pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.5	Datawarrior	0	-1	Cc1cc(O)n(-c2nc(C)c(C)c(O)n2)n1	Cc1cc([O-])n(-c2nc(C)c(C)c(O)n2)n1,Cc1cc(O)n(-c2nc(C)c(C)c([O-])n2)n1	mol14534	Cc1cc(O)n(-c2nc(C)c(C)c(O)n2)n1
10.3	Datawarrior	-1	-2	Cc1cc([O-])n(-c2nc(C)c(C)c(O)n2)n1,Cc1cc(O)n(-c2nc(C)c(C)c([O-])n2)n1	Cc1cc([O-])n(-c2nc(C)c(C)c([O-])n2)n1	mol14534	Cc1cc(O)n(-c2nc(C)c(C)c(O)n2)n1