smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1ccc(NC(=O)CC2S/C(=N\c3ccccc3)N(CCO)C2=O)cc1	ZINC000017085163	558816022	/nfs/dbraw/zinc/81/60/22/558816022.db2.gz	NVELQRSCTJTPSB-BLRPHQBRSA-N	-1	2	413.455	2.337	10	30		HEEELM
O=C([O-])c1ccc(NC(=O)C[C@H]2S/C(=N\c3ccccc3)N(CCO)C2=O)cc1	ZINC000017085163	558816024	/nfs/dbraw/zinc/81/60/24/558816024.db2.gz	NVELQRSCTJTPSB-BLRPHQBRSA-N	-1	2	413.455	2.337	10	30		HEEELM
O=C([O-])c1ccc(NC(=O)CC2S/C(=N\c3ccccc3)N(CCO)C2=O)cc1	ZINC000017085164	558816050	/nfs/dbraw/zinc/81/60/50/558816050.db2.gz	NVELQRSCTJTPSB-HZSHHLKBSA-N	-1	2	413.455	2.337	10	30		HEEELM
O=C([O-])c1ccc(NC(=O)C[C@@H]2S/C(=N\c3ccccc3)N(CCO)C2=O)cc1	ZINC000017085164	558816052	/nfs/dbraw/zinc/81/60/52/558816052.db2.gz	NVELQRSCTJTPSB-HZSHHLKBSA-N	-1	2	413.455	2.337	10	30		HEEELM