smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N@@H+]1C[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000169356981	173198282	/nfs/dbraw/zinc/19/82/82/173198282.db2.gz	PRWWOGQHZCSEBR-MNOVXSKESA-N	1	1	247.254	1.259	1	5		BDBFMO
C[N@H+]1C[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000169356981	173198284	/nfs/dbraw/zinc/19/82/84/173198284.db2.gz	PRWWOGQHZCSEBR-MNOVXSKESA-N	1	1	247.254	1.259	1	5		BDBFMO
C[N@H+]1CCC[C@H]1COc1cncc([N+](=O)[O-])c1	ZINC000026569851	173055668	/nfs/dbraw/zinc/05/56/68/173055668.db2.gz	CYXFUNSRJZCZJC-VIFPVBQESA-N	1	1	237.259	1.463	1	5		BDBFMO
Cc1cc(OCc2ncc([N+](=O)[O-])n2C)cc[nH+]1	ZINC000066073951	178213755	/nfs/dbraw/zinc/21/37/55/178213755.db2.gz	QZBDPYHJWYXFIN-UHFFFAOYSA-N	1	1	248.242	1.611	1	5		BDBFMO
C[N@@H+]1C[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000073166720	173199195	/nfs/dbraw/zinc/19/91/95/173199195.db2.gz	PRWWOGQHZCSEBR-GHMZBOCLSA-N	1	1	247.254	1.259	1	5		BDBFMO
C[N@H+]1C[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000073166720	173199198	/nfs/dbraw/zinc/19/91/98/173199198.db2.gz	PRWWOGQHZCSEBR-GHMZBOCLSA-N	1	1	247.254	1.259	1	5		BDBFMO
C[N@H+]1CCC[C@H]1COc1cccnc1[N+](=O)[O-]	ZINC000026570332	173057368	/nfs/dbraw/zinc/05/73/68/173057368.db2.gz	LSUGHUYGLJQRQT-VIFPVBQESA-N	1	1	237.259	1.463	1	5		BDBFMO