pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.02	Datawarrior	0	-1	[NH3+]CCCCCCCCC(=O)[O-]	NCCCCCCCCC(=O)[O-]	mol12889	NCCCCCCCCC(=O)O
4.53	Datawarrior	1	0	[NH3+]CCCCCCCCC(=O)O	[NH3+]CCCCCCCCC(=O)[O-]	mol12889	NCCCCCCCCC(=O)O
4.5300002	OCHEM	1	0	[NH3+]CCCCCCCCC(=O)O	[NH3+]CCCCCCCCC(=O)[O-]	mol12889	NCCCCCCCCC(=O)O