pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.7	Datawarrior	1	0	C[NH+](C)c1ccc(N2CCOCC2)cc1,CN(C)c1ccc([NH+]2CCOCC2)cc1	CN(C)c1ccc(N2CCOCC2)cc1	mol15737	CN(C)c1ccc(N2CCOCC2)cc1
5.6999998	OCHEM	1	0	C[NH+](C)c1ccc(N2CCOCC2)cc1,CN(C)c1ccc([NH+]2CCOCC2)cc1	CN(C)c1ccc(N2CCOCC2)cc1	mol15737	CN(C)c1ccc(N2CCOCC2)cc1
5.69999980926514	QSARToolbox	1	0	C[NH+](C)c1ccc(N2CCOCC2)cc1,CN(C)c1ccc([NH+]2CCOCC2)cc1	CN(C)c1ccc(N2CCOCC2)cc1	mol15737	CN(C)c1ccc(N2CCOCC2)cc1