pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.23	Datawarrior	0	-1	Cc1cc(O)nc(-n2nc(C)cc2O)n1	Cc1cc(O)nc(-n2nc(C)cc2[O-])n1,Cc1cc([O-])nc(-n2nc(C)cc2O)n1	mol15700	Cc1cc(O)nc(-n2nc(C)cc2O)n1
10.0	Datawarrior	-1	-2	Cc1cc(O)nc(-n2nc(C)cc2[O-])n1,Cc1cc([O-])nc(-n2nc(C)cc2O)n1	Cc1cc([O-])nc(-n2nc(C)cc2[O-])n1	mol15700	Cc1cc(O)nc(-n2nc(C)cc2O)n1