pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.45	Datawarrior	0	-1	O=C(O)[C@@H](F)c1ccccc1	O=C([O-])[C@@H](F)c1ccccc1	mol14106	O=C(O)C(F)c1ccccc1
2.32999992370605	QSARToolbox	0	-1	O=C(O)[C@@H](F)c1ccccc1	O=C([O-])[C@@H](F)c1ccccc1	mol14106	O=C(O)C(F)c1ccccc1
2.03	AttenGpKa training set	0	-1	O=C(O)[C@@H](F)c1ccccc1	O=C([O-])[C@@H](F)c1ccccc1	mol14106	O=C(O)C(F)c1ccccc1
