pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.72	Datawarrior	0	-1	O=C([O-])[C@@H]1CC[NH2+]C1	O=C([O-])[C@@H]1CCNC1	mol11705	O=C(O)C1CCNC1
3.38	Datawarrior	1	0	O=C(O)[C@@H]1CC[NH2+]C1	O=C([O-])[C@@H]1CC[NH2+]C1	mol11705	O=C(O)C1CCNC1
3.3800001	OCHEM	1	0	O=C(O)[C@@H]1CC[NH2+]C1	O=C([O-])[C@@H]1CC[NH2+]C1	mol11705	O=C(O)C1CCNC1