smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1c(C)c([O-])c(C(=O)C=C(O)c2ccccc2)c(O)c1C=O	ZINC000101226052	204001579	/nfs/dbraw/zinc/00/15/79/204001579.db2.gz	NDXOLILIMMVXLG-ZSOIEALJSA-N	-1	2	328.320	3.009	1	30		EGEFLM
COc1c(C)c(O)c(C(=O)C=C([O-])c2ccccc2)c(O)c1C=O	ZINC000101226052	204001583	/nfs/dbraw/zinc/00/15/83/204001583.db2.gz	NDXOLILIMMVXLG-ZSOIEALJSA-N	-1	2	328.320	3.009	1	30		EGEFLM
COc1c(C)c([O-])c(C(=O)C=C(O)c2ccccc2)c(O)c1C=O	ZINC000101135071	219117216	/nfs/dbraw/zinc/11/72/16/219117216.db2.gz	FYPNXPAVVGQFNL-JYRVWZFOSA-N	-1	2	328.320	3.009	1	30	biogenic,in-vitro	EGEFLM
COc1c(C)c(O)c(C(=O)C=C([O-])c2ccccc2)c(O)c1C=O	ZINC000101135071	219117218	/nfs/dbraw/zinc/11/72/18/219117218.db2.gz	FYPNXPAVVGQFNL-JYRVWZFOSA-N	-1	2	328.320	3.009	1	30	biogenic,in-vitro	EGEFLM
C=CC(C)(C)c1c(=O)cc(O)c2c(O)c3cc(O)c([O-])cc3oc1-2	ZINC000015121024	560228729	/nfs/dbraw/zinc/22/87/29/560228729.db2.gz	FJCLLPPQHWALHG-UHFFFAOYSA-N	-1	2	328.320	3.232	1	30	biogenic,in-vitro	EGEFLM
O=C([O-])C(=O)C=C(O)c1cn(Cc2ccc(F)cc2)c2ccccc12	ZINC000101031257	204001271	/nfs/dbraw/zinc/00/12/71/204001271.db2.gz	XEPABNKDQLQPER-MFOYZWKCSA-N	-1	2	339.322	3.381	1	30		EGEFLM
C=CC(C)(C)c1cc(O)c(=O)c2c([O-])c3ccc(O)c(O)c3oc1-2	ZINC000015121016	560228759	/nfs/dbraw/zinc/22/87/59/560228759.db2.gz	ZBJZNRJIJCYESW-UHFFFAOYSA-N	-1	2	328.320	3.232	1	30	biogenic,in-vitro	EGEFLM