pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.59999990463257	QSARToolbox	1	0	[NH3+]c1cccc(C(O)(C(F)(F)F)C(F)(F)F)c1	Nc1cccc(C(O)(C(F)(F)F)C(F)(F)F)c1	mol24070	Nc1cccc(C(O)(C(F)(F)F)C(F)(F)F)c1
3.6	AttenGpKa training set	1	0	[NH3+]c1cccc(C(O)(C(F)(F)F)C(F)(F)F)c1	Nc1cccc(C(O)(C(F)(F)F)C(F)(F)F)c1	mol24070	Nc1cccc(C(O)(C(F)(F)F)C(F)(F)F)c1