pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.69	AttenGpKa training set	-1	-2	CC(/C=N/[O-])=N\O,CC(/C=N/O)=N\[O-]	CC(/C=N/[O-])=N\[O-]	mol31489	CC(/C=N/O)=N\O