smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Clc1ccc(CN2CC[N+]3(CC2)CC[N+]2(CCN(Cc4ccc(Cl)cc4)CC2)CC3)cc1	ZINC000067350922	569688426	/nfs/dbraw/zinc/68/84/26/569688426.db2.gz	SJUIGIXGRFHMFN-UHFFFAOYSA-N	2	0	475.508	3.972	50	5		JHBARP
COC(=O)C1CC[NH+](Cc2ccc(OCCC[NH+]3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc2)CC1	ZINC000008762111	554661669	/nfs/dbraw/zinc/66/16/69/554661669.db2.gz	XYFRLVLKALKQQZ-UHFFFAOYSA-N	2	0	496.608	3.571	50	5		JHBARP
Cc1ccc(C(=O)NCC[NH+]2CCCC2)c(C2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)n1	ZINC000034725528	569652845	/nfs/dbraw/zinc/65/28/45/569652845.db2.gz	QCXAYXUPWHZVBG-UHFFFAOYSA-N	2	0	451.571	3.503	50	5		JHBARP
O=[N+]([O-])c1ccc(-[n+]2ccc(-c3cc[n+](-c4ccc([N+](=O)[O-])cc4[N+](=O)[O-])cc3)cc2)c([N+](=O)[O-])c1	ZINC000049775610	563203542	/nfs/dbraw/zinc/20/35/42/563203542.db2.gz	UVCIVGWTJICGFA-UHFFFAOYSA-N	2	0	490.388	3.540	50	5		JHBARP