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(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)O[C@@H]3OC	ZINC000014435110	291253258	/nfs/dbraw/zinc/25/32/58/291253258.db2.gz	XURLTFUKDPZAPN-QFIPXVFZSA-N	-1	1	410.378	3.774	1	0	biogenic,in-vitro	HHAFMM
C[C@H]1C=Cc2c(cc([O-])c3c(=O)c4c(oc23)-c2ccc(O)cc2O[C@@H](C(C)(C)O)C4)O1	ZINC000095912540	291256818	/nfs/dbraw/zinc/25/68/18/291256818.db2.gz	YBYHQICXTIWWIY-JEOXALJRSA-N	-1	1	422.433	3.740	1	0	biogenic,in-vitro	HHAFMM
C[C@H]1C=Cc2c(cc(=O)c3c([O-])c4c(oc2-3)-c2ccc(O)cc2O[C@@H](C(C)(C)O)C4)O1	ZINC000095912540	291256820	/nfs/dbraw/zinc/25/68/20/291256820.db2.gz	YBYHQICXTIWWIY-JEOXALJRSA-N	-1	1	422.433	3.740	1	0	biogenic,in-vitro	HHAFMM
CC(C)C[C@H](NC(=O)c1ccc(NCc2cnc[nH]2)cc1-c1ccccc1)C(=O)[O-]	ZINC000013796728	581097888	/nfs/dbraw/zinc/09/78/88/581097888.db2.gz	KZMSAVPDHMHSQO-NRFANRHFSA-N	-1	1	406.486	3.918	1	0		HHAFMM
COc1c([O-])c(C(C)C)c2oc(-c3ccc(O)cc3)cc(=O)c2c1OCCCO	ZINC000085633018	291251999	/nfs/dbraw/zinc/25/19/99/291251999.db2.gz	NSNCXPDXKYMOEH-UHFFFAOYSA-N	-1	1	400.427	3.764	1	0	biogenic,in-vitro	HHAFMM
COc1cc2c(-c3ccc4c(c3)OCO4)c3c(c([O-])c2c(OC)c1OC)COC3=O	ZINC000095486302	291253143	/nfs/dbraw/zinc/25/31/43/291253143.db2.gz	LYXHFFLCDMOEKH-UHFFFAOYSA-N	-1	1	410.378	3.637	1	0	biogenic,in-vitro	HHAFMM
COc1ccc(-c2c(-c3cc(Cl)c([O-])cc3O)n[nH]c2C(=O)NC(C)C)cc1	ZINC000004617894	581097451	/nfs/dbraw/zinc/09/74/51/581097451.db2.gz	RBHQGEWNBVFZRU-UHFFFAOYSA-N	-1	1	401.850	3.955	1	0		HHAFMM
COc1cc2c(cc1OC)-c1c([O-])c3c(=O)cc4c(c-3oc1[C@@H](O)O2)C=CC(C)(C)O4	ZINC000014768752	291253535	/nfs/dbraw/zinc/25/35/35/291253535.db2.gz	NVIZHSSHHRHDLE-QFIPXVFZSA-N	-1	1	424.405	3.750	1	0	biogenic,in-vitro	HHAFMM
COc1cc2c(cc1OC)-c1c(=O)c3c([O-])cc4c(c3oc1[C@@H](O)O2)C=CC(C)(C)O4	ZINC000014768752	291253538	/nfs/dbraw/zinc/25/35/38/291253538.db2.gz	NVIZHSSHHRHDLE-QFIPXVFZSA-N	-1	1	424.405	3.750	1	0	biogenic,in-vitro	HHAFMM