smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=c1[n-]c(=O)n2c(c1[N+](=O)[O-])N[C@H]([C@@H](O)[C@@H](O)[C@@H](O)CO)[C@@H]2O	ZINC000008384268	375230208	/nfs/dbraw/zinc/23/02/08/375230208.db2.gz	ZQCHWTXEFJUFAA-OWBUZKCFSA-N	-1	0	334.241	-4.195	50	5		EABARM
O=c1[n-]c(=O)n2c(c1[N+](=O)[O-])N[C@H]([C@@H](O)[C@@H](O)[C@H](O)CO)[C@@H]2O	ZINC000008384270	210944427	/nfs/dbraw/zinc/94/44/27/210944427.db2.gz	ZQCHWTXEFJUFAA-NKZDCWSFSA-N	-1	0	334.241	-4.195	50	5		EABARM
O=c1[n-]c(=O)n2c(c1[N+](=O)[O-])N[C@H]([C@@H](O)[C@H](O)[C@@H](O)CO)[C@@H]2O	ZINC000008384271	375230950	/nfs/dbraw/zinc/23/09/50/375230950.db2.gz	ZQCHWTXEFJUFAA-AYJSBNPASA-N	-1	0	334.241	-4.195	50	5		EABARM
O=c1[n-]c(=O)n2c(c1[N+](=O)[O-])N[C@H]([C@@H](O)[C@H](O)[C@H](O)CO)[C@@H]2O	ZINC000008384274	375229173	/nfs/dbraw/zinc/22/91/73/375229173.db2.gz	ZQCHWTXEFJUFAA-UMOARQHTSA-N	-1	0	334.241	-4.195	50	5		EABARM
O=c1[n-]c(=O)n2c(c1[N+](=O)[O-])N[C@@H]([C@H](O)[C@H](O)[C@H](O)CO)[C@H]2O	ZINC000017111797	374978083	/nfs/dbraw/zinc/97/80/83/374978083.db2.gz	ZQCHWTXEFJUFAA-NKWUJSBFSA-N	-1	0	334.241	-4.195	50	5		EABARM
O=c1[n-]c(=O)n2c(c1[N+](=O)[O-])N[C@@H]([C@H](O)[C@H](O)[C@@H](O)CO)[C@H]2O	ZINC000017111799	374979407	/nfs/dbraw/zinc/97/94/07/374979407.db2.gz	ZQCHWTXEFJUFAA-DSSZKMTFSA-N	-1	0	334.241	-4.195	50	5		EABARM
O=c1[n-]c(=O)n2c(c1[N+](=O)[O-])N[C@@H]([C@H](O)[C@@H](O)[C@H](O)CO)[C@H]2O	ZINC000017111801	374978742	/nfs/dbraw/zinc/97/87/42/374978742.db2.gz	ZQCHWTXEFJUFAA-KOOROYRDSA-N	-1	0	334.241	-4.195	50	5		EABARM
O=c1[n-]c(=O)n2c(c1[N+](=O)[O-])N[C@@H]([C@H](O)[C@@H](O)[C@@H](O)CO)[C@H]2O	ZINC000017111802	374978034	/nfs/dbraw/zinc/97/80/34/374978034.db2.gz	ZQCHWTXEFJUFAA-LGSMAPHPSA-N	-1	0	334.241	-4.195	50	5		EABARM
Cc1ncc([N+](=O)[O-])n1CCO[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O	ZINC000095908803	375200415	/nfs/dbraw/zinc/20/04/15/375200415.db2.gz	KOVNZSSTXZPVCG-GOVZDWNOSA-N	-1	0	347.280	-1.991	50	5		EABARM
O=C([O-])c1cc(N[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc([N+](=O)[O-])c1	ZINC000239378251	304226049	/nfs/dbraw/zinc/22/60/49/304226049.db2.gz	OMJDAMXBZQGOAP-CSYMLDBXSA-N	-1	0	344.276	-1.495	50	5		EABARM
O=C([O-])c1cc(N[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc([N+](=O)[O-])c1	ZINC000239378254	374935122	/nfs/dbraw/zinc/93/51/22/374935122.db2.gz	OMJDAMXBZQGOAP-IYKVGLELSA-N	-1	0	344.276	-1.495	50	5		EABARM
O=C([O-])c1cc(N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc([N+](=O)[O-])c1	ZINC000239378256	304226077	/nfs/dbraw/zinc/22/60/77/304226077.db2.gz	OMJDAMXBZQGOAP-WTPMCQDGSA-N	-1	0	344.276	-1.495	50	5		EABARM
O=C([O-])c1cc(N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc([N+](=O)[O-])c1	ZINC000239378258	374934984	/nfs/dbraw/zinc/93/49/84/374934984.db2.gz	OMJDAMXBZQGOAP-YBXAARCKSA-N	-1	0	344.276	-1.495	50	5		EABARM