pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.77	IUPAC digitized pKa	1	0	COc1cc(C(=O)N2CCNc3nc(N)[nH+]c(N)c32)cc(OC)c1OC,COc1cc(C(=O)N2CCNc3nc([NH3+])nc(N)c32)cc(OC)c1OC,COc1cc(C(=O)N2CC[NH2+]c3nc(N)nc(N)c32)cc(OC)c1OC,COc1cc(C(=O)N2CCNc3[nH+]c(N)nc(N)c32)cc(OC)c1OC,COc1cc(C(=O)N2CCNc3nc(N)nc([NH3+])c32)cc(OC)c1OC	COc1cc(C(=O)N2CCNc3nc(N)nc(N)c32)cc(OC)c1OC	mol8134	COc1cc(C(=O)N2CCNc3nc(N)nc(N)c32)cc(OC)c1OC