smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+][C@@H](Cn1cc([N+](=O)[O-])c(=O)[nH]c1=O)C(=O)[O-]	ZINC000001702710	357165174	/nfs/dbraw/zinc/16/51/74/357165174.db2.gz	IEBVITXSHAFLJR-VKHMYHEASA-N	0	1	244.163	-2.143	10	5	in-vitro	BABEMN
O=c1[nH]c(=O)n(CCO)cc1[N+](=O)[O-]	ZINC000035940156	360312796	/nfs/dbraw/zinc/31/27/96/360312796.db2.gz	QQKRHWSJVOEMNX-UHFFFAOYSA-N	0	1	201.138	-1.563	10	5		BABEMN
O=C(Cn1cnc([N+](=O)[O-])n1)N1CCNCC1	ZINC000043403901	182073057	/nfs/dbraw/zinc/07/30/57/182073057.db2.gz	SUGKCWLKQOBPIT-UHFFFAOYSA-N	0	1	240.223	-1.382	10	5		BABEMN
CNC(=O)Cn1cc([N+](=O)[O-])c(=O)[nH]c1=O	ZINC000104287274	173283973	/nfs/dbraw/zinc/28/39/73/173283973.db2.gz	XXEGINQSTQNGHG-UHFFFAOYSA-N	0	1	228.164	-1.809	10	5		BABEMN
CN1C[C@@H](O)n2c1c([N+](=O)[O-])c(=O)[nH]c2=O	ZINC000584658690	385772183	/nfs/dbraw/zinc/77/21/83/385772183.db2.gz	KHHXZYFZRWCQTJ-GSVOUGTGSA-N	0	1	228.164	-1.202	10	5		BABEMN
CN1C[C@H](O)n2c1c([N+](=O)[O-])c(=O)[nH]c2=O	ZINC000584658691	385770979	/nfs/dbraw/zinc/77/09/79/385770979.db2.gz	KHHXZYFZRWCQTJ-VKHMYHEASA-N	0	1	228.164	-1.202	10	5		BABEMN