pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.90000009536743	QSARToolbox	1	0	C1CNCCN(Cc2n[nH]c(CN3CCNCC[NH2+]CC3)n2)CCN1,C1CNCCN(Cc2n[nH]c(C[NH+]3CCNCCNCC3)n2)CCN1,C1CNCCN(Cc2nc(C[NH+]3CCNCCNCC3)n[nH]2)CCN1,C1CNCCN(Cc2nc(CN3CCNCC[NH2+]CC3)n[nH]2)CCN1	C1CNCCN(Cc2n[nH]c(CN3CCNCCNCC3)n2)CCN1	mol38033	C1CNCCN(Cc2n[nH]c(CN3CCNCCNCC3)n2)CCN1