smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1cc([N+](=O)[O-])c(N2CC[NH+](CCO)CC2)cc1N1CC[NH+](CCO)CC1	ZINC000033447240	559193519	/nfs/dbraw/zinc/19/35/19/559193519.db2.gz	XKFDCOXBOSLLBY-UHFFFAOYSA-N	2	2	424.458	-0.268	40	5		HBBBLP
COC[C@H](O)C[NH+]1CCN(c2ccc([N+](=O)[O-])c(N3CC[NH+](CCO)CC3)c2)CC1	ZINC000059463841	568955588	/nfs/dbraw/zinc/95/55/88/568955588.db2.gz	CFELMXURISKLJZ-GOSISDBHSA-N	2	2	423.514	-0.162	40	5		HBBBLP
COC[C@@H](O)C[NH+]1CCN(c2ccc([N+](=O)[O-])c(N3CC[NH+](CCO)CC3)c2)CC1	ZINC000059463842	568955567	/nfs/dbraw/zinc/95/55/67/568955567.db2.gz	CFELMXURISKLJZ-SFHVURJKSA-N	2	2	423.514	-0.162	40	5		HBBBLP