pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.3	IUPAC digitized pKa	0	-1	O=C(O)CSc1cccc(C(F)(F)F)c1	O=C([O-])CSc1cccc(C(F)(F)F)c1	mol11113	O=C(O)CSc1cccc(C(F)(F)F)c1
3.29999995231628	QSARToolbox	0	-1	O=C(O)CSc1cccc(C(F)(F)F)c1	O=C([O-])CSc1cccc(C(F)(F)F)c1	mol11113	O=C(O)CSc1cccc(C(F)(F)F)c1