pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.43	Hunt	1	0	CCOC(=O)c1ccc([C@@H](O)C[NH2+]C(C)C)cc1	CCOC(=O)c1ccc([C@@H](O)CNC(C)C)cc1	mol2177	CCOC(=O)c1ccc([C@@H](O)CNC(C)C)cc1