smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2c(c1)C(=O)c1cccc(O)c1C2=O	ZINC000012446752	574412989	/nfs/dbraw/zinc/41/29/89/574412989.db2.gz	QKPDYSSHOSPOKH-FGAAHKGBSA-N	0	0	416.382	-0.345	1	10	endogenous,in-man	HBCFRN
Cc1cc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2c(c1)C(=O)c1cccc(O)c1C2=O	ZINC000012446753	574412982	/nfs/dbraw/zinc/41/29/82/574412982.db2.gz	QKPDYSSHOSPOKH-CYCQADSDSA-N	0	0	416.382	-0.345	1	10	endogenous,in-man	HBCFRN
Cc1cc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2c(c1)C(=O)c1cccc(O)c1C2=O	ZINC000015063146	574413750	/nfs/dbraw/zinc/41/37/50/574413750.db2.gz	QKPDYSSHOSPOKH-MRCDGREHSA-N	0	0	416.382	-0.345	1	10	endogenous,in-man	HBCFRN
Cc1cc2c(c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1O)C(=O)c1ccccc1C2=O	ZINC000033830166	291168323	/nfs/dbraw/zinc/16/83/23/291168323.db2.gz	WGPHZEVLQPMCID-VIVOITHDSA-N	0	0	416.382	-0.345	1	10	biogenic,in-vitro	HBCFRN
O=C1c2ccccc2C(=O)c2c(O)c(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)ccc21	ZINC000059586149	291170081	/nfs/dbraw/zinc/17/00/81/291170081.db2.gz	LPUCQUKLBVSNAF-VVEMMYRFSA-N	0	0	402.355	-0.654	1	10	biogenic,in-vitro	HBCFRN
CC1C=C2C(=O)c3cccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c3C(=O)C2=C(O)C1	ZINC000059586422	291164071	/nfs/dbraw/zinc/16/40/71/291164071.db2.gz	JPTUPZOMBWSXAF-OSFNWEDSSA-N	0	0	418.398	-0.122	1	10	biogenic,in-vitro	HBCFRN
O=C1c2ccccc2C(=O)c2c(O)cc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc21	ZINC000095919429	291170083	/nfs/dbraw/zinc/17/00/83/291170083.db2.gz	MVYMTRGKWWWUAR-VUCAUUSGSA-N	0	0	402.355	-0.654	1	10	biogenic,in-vitro	HBCFRN