pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.59999990463257	QSARToolbox	-1	-2	O=C([O-])C/C(=C/c1ccccc1)C(=O)O,O=C(O)C/C(=C/c1ccccc1)C(=O)[O-]	O=C([O-])C/C(=C/c1ccccc1)C(=O)[O-]	mol22898	O=C(O)C/C(=C/c1ccccc1)C(=O)O
3.86	AttenGpKa training set	-1	-2	O=C([O-])C/C(=C/c1ccccc1)C(=O)O,O=C(O)C/C(=C/c1ccccc1)C(=O)[O-]	O=C([O-])C/C(=C/c1ccccc1)C(=O)[O-]	mol22898	O=C(O)C/C(=C/c1ccccc1)C(=O)O
