pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.47	AttenGpKa training set	1	0	C[NH+](C)CCCCc1ccc2ccccc2c1	CN(C)CCCCc1ccc2ccccc2c1	mol24328	CN(C)CCCCc1ccc2ccccc2c1
