smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1ccc([C@H]2C[N@H+]3CCC[C@H]3c3ccccc32)cc1	ZINC000028090006	171547060	/nfs/dbraw/zinc/54/70/60/171547060.db2.gz	NEBIUZBZGRZRHR-MSOLQXFVSA-N	1	1	294.354	3.877	1	5		CHBFMO
C[C@@]12C[C@@H](CC(C)(C)C1)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2	ZINC000000214312	567924915	/nfs/dbraw/zinc/92/49/15/567924915.db2.gz	GQOSNBDGQBEHJN-NVXWUHKLSA-N	1	1	288.391	3.995	1	5		CHBFMO
C[C@]12C[C@H](CC(C)(C)C1)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2	ZINC000003680977	567017382	/nfs/dbraw/zinc/01/73/82/567017382.db2.gz	GQOSNBDGQBEHJN-RDJZCZTQSA-N	1	1	288.391	3.995	1	5		CHBFMO
O=[N+]([O-])c1ccc(-c2c[nH]c(NC3CCCCC3)[nH+]2)cc1	ZINC000072108574	176317172	/nfs/dbraw/zinc/31/71/72/176317172.db2.gz	CUGBHZWMIYIUHT-UHFFFAOYSA-N	1	1	286.335	3.730	1	5		CHBFMO
O=[N+]([O-])c1cccc(-c2c[nH]c(NC3CCCCC3)[nH+]2)c1	ZINC000072113328	176318311	/nfs/dbraw/zinc/31/83/11/176318311.db2.gz	HRTDBBFNZHSDFB-UHFFFAOYSA-N	1	1	286.335	3.730	1	5		CHBFMO