pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.6	AttenGpKa training set	1	0	Fc1ccc2[nH+]c[nH]c2c1F	Fc1ccc2nc[nH]c2c1F	mol26394	Fc1ccc2nc[nH]c2c1F