smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+]1CCN(c2cccc(N3CCC[C@@]4(C3)COCCN(c3cccc(C#N)c3)C4)[nH+]2)CC1	ZINC001165003163	722258763	/nfs/dbraw/zinc/25/87/63/722258763.db2.gz	CMMGQKKFDSLHBD-AREMUKBSSA-N	2	2	446.599	2.828	20	30		IFEDLP
C[NH+]1CCN(c2cccc(N3CCC[C@]4(C3)COCCN(c3cccc(C#N)c3)C4)[nH+]2)CC1	ZINC001165003164	722258747	/nfs/dbraw/zinc/25/87/47/722258747.db2.gz	CMMGQKKFDSLHBD-SANMLTNESA-N	2	2	446.599	2.828	20	30		IFEDLP
N#Cc1c2c(cnc1N1CCC3(CC1)COCC[N@H+]3Cc1ccc(F)cc1)C[NH2+]CCC2	ZINC001164671061	719493082	/nfs/dbraw/zinc/49/30/82/719493082.db2.gz	ZFSUDYMZOGHIJL-UHFFFAOYSA-N	2	2	435.547	3.000	20	30		IFEDLP
N#Cc1c2c(cnc1N1CCC3(CC1)COCC[N@@H+]3Cc1ccc(F)cc1)C[NH2+]CCC2	ZINC001164671061	719493084	/nfs/dbraw/zinc/49/30/84/719493084.db2.gz	ZFSUDYMZOGHIJL-UHFFFAOYSA-N	2	2	435.547	3.000	20	30		IFEDLP