pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.64999961853027	QSARToolbox	2	1	C1CNCCOCC[NH2+]CCNCCOCCNCC[NH2+]CCOCCN1,C1CNCCOCCNCC[NH2+]CCOCC[NH2+]CCNCCOCCN1,C1CNCCOCC[NH2+]CCNCCOCC[NH2+]CCNCCOCCN1	C1CNCCOCCNCC[NH2+]CCOCCNCCNCCOCCN1	mol38026	C1CNCCOCCNCCNCCOCCNCCNCCOCCN1
9.14999961853027	QSARToolbox	2	1	C1CNCCOCC[NH2+]CCNCCOCCNCC[NH2+]CCOCCN1,C1CNCCOCCNCC[NH2+]CCOCC[NH2+]CCNCCOCCN1,C1CNCCOCC[NH2+]CCNCCOCC[NH2+]CCNCCOCCN1	C1CNCCOCCNCC[NH2+]CCOCCNCCNCCOCCN1	mol38026	C1CNCCOCCNCCNCCOCCNCCNCCOCCN1