pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.37	AttenGpKa training set	0	-1	O=C(S)c1ccc(C(F)(F)F)cc1	O=C([S-])c1ccc(C(F)(F)F)cc1	mol28242	O=C(S)c1ccc(C(F)(F)F)cc1