smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC1=C(C)C(=O)c2c3c(c([O-])cc2C1=O)[C@](C)([C@@H]1CC=C(C)[C@H](O)O1)[C@H](C)O3	ZINC000006066990	560204874	/nfs/dbraw/zinc/20/48/74/560204874.db2.gz	QYYCUZABDGTLCM-KNBMBHGDSA-N	-1	1	400.427	2.784	1	30	in-vitro	HFEFMM
COC1=C(C)C(=O)c2c3c(c([O-])cc2C1=O)[C@@](C)([C@@H]1CC=C(C)[C@H](O)O1)[C@@H](C)O3	ZINC000006031903	560204612	/nfs/dbraw/zinc/20/46/12/560204612.db2.gz	QYYCUZABDGTLCM-OKBRKOFTSA-N	-1	1	400.427	2.784	1	30	in-vitro	HFEFMM
COC1=C(C)C(=O)c2c3c(c([O-])cc2C1=O)[C@](C)([C@@H]1CC=C(C)[C@H](O)O1)[C@@H](C)O3	ZINC000006031780	560204554	/nfs/dbraw/zinc/20/45/54/560204554.db2.gz	QYYCUZABDGTLCM-ZDEDCHIWSA-N	-1	1	400.427	2.784	1	30	in-vitro	HFEFMM
COC1=C(C)C(=O)c2c3c(c([O-])cc2C1=O)[C@@](C)([C@@H]1CC=C(C)[C@H](O)O1)[C@H](C)O3	ZINC000006067120	560204845	/nfs/dbraw/zinc/20/48/45/560204845.db2.gz	QYYCUZABDGTLCM-INMMXKSISA-N	-1	1	400.427	2.784	1	30	in-vitro	HFEFMM