pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.57	AttenGpKa training set	0	-1	CN(O)C(=O)c1c[nH]cn1	CN([O-])C(=O)c1c[nH]cn1	mol31400	CN(O)C(=O)c1c[nH]cn1
5.06	AttenGpKa training set	1	0	CN(O)C(=[OH+])c1c[nH]cn1,CN(O)C(=O)c1c[nH]c[nH+]1	CN(O)C(=O)c1c[nH]cn1	mol31400	CN(O)C(=O)c1c[nH]cn1