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](O)C/C=C(\C)CO)[C@@H](C)O3	ZINC000003914598	560191339	/nfs/dbraw/zinc/19/13/39/560191339.db2.gz	FBOIBFWCHWNBOE-BPSCMEEZSA-N	-1	1	402.443	2.420	1	30	in-vitro	HEEFMM
Cc1cc([O-])c2c(=O)c3c(cc-2o1)OC(C)(C)[C@H](OC(=O)[C@]1(CCCO)O[C@@H]1C)C3	ZINC000085594163	291210390	/nfs/dbraw/zinc/21/03/90/291210390.db2.gz	UPHQSZUUCNYAQI-LPCJOIQWSA-N	-1	1	418.442	2.362	1	30	biogenic,in-vitro	HEEFMM
Cc1cc(=O)c2c([O-])c3c(cc2o1)OC(C)(C)[C@H](OC(=O)[C@]1(CCCO)O[C@@H]1C)C3	ZINC000085594163	291210392	/nfs/dbraw/zinc/21/03/92/291210392.db2.gz	UPHQSZUUCNYAQI-LPCJOIQWSA-N	-1	1	418.442	2.362	1	30	biogenic,in-vitro	HEEFMM
Cc1cc([O-])c2c(=O)c3c(cc-2o1)OC(C)(C)[C@H](OC(=O)[C@@]1(CCCO)O[C@@H]1C)C3	ZINC000085594161	291210398	/nfs/dbraw/zinc/21/03/98/291210398.db2.gz	UPHQSZUUCNYAQI-IPTDYSPRSA-N	-1	1	418.442	2.362	1	30	biogenic,in-vitro	HEEFMM
Cc1cc(=O)c2c([O-])c3c(cc2o1)OC(C)(C)[C@H](OC(=O)[C@@]1(CCCO)O[C@@H]1C)C3	ZINC000085594161	291210400	/nfs/dbraw/zinc/21/04/00/291210400.db2.gz	UPHQSZUUCNYAQI-IPTDYSPRSA-N	-1	1	418.442	2.362	1	30	biogenic,in-vitro	HEEFMM