pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.26	Datawarrior	0	-1	NNC(=O)C(F)(F)[C@@]1(F)OC(F)(F)C(F)(F)C1(F)F	N[N-]C(=O)C(F)(F)[C@@]1(F)OC(F)(F)C(F)(F)C1(F)F	mol15576	NNC(=O)C(F)(F)C1(F)OC(F)(F)C(F)(F)C1(F)F
8.2600002	OCHEM	0	-1	NNC(=O)C(F)(F)[C@@]1(F)OC(F)(F)C(F)(F)C1(F)F	N[N-]C(=O)C(F)(F)[C@@]1(F)OC(F)(F)C(F)(F)C1(F)F	mol15576	NNC(=O)C(F)(F)C1(F)OC(F)(F)C(F)(F)C1(F)F
8.26000022888184	QSARToolbox	0	-1	NNC(=O)C(F)(F)[C@@]1(F)OC(F)(F)C(F)(F)C1(F)F	N[N-]C(=O)C(F)(F)[C@@]1(F)OC(F)(F)C(F)(F)C1(F)F	mol15576	NNC(=O)C(F)(F)C1(F)OC(F)(F)C(F)(F)C1(F)F