pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	Datawarrior	1	0	CC(=O)N1CC[NH+](C)CC1	CC(=O)N1CCN(C)CC1	mol12983	CC(=O)N1CCN(C)CC1
7.0999999	OCHEM	1	0	CC(=O)N1CC[NH+](C)CC1	CC(=O)N1CCN(C)CC1	mol12983	CC(=O)N1CCN(C)CC1
7.09999990463257	QSARToolbox	1	0	CC(=O)N1CC[NH+](C)CC1	CC(=O)N1CCN(C)CC1	mol12983	CC(=O)N1CCN(C)CC1