smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(N2CCN(CCCNC(=O)CCc3nnc4n3c3ccccc3c(=O)n4Cc3ccccc3Cl)CC2)cc1	ZINC000101532442	554795021	/nfs/dbraw/zinc/79/50/21/554795021.db2.gz	SYKABAZGIMJKES-UHFFFAOYSA-N	0	1	614.150	4.016	10	10		KICEMN
CCOC(=O)[C@H](C(=O)C(=O)Nc1c(C)cccc1C(C)C)c1nc2ccc3c(c2[nH]c1=O)C(=O)c1ccccc1C3=O	ZINC000104722460	571385694	/nfs/dbraw/zinc/38/56/94/571385694.db2.gz	CQTWPQSVTJSNOR-QHCPKHFHSA-N	0	1	565.582	4.397	10	10		KICEMN
CCOC(=O)C(C(=O)C(=O)Nc1c(C)cccc1C(C)C)c1nc2ccc3c(c2[nH]c1=O)C(=O)c1ccccc1C3=O	ZINC000104722460	571385693	/nfs/dbraw/zinc/38/56/93/571385693.db2.gz	CQTWPQSVTJSNOR-QHCPKHFHSA-N	0	1	565.582	4.397	10	10		KICEMN
CCOC(=O)[C@@H](C(=O)C(=O)Nc1c(C)cccc1C(C)C)c1nc2ccc3c(c2[nH]c1=O)C(=O)c1ccccc1C3=O	ZINC000104722465	571385679	/nfs/dbraw/zinc/38/56/79/571385679.db2.gz	CQTWPQSVTJSNOR-HSZRJFAPSA-N	0	1	565.582	4.397	10	10		KICEMN
CCOC(=O)C(C(=O)C(=O)Nc1c(C)cccc1C(C)C)c1nc2ccc3c(c2[nH]c1=O)C(=O)c1ccccc1C3=O	ZINC000104722465	571385678	/nfs/dbraw/zinc/38/56/78/571385678.db2.gz	CQTWPQSVTJSNOR-HSZRJFAPSA-N	0	1	565.582	4.397	10	10		KICEMN