smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#Cc1c2c(cnc1N1CCO[C@@]3(C1)COCC[N@H+](Cc1cccnc1)C3)C[NH2+]CCC2	ZINC001164911007	721768482	/nfs/dbraw/zinc/76/84/82/721768482.db2.gz	DEFRLTBQPMBLKV-DEOSSOPVSA-N	2	2	434.544	1.492	20	30		IDEDLP
N#Cc1c2c(cnc1N1CCO[C@@]3(C1)COCC[N@@H+](Cc1cccnc1)C3)C[NH2+]CCC2	ZINC001164911007	721768486	/nfs/dbraw/zinc/76/84/86/721768486.db2.gz	DEFRLTBQPMBLKV-DEOSSOPVSA-N	2	2	434.544	1.492	20	30		IDEDLP
N#Cc1c2c(cnc1N1CCC3(CC1)C(=O)NCC[N@@H+]3Cc1ccccc1)C[NH2+]CCC2	ZINC001164948817	721968813	/nfs/dbraw/zinc/96/88/13/721968813.db2.gz	VOQONHQEAJONPG-UHFFFAOYSA-N	2	2	430.556	1.960	20	30		IDEDLP
N#Cc1c2c(cnc1N1CCC3(CC1)C(=O)NCC[N@H+]3Cc1ccccc1)C[NH2+]CCC2	ZINC001164948817	721968815	/nfs/dbraw/zinc/96/88/15/721968815.db2.gz	VOQONHQEAJONPG-UHFFFAOYSA-N	2	2	430.556	1.960	20	30		IDEDLP
N#Cc1c2c(cnc1N1CCO[C@]3(C1)COCC[N@H+](Cc1cccnc1)C3)C[NH2+]CCC2	ZINC001164911038	721768287	/nfs/dbraw/zinc/76/82/87/721768287.db2.gz	DEFRLTBQPMBLKV-XMMPIXPASA-N	2	2	434.544	1.492	20	30		IDEDLP
N#Cc1c2c(cnc1N1CCO[C@]3(C1)COCC[N@@H+](Cc1cccnc1)C3)C[NH2+]CCC2	ZINC001164911038	721768293	/nfs/dbraw/zinc/76/82/93/721768293.db2.gz	DEFRLTBQPMBLKV-XMMPIXPASA-N	2	2	434.544	1.492	20	30		IDEDLP