pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.14	AttenGpKa training set	1	0	CC(C)[NH2+]C1CCCCC1	CC(C)NC1CCCCC1	mol24526	CC(C)NC1CCCCC1