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@@H](c1nnc(SCC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccco2)n1-c1ccc(OC)cc1)[NH+](C)C	ZINC000514301390	1066424964	/nfs/dbraw/zinc/42/49/64/1066424964.db2.gz	ZFWDXWYADQWOFX-DEOSSOPVSA-N	1	1	547.685	4.951	20	30		KJEDMO
CC[C@H](c1nnc(SCC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccco2)n1-c1ccc(OC)cc1)[NH+](C)C	ZINC000514301391	1066424880	/nfs/dbraw/zinc/42/48/80/1066424880.db2.gz	ZFWDXWYADQWOFX-XMMPIXPASA-N	1	1	547.685	4.951	20	30		KJEDMO
O=C(C=CC(=O)c1ccccc1)NC1(Cc2ccc(Cl)cc2)CCN(c2[nH+]cnc3[nH]ccc32)CC1	ZINC001144713965	1066507832	/nfs/dbraw/zinc/50/78/32/1066507832.db2.gz	FQMLKPLLHBAKCJ-ZHACJKMWSA-N	1	1	500.002	4.748	20	30		KJEDMO