pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.09	AttenGpKa training set	0	-1	Cc1ccc(C2(c3ccc(C)cc3)C(=O)NC(=O)[C@H]2C(=O)O)cc1	Cc1ccc(C2(c3ccc(C)cc3)C(=O)NC(=O)[C@H]2C(=O)[O-])cc1	mol27357	Cc1ccc(C2(c3ccc(C)cc3)C(=O)NC(=O)C2C(=O)O)cc1