pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.86	Datawarrior	1	0	O=Cc1cccc[nH+]1	O=Cc1ccccn1	mol3709	O=Cc1ccccn1
3.8	Organic Oxygen Acids and Nitrogen Bases	1	0	O=Cc1cccc[nH+]1	O=Cc1ccccn1	mol3709	O=Cc1ccccn1
3.84	OCHEM	1	0	O=Cc1cccc[nH+]1	O=Cc1ccccn1	mol3709	O=Cc1ccccn1
3.8599999	OCHEM	1	0	O=Cc1cccc[nH+]1	O=Cc1ccccn1	mol3709	O=Cc1ccccn1
3.78	OCHEM	1	0	O=Cc1cccc[nH+]1	O=Cc1ccccn1	mol3709	O=Cc1ccccn1
