pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.66	AttenGpKa training set	0	-1	COc1ccc(/C=[N+](\C)[O-])c(C(=O)O)c1OC,COc1ccc(/C=[N+](\C)O)c(C(=O)[O-])c1OC	COc1ccc(/C=[N+](\C)[O-])c(C(=O)[O-])c1OC	mol23044	COc1ccc(/C=[N+](\C)[O-])c(C(=O)O)c1OC