pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.85	Datawarrior	0	-1	N#CCCN(CCC#N)c1nnn[nH]1	N#CCCN(CCC#N)c1nnn[n-]1	mol13323	N#CCCN(CCC#N)c1nnn[nH]1
4.8499999	OCHEM	0	-1	N#CCCN(CCC#N)c1nnn[nH]1	N#CCCN(CCC#N)c1nnn[n-]1	mol13323	N#CCCN(CCC#N)c1nnn[nH]1