pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.77	IUPAC digitized pKa	1	0	COc1ncc(-c2ccc(C)cc2)c[nH+]1	COc1ncc(-c2ccc(C)cc2)cn1	mol7498	COc1ncc(-c2ccc(C)cc2)cn1
0.769999980926514	QSARToolbox	1	0	COc1ncc(-c2ccc(C)cc2)c[nH+]1	COc1ncc(-c2ccc(C)cc2)cn1	mol7498	COc1ncc(-c2ccc(C)cc2)cn1