pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.01	AttenGpKa training set	-1	-2	CN1C(=O)[N-]c2nccnc2[C@@H]1O,CN1C(=O)Nc2nccnc2[C-]1O	CN1C(=O)[N-]c2nccnc2[C@@H]1[O-],CN1C(=O)Nc2nccnc2[C-]1[O-],CN1C(=O)[N-]c2nccnc2[C-]1O	mol26244	CN1C(=O)Nc2nccnc2C1O