pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.96	OCHEM	0	-1	O=C([O-])[C@H]1CCC[NH2+]1	O=C([O-])[C@H]1CCCN1	mol1803	O=C(O)[C@H]1CCCN1
1.99	OCHEM	1	0	O=C(O)[C@H]1CCC[NH2+]1	O=C([O-])[C@H]1CCC[NH2+]1	mol1803	O=C(O)[C@H]1CCCN1