pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.23000001907349	QSARToolbox	1	0	COc1cc(Cc2c[nH+]c(N)nc2N)cc(O)c1O,COc1cc(Cc2cnc(N)[nH+]c2N)cc(O)c1O,COc1cc(Cc2cnc(N)nc2[NH3+])cc(O)c1O,COc1cc(Cc2cnc([NH3+])nc2N)cc(O)c1O	COc1cc(Cc2cnc(N)nc2N)cc(O)c1O	mol37060	COc1cc(Cc2cnc(N)nc2N)cc(O)c1O