pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.3	Baltruschat ChEMBL	0	-1	O=S(=O)(Nc1cncc(Br)c1)c1ccccc1C(F)(F)F	O=S(=O)([N-]c1cncc(Br)c1)c1ccccc1C(F)(F)F	mol16692	O=S(=O)(Nc1cncc(Br)c1)c1ccccc1C(F)(F)F