pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.56	AttenGpKa training set	0	-1	N[C@@H](CO)c1cccc(O)c1,[NH3+][C@@H](CO)c1cccc([O-])c1	N[C@@H](CO)c1cccc([O-])c1	mol24261	NC(CO)c1cccc(O)c1
9.63	AttenGpKa training set	0	-1	N[C@@H](CO)c1cccc(O)c1,[NH3+][C@@H](CO)c1cccc([O-])c1	N[C@@H](CO)c1cccc([O-])c1	mol24261	NC(CO)c1cccc(O)c1