smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc2c([O-])c3c(=O)c(OC)c(O)cc-3oc2cc1[O-]	ZINC000003782686	560189447	/nfs/dbraw/zinc/18/94/47/560189447.db2.gz	MEDZADGBRDMLGM-UHFFFAOYSA-N	-2	3	304.254	2.080	1	5	biogenic,in-vitro	DEBFHL
COc1cc2c(=O)c3c(O)c(OC)c([O-])cc3oc2cc1[O-]	ZINC000003782686	560189449	/nfs/dbraw/zinc/18/94/49/560189449.db2.gz	MEDZADGBRDMLGM-UHFFFAOYSA-N	-2	3	304.254	2.080	1	5	biogenic,in-vitro	DEBFHL
COc1c([O-])cc2oc3cc(C)ncc3c(=O)c2c1C(=O)[O-]	ZINC000096911629	185391296	/nfs/dbraw/zinc/39/12/96/185391296.db2.gz	YKFKVOZQQDHYCE-UHFFFAOYSA-N	-2	3	301.254	2.062	1	5		DEBFHL
COc1ccc2oc3c(OC)c(OC)cc(=O)c-3c([O-])c2c1[O-]	ZINC000014648971	560223854	/nfs/dbraw/zinc/22/38/54/560223854.db2.gz	ZNARIKIJOHPGTA-UHFFFAOYSA-N	-2	3	318.281	2.383	1	5	biogenic,in-vitro	DEBFHL
COc1ccc2oc3c(OC)c(OC)cc([O-])c3c([O-])c-2c1=O	ZINC000014648971	560223855	/nfs/dbraw/zinc/22/38/55/560223855.db2.gz	ZNARIKIJOHPGTA-UHFFFAOYSA-N	-2	3	318.281	2.383	1	5	biogenic,in-vitro	DEBFHL