pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.62	IUPAC digitized pKa	1	0	COc1ccnc([NH3+])c1,COc1cc[nH+]c(N)c1	COc1ccnc(N)c1	mol2187	COc1ccnc(N)c1
7.61999988555908	QSARToolbox	1	0	COc1ccnc([NH3+])c1,COc1cc[nH+]c(N)c1	COc1ccnc(N)c1	mol2187	COc1ccnc(N)c1
-6.94000005722046	QSARToolbox	2	1	COc1cc[nH+]c([NH3+])c1	COc1ccnc([NH3+])c1,COc1cc[nH+]c(N)c1	mol2187	COc1ccnc(N)c1