pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.40000009536743	QSARToolbox	0	-1	O=C(O)Cc1ccc(O)cc1	O=C([O-])Cc1ccc(O)cc1	mol23273	O=C(O)Cc1ccc(O)cc1
4.33	AttenGpKa training set	0	-1	O=C(O)Cc1ccc(O)cc1	O=C([O-])Cc1ccc(O)cc1	mol23273	O=C(O)Cc1ccc(O)cc1
10.145	AttenGpKa training set	-1	-2	O=C([O-])Cc1ccc(O)cc1	O=C([O-])Cc1ccc([O-])cc1	mol23273	O=C(O)Cc1ccc(O)cc1