pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.98	OCHEM	0	-1	COc1ccc(O)c(N=Nc2nc(C)cs2)c1	COc1ccc([O-])c(N=Nc2nc(C)cs2)c1	mol32295	COc1ccc(O)c(N=Nc2nc(C)cs2)c1
0.76999998	OCHEM	2	1	COc1ccc([O-])c([NH+]=[NH+]c2[nH+]c(C)cs2)c1,COc1ccc(O)c([NH+]=[NH+]c2nc(C)cs2)c1	COc1ccc(O)c(N=Nc2[nH+]c(C)cs2)c1,COc1ccc(O)c(N=[NH+]c2nc(C)cs2)c1,COc1ccc(O)c([NH+]=Nc2nc(C)cs2)c1	mol32295	COc1ccc(O)c(N=Nc2nc(C)cs2)c1