pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.83	IUPAC digitized pKa	1	0	Nc1ccc(Cl)c[nH+]1,[NH3+]c1ccc(Cl)cn1	Nc1ccc(Cl)cn1	mol3608	Nc1ccc(Cl)cn1
4.8299999	OCHEM	1	0	Nc1ccc(Cl)c[nH+]1,[NH3+]c1ccc(Cl)cn1	Nc1ccc(Cl)cn1	mol3608	Nc1ccc(Cl)cn1
4.71	AttenGpKa training set	1	0	Nc1ccc(Cl)c[nH+]1,[NH3+]c1ccc(Cl)cn1	Nc1ccc(Cl)cn1	mol3608	Nc1ccc(Cl)cn1