pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.56	AttenGpKa training set	1	0	Cc1c(O)c(O)cc[n+]1C	Cc1c([O-])c(O)cc[n+]1C,Cc1c(O)c([O-])cc[n+]1C	mol25067	Cc1c(O)c(O)cc[n+]1C