pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.4	Datawarrior	0	-1	C[C@H]1CCC[C@H](C(=O)[O-])[NH2+]1	C[C@H]1CCC[C@H](C(=O)[O-])N1	mol13050	CC1CCCC(C(=O)O)N1
10.3999996185303	QSARToolbox	0	-1	C[C@H]1CCC[C@H](C(=O)[O-])[NH2+]1	C[C@H]1CCC[C@H](C(=O)[O-])N1	mol13050	CC1CCCC(C(=O)O)N1
0.9	OCHEM	1	0	C[C@H]1CCC[C@H](C(=O)O)[NH2+]1	C[C@H]1CCC[C@H](C(=O)[O-])[NH2+]1	mol13050	CC1CCCC(C(=O)O)N1