pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.84	AttenGpKa training set	1	0	C[NH2+]CCc1ccc2ccccc2c1	CNCCc1ccc2ccccc2c1	mol24293	CNCCc1ccc2ccccc2c1
