pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.0	AttenGpKa training set	1	0	CO[C@@H]1NC=[NH+]c2c1cccc2[N+](=O)[O-]	CO[C@@H]1NC=Nc2c1cccc2[N+](=O)[O-]	mol26272	COC1NC=Nc2c1cccc2[N+](=O)[O-]