smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC1=CC[C@]2([N+](=O)[O-])C[N@H+](CCO)C[C@@]1([N+](=O)[O-])C2	ZINC000020477973	292150827	/nfs/dbraw/zinc/15/08/27/292150827.db2.gz	VRXYKYLSCIYEGS-MNOVXSKESA-N	1	2	287.272	-0.351	2	5		CBBFLO
COC1=CC[C@]2([N+](=O)[O-])C[N@@H+](CCO)C[C@@]1([N+](=O)[O-])C2	ZINC000020477973	292150828	/nfs/dbraw/zinc/15/08/28/292150828.db2.gz	VRXYKYLSCIYEGS-MNOVXSKESA-N	1	2	287.272	-0.351	2	5		CBBFLO
Cc1ncc([N+](=O)[O-])n1CC[NH2+]Cc1no[n+]([O-])c1C	ZINC000040421279	174257813	/nfs/dbraw/zinc/25/78/13/174257813.db2.gz	JFJZMJCPWYJLFS-UHFFFAOYSA-N	1	2	282.260	-0.181	1	5		CBBFLO
COC1=CC[C@@]2([N+](=O)[O-])C[N@H+](CCO)C[C@]1([N+](=O)[O-])C2	ZINC000033892030	292150920	/nfs/dbraw/zinc/15/09/20/292150920.db2.gz	VRXYKYLSCIYEGS-WDEREUQCSA-N	1	2	287.272	-0.351	2	5		CBBFLO
COC1=CC[C@@]2([N+](=O)[O-])C[N@@H+](CCO)C[C@]1([N+](=O)[O-])C2	ZINC000033892030	292150922	/nfs/dbraw/zinc/15/09/22/292150922.db2.gz	VRXYKYLSCIYEGS-WDEREUQCSA-N	1	2	287.272	-0.351	2	5		CBBFLO