pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
-0.83	AttenGpKa training set	1	0	C[n+]1ccc([S-])c[nH+]1,C[n+]1ccc(S)cn1	C[n+]1ccc([S-])cn1	mol25713	C[n+]1ccc(S)cn1