pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.1800000667572	QSARToolbox	1	0	[NH3+]c1ccccc1C(O)(C(F)(F)F)C(F)(F)F	Nc1ccccc1C(O)(C(F)(F)F)C(F)(F)F	mol24069	Nc1ccccc1C(O)(C(F)(F)F)C(F)(F)F
3.18	AttenGpKa training set	1	0	[NH3+]c1ccccc1C(O)(C(F)(F)F)C(F)(F)F	Nc1ccccc1C(O)(C(F)(F)F)C(F)(F)F	mol24069	Nc1ccccc1C(O)(C(F)(F)F)C(F)(F)F