pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.43	Datawarrior	0	-1	Cc1nc(O)n[nH]1	Cc1nc([O-])n[nH]1,Cc1nc(O)n[n-]1	mol16048	Cc1nc(O)n[nH]1
9.4300003	OCHEM	0	-1	Cc1nc(O)n[nH]1	Cc1nc([O-])n[nH]1,Cc1nc(O)n[n-]1	mol16048	Cc1nc(O)n[nH]1
9.61	AttenGpKa training set	0	-1	Cc1nc(O)n[nH]1	Cc1nc([O-])n[nH]1,Cc1nc(O)n[n-]1	mol16048	Cc1nc(O)n[nH]1