pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.9	AttenGpKa training set	1	0	FC(F)(F)c1ccc2cnc[nH+]c2c1,FC(F)(F)c1ccc2c[nH+]cnc2c1	FC(F)(F)c1ccc2cncnc2c1	mol7927	FC(F)(F)c1ccc2cncnc2c1