smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CSc1nc(OC(=O)[C@H](O)COP(=O)([O-])[O-])c([N+](=O)[O-])c(=O)[nH]1	ZINC001227627269	845856319	/nfs/dbraw/zinc/85/63/19/845856319.db2.gz	FDUGEHYMDGPIOH-GSVOUGTGSA-N	-2	2	371.220	-0.812	20	5		FBBDLL
O=C([O-])C[C@H](C(=O)Oc1ncc([N+](=O)[O-])c2[nH]cnc21)[C@@H](O)C(=O)[O-]	ZINC001227692181	845857014	/nfs/dbraw/zinc/85/70/14/845857014.db2.gz	VMOWPBMXWKRNAS-AJAUBTJJSA-N	-2	2	354.231	-0.692	20	5		FBBDLL
O=C([O-])C[C@@H](C(=O)Oc1ncc([N+](=O)[O-])c2[nH]cnc21)[C@@H](O)C(=O)[O-]	ZINC001227692182	845856974	/nfs/dbraw/zinc/85/69/74/845856974.db2.gz	VMOWPBMXWKRNAS-ALFREKQPSA-N	-2	2	354.231	-0.692	20	5		FBBDLL
O=C([O-])C[C@H](C(=O)Oc1ncc([N+](=O)[O-])c2[nH]cnc21)[C@H](O)C(=O)[O-]	ZINC001227692183	845857305	/nfs/dbraw/zinc/85/73/05/845857305.db2.gz	VMOWPBMXWKRNAS-IGJIYHIXSA-N	-2	2	354.231	-0.692	20	5		FBBDLL
O=C([O-])C[C@@H](C(=O)Oc1ncc([N+](=O)[O-])c2[nH]cnc21)[C@H](O)C(=O)[O-]	ZINC001227692184	845857456	/nfs/dbraw/zinc/85/74/56/845857456.db2.gz	VMOWPBMXWKRNAS-MOFOKWOHSA-N	-2	2	354.231	-0.692	20	5		FBBDLL