smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc([O-])c2c(c1)C(=O)c1cc3c(c([O-])c1C2=O)[C@H](O)[C@H](OC)[C@@](C)(O)[C@@H]3O	ZINC000005438288	560202136	/nfs/dbraw/zinc/20/21/36/560202136.db2.gz	GELQCQRLAMAWDN-WOZUAGRISA-N	-2	3	416.382	0.728	1	10	in-vitro	HCCFHL
COc1cc([O-])c2c(c1)C(=O)c1cc3c(c([O-])c1C2=O)[C@H](O)[C@H](OC)[C@](C)(O)[C@@H]3O	ZINC000005438290	560202121	/nfs/dbraw/zinc/20/21/21/560202121.db2.gz	GELQCQRLAMAWDN-JSXRDJHFSA-N	-2	3	416.382	0.728	1	10	in-vitro	HCCFHL
COc1cc([O-])c2c(c1)C(=O)c1cc3c(c([O-])c1C2=O)[C@H](O)[C@H](OC)[C@@](C)(O)[C@H]3O	ZINC000005438291	560202116	/nfs/dbraw/zinc/20/21/16/560202116.db2.gz	GELQCQRLAMAWDN-TUFLPTIASA-N	-2	3	416.382	0.728	1	10	in-vitro	HCCFHL
COc1cc([O-])c2c(c1)C(=O)c1cc3c(c([O-])c1C2=O)[C@H](O)[C@H](OC)[C@](C)(O)[C@H]3O	ZINC000005438292	560202159	/nfs/dbraw/zinc/20/21/59/560202159.db2.gz	GELQCQRLAMAWDN-XSDIEEQYSA-N	-2	3	416.382	0.728	1	10	in-vitro	HCCFHL
Cc1cc([O-])c2c(c1)C(=O)c1cc(O[C@H]3OC[C@](O)(CO)[C@@H]3O)cc([O-])c1C2=O	ZINC000014814260	291181754	/nfs/dbraw/zinc/18/17/54/291181754.db2.gz	AEQMIFRODRFTJF-VAMGGRTRSA-N	-2	3	402.355	0.001	1	10	biogenic,in-vitro	HCCFHL