pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.15	AttenGpKa training set	1	0	COc1cc(C[C@@H](C)N[NH3+])cc(OC)c1OC,COc1cc(C[C@@H](C)[NH2+]N)cc(OC)c1OC	COc1cc(C[C@@H](C)NN)cc(OC)c1OC	mol24871	COc1cc(CC(C)NN)cc(OC)c1OC