pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.15	Datawarrior	1	0	C=C(C)C(=O)OCC[NH2+]CC	C=C(C)C(=O)OCCNCC	mol14070	C=C(C)C(=O)OCCNCC
9.1499996	OCHEM	1	0	C=C(C)C(=O)OCC[NH2+]CC	C=C(C)C(=O)OCCNCC	mol14070	C=C(C)C(=O)OCCNCC
9.14999961853027	QSARToolbox	1	0	C=C(C)C(=O)OCC[NH2+]CC	C=C(C)C(=O)OCCNCC	mol14070	C=C(C)C(=O)OCCNCC