pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.96	AttenGpKa training set	-1	-2	O=C([O-])/C(S)=C/C=C/c1ccccc1	O=C([O-])/C([S-])=C/C=C/c1ccccc1	mol23443	O=C(O)/C(S)=C/C=C/c1ccccc1
