]C[C@H]1O	ZINC000263283924	408090520	/nfs/dbraw/zinc/09/05/20/408090520.db2.gz	USSCJXMNOMONHS-PWXKEOIMSA-N	1	3	319.405	1.476	10	5		DDBEHO
O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1NC[C@@H]1C[NH2+]C[C@@H]1O	ZINC000263283925	408091536	/nfs/dbraw/zinc/09/15/36/408091536.db2.gz	USSCJXMNOMONHS-QEWYBTABSA-N	1	3	319.405	1.476	10	5		DDBEHO
O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1NC[C@H]1C[NH2+]C[C@@H]1O	ZINC000263283922	408090284	/nfs/dbraw/zinc/09/02/84/408090284.db2.gz	USSCJXMNOMONHS-GUSZCTEKSA-N	1	3	319.405	1.476	10	5		DDBEHO
O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1NC[C@@H]1C[NH2+]C[C@H]1O	ZINC000263283923	408091071	/nfs/dbraw/zinc/09/10/71/408091071.db2.gz	USSCJXMNOMONHS-NZUILWFCSA-N	1	3	319.405	1.476	10	5		DDBEHO