pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.85	Datawarrior	1	0	CNc1cc[n+](O)cc1	CNc1cc[n+]([O-])cc1	mol13625	CNc1cc[n+](O)cc1
3.8499999	OCHEM	1	0	CNc1cc[n+](O)cc1	CNc1cc[n+]([O-])cc1	mol13625	CNc1cc[n+](O)cc1