pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.1400003433228	QSARToolbox	0	-1	[O-]c1c(O)cccc1C[NH+]1CCOCC1,[O-]c1cccc(C[NH+]2CCOCC2)c1O,Oc1cccc(CN2CCOCC2)c1O	[O-]c1cccc(CN2CCOCC2)c1O,[O-]c1c(O)cccc1CN1CCOCC1	mol34006	Oc1cccc(CN2CCOCC2)c1O
