pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.61	Datawarrior	0	-1	CCCc1nnn[nH]1	CCCc1nnn[n-]1	mol12355	CCCc1nnn[nH]1
5.6100001	OCHEM	0	-1	CCCc1nnn[nH]1	CCCc1nnn[n-]1	mol12355	CCCc1nnn[nH]1
5.6100001335144	QSARToolbox	0	-1	CCCc1nnn[nH]1	CCCc1nnn[n-]1	mol12355	CCCc1nnn[nH]1