pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.83	AttenGpKa training set	1	0	Cn1c(=[OH+])oc2ccc(Cl)cc21	Cn1c(=O)oc2ccc(Cl)cc21	mol30265	CN1C(=O)Oc2ccc(Cl)cc21