smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CNC(=[NH2+])c1ccc(NC(=N)c2cccc(C(=N)Nc3ccc(C(=[NH2+])NC)cc3)c2)cc1	ZINC000008626476	556193602	/nfs/dbraw/zinc/19/36/02/556193602.db2.gz	VTGCXWBEYAILBI-UHFFFAOYSA-N	2	3	426.528	3.651	40	0		IHABHP
CNC(=[NH2+])c1ccc(NC(=N)c2ccc(C(=N)Nc3ccc(C(=[NH2+])NC)cc3)cc2)cc1	ZINC000004214810	555976757	/nfs/dbraw/zinc/97/67/57/555976757.db2.gz	VQQQRERMPYGZGF-UHFFFAOYSA-N	2	3	426.528	3.651	40	0		IHABHP
CNC(=[NH2+])c1ccc(NC(=N)c2ccc(C(=[NH2+])Nc3ccc(C(=[NH2+])NC)cc3)cc2)cc1	ZINC000004214810	555976759	/nfs/dbraw/zinc/97/67/59/555976759.db2.gz	VQQQRERMPYGZGF-UHFFFAOYSA-N	3	3	426.528	3.651	40	0		IHABHP