pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.48999977111816	QSARToolbox	1	0	CCOc1cc(C(=O)OCC[NH+](CC)CC)cc(OCC)c1OCC	CCOc1cc(C(=O)OCCN(CC)CC)cc(OCC)c1OCC	mol35902	CCOc1cc(C(=O)OCCN(CC)CC)cc(OCC)c1OCC
