pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.59	AttenGpKa training set	0	-1	COC(=O)c1cc(C(=O)O)ccc1C(=O)O	COC(=O)c1cc(C(=O)[O-])ccc1C(=O)O,COC(=O)c1cc(C(=O)O)ccc1C(=O)[O-]	mol22989	COC(=O)c1cc(C(=O)O)ccc1C(=O)O
4.0	AttenGpKa training set	-1	-2	COC(=O)c1cc(C(=O)[O-])ccc1C(=O)O,COC(=O)c1cc(C(=O)O)ccc1C(=O)[O-]	COC(=O)c1cc(C(=O)[O-])ccc1C(=O)[O-]	mol22989	COC(=O)c1cc(C(=O)O)ccc1C(=O)O