pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.11	IUPAC digitized pKa	1	0	COc1c[nH+]c(C)nc1OC,COc1cnc(C)[nH+]c1OC	COc1cnc(C)nc1OC	mol7390	COc1cnc(C)nc1OC
4.1100001335144	QSARToolbox	1	0	COc1c[nH+]c(C)nc1OC,COc1cnc(C)[nH+]c1OC	COc1cnc(C)nc1OC	mol7390	COc1cnc(C)nc1OC
