pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.85	IUPAC digitized pKa	1	0	Cn1c2cccc(=O)c-2[nH+]c2ccccc21	Cn1c2cccc(=O)c-2nc2ccccc21	mol5124	Cn1c2cccc(=O)c-2nc2ccccc21
4.84999990463257	QSARToolbox	1	0	Cn1c2cccc(=O)c-2[nH+]c2ccccc21	Cn1c2cccc(=O)c-2nc2ccccc21	mol5124	Cn1c2cccc(=O)c-2nc2ccccc21