pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.69	AttenGpKa training set	1	0	Cc1cc(O)c(O)c(C(=O)NC(C)C)[n+]1C	Cc1cc(O)c([O-])c(C(=O)NC(C)C)[n+]1C,Cc1cc([O-])c(O)c(C(=O)NC(C)C)[n+]1C	mol25121	Cc1cc(O)c(O)c(C(=O)NC(C)C)[n+]1C