pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.02	AttenGpKa training set	1	0	CCCC[NH+](CC)c1ccccc1	CCCCN(CC)c1ccccc1	mol23811	CCCCN(CC)c1ccccc1