smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)OCCCNc1ccc(S(=O)(=O)N2CCOCC2)cc1NS(=O)(=O)c1cccc(C#N)c1	ZINC000514392545	1059385968	/nfs/dbraw/zinc/38/59/68/1059385968.db2.gz	XRIXBKKOWOINKG-UHFFFAOYSA-N	0	1	522.649	2.607	20	30		KFEDMN
CCCCN(C(=O)CN1CCCN(Cc2ccc(C#N)cc2)CC1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O	ZINC000514392779	1059383560	/nfs/dbraw/zinc/38/35/60/1059383560.db2.gz	BNTFDYCXGYZFMP-UHFFFAOYSA-N	0	1	543.672	2.792	20	30		KFEDMN
CCCCn1c(N)c(N(CC(C)C)C(=O)CCC(=O)N2CCCN(Cc3ccc(C#N)cc3)CC2)c(=O)[nH]c1=O	ZINC000514394617	1059398335	/nfs/dbraw/zinc/39/83/35/1059398335.db2.gz	PIROGHONHWCKPV-UHFFFAOYSA-N	0	1	551.692	2.707	20	30		KFEDMN
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCCN(Cc4ccc(C#N)cc4)CC3)CC2)c1	ZINC000514403406	1059372845	/nfs/dbraw/zinc/37/28/45/1059372845.db2.gz	UWSUPMQURNWUMR-UHFFFAOYSA-N	0	1	551.713	2.523	20	30		KFEDMN
CC(C)OCCCNc1ccc(S(=O)(=O)N2CCOCC2)cc1NS(=O)(=O)c1ccc(C#N)cc1	ZINC000514404535	1059420119	/nfs/dbraw/zinc/42/01/19/1059420119.db2.gz	GTMUMTSWKUJBOL-UHFFFAOYSA-N	0	1	522.649	2.607	20	30		KFEDMN