pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.98	Datawarrior	0	-1	NS(=O)(=O)c1cccc(C(F)(F)F)c1	[NH-]S(=O)(=O)c1cccc(C(F)(F)F)c1	mol13278	NS(=O)(=O)c1cccc(C(F)(F)F)c1
8.9799995	OCHEM	0	-1	NS(=O)(=O)c1cccc(C(F)(F)F)c1	[NH-]S(=O)(=O)c1cccc(C(F)(F)F)c1	mol13278	NS(=O)(=O)c1cccc(C(F)(F)F)c1
8.97999954223633	QSARToolbox	0	-1	NS(=O)(=O)c1cccc(C(F)(F)F)c1	[NH-]S(=O)(=O)c1cccc(C(F)(F)F)c1	mol13278	NS(=O)(=O)c1cccc(C(F)(F)F)c1