smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)NC(=N)NC(=[NH2+])N1c1cccc(CCCCc2ccc(S(=O)(=O)F)c(Cl)c2)c1	ZINC000043307596	563169441	/nfs/dbraw/zinc/16/94/41/563169441.db2.gz	CPIZNVKCRSRNEQ-UHFFFAOYSA-N	1	3	465.982	3.749	40	70		JHIBHO
CC1(C)NC(=N)NC(=[NH2+])N1c1cccc(CCCCc2ccc(Cl)c(S(=O)(=O)F)c2)c1	ZINC000043845607	563171174	/nfs/dbraw/zinc/17/11/74/563171174.db2.gz	FWXSKQKTXSXNAF-UHFFFAOYSA-N	1	3	465.982	3.749	40	70		JHIBHO
CC1(C)NC(=N)NC(=[NH2+])N1c1cccc(CCCCc2ccc(S(=O)(=O)F)cc2Cl)c1	ZINC000043307511	563169406	/nfs/dbraw/zinc/16/94/06/563169406.db2.gz	VOKDNZNHYBZQDV-UHFFFAOYSA-N	1	3	465.982	3.749	40	70		JHIBHO
CC1(C)NC(=N)NC(=[NH2+])N1c1ccc(CCCCCCc2ccc(S(=O)(=O)F)cc2)cc1	ZINC000043307579	563169357	/nfs/dbraw/zinc/16/93/57/563169357.db2.gz	VNYWLJDMMFVHSV-UHFFFAOYSA-N	1	3	459.591	3.876	40	70		JHIBHO