pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.2199998	OCHEM	1	0	CCCCCC[NH+]=Cc1c(C)cnc(C)c1O,CCCCCCN=Cc1c(C)c[nH+]c(C)c1O	CCCCCCN=Cc1c(C)cnc(C)c1O,CCCCCCN=Cc1c(C)c[nH+]c(C)c1[O-],CCCCCC[NH+]=Cc1c(C)cnc(C)c1[O-]	mol32823	CCCCCCN=Cc1c(C)cnc(C)c1O
