pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.36	AttenGpKa training set	1	0	C[NH2+]CCc1cccc(O)c1	CNCCc1cccc(O)c1,C[NH2+]CCc1cccc([O-])c1	mol24257	CNCCc1cccc(O)c1
