pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.79	OCHEM	1	0	COc1ncc(-c2ccccc2)c[nH+]1	COc1ncc(-c2ccccc2)cn1	mol7494	COc1ncc(-c2ccccc2)cn1
0.790000021457672	QSARToolbox	1	0	COc1ncc(-c2ccccc2)c[nH+]1	COc1ncc(-c2ccccc2)cn1	mol7494	COc1ncc(-c2ccccc2)cn1