pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.53	AttenGpKa training set	1	0	N/[NH+]=C(/c1ccccc1)c1ccc(Cl)cc1,[NH3+]/N=C(/c1ccccc1)c1ccc(Cl)cc1	N/N=C(/c1ccccc1)c1ccc(Cl)cc1	mol24860	N/N=C(/c1ccccc1)c1ccc(Cl)cc1