smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H](C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)N1CCC[N@H+](Cc2ccc(C#N)cc2)CC1	ZINC000514303029	1066268003	/nfs/dbraw/zinc/26/80/03/1066268003.db2.gz	JGBDXPZUOZDNNQ-NRFANRHFSA-N	1	0	511.648	2.114	20	30		KEEDRO
C[C@H](C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)N1CCC[N@H+](Cc2ccc(C#N)cc2)CC1	ZINC000514303030	1066267929	/nfs/dbraw/zinc/26/79/29/1066267929.db2.gz	JGBDXPZUOZDNNQ-OAQYLSRUSA-N	1	0	511.648	2.114	20	30		KEEDRO
C=CCn1c(CC[NH+]2CCCCC2)nnc1SCC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000514391475	1066323509	/nfs/dbraw/zinc/32/35/09/1066323509.db2.gz	KVCXVVXRBYQBFQ-UHFFFAOYSA-N	1	0	532.736	2.259	20	30		KEEDRO
C=CCN1CC(=O)N2[C@@H](Cc3ccc(O)cc3F)C(=O)N(Cc3cccc(N4CC(N5CC[NH+](CC)CC5)C4)n3)C[C@@H]2N1C(=O)NCc1ccccc1	ZINC001250305025	1066428103	/nfs/dbraw/zinc/42/81/03/1066428103.db2.gz	ZGNKNLOBYFTGRG-GIWKVKTRSA-N	1	0	725.870	2.489	20	30		KEEDRO