pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.35	AttenGpKa training set	0	-1	C[NH+](C)c1cc(C(=O)O)ccc1C(=O)[O-],CN(C)c1cc(C(=O)O)ccc1C(=O)O,C[NH+](C)c1cc(C(=O)[O-])ccc1C(=O)O	C[NH+](C)c1cc(C(=O)[O-])ccc1C(=O)[O-],CN(C)c1cc(C(=O)[O-])ccc1C(=O)O	mol22915	CN(C)c1cc(C(=O)O)ccc1C(=O)O