pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.30000019073486	QSARToolbox	3	2	OC1CN2CCNCCNCC[NH2+]CC[NH+](CCNCCNCC[NH2+]CC2)C1,OC1CN2CCNCC[NH2+]CCNCCN(CC[NH2+]CC[NH2+]CCNCC2)C1,OC1CN2CCNCCNCC[NH2+]CCN(CC[NH2+]CC[NH2+]CCNCC2)C1,OC1CN2CCNCC[NH2+]CCNCC[NH+](CCNCCNCC[NH2+]CC2)C1,OC1CN2CCNCC[NH2+]CCNCC[NH+](CCNCC[NH2+]CCNCC2)C1,OC1CN2CCNCCNCC[NH2+]CC[NH+](CCNCC[NH2+]CCNCC2)C1,OC1CN2CC[NH2+]CCNCCNCC[NH+](CCNCCNCC[NH2+]CC2)C1,OC1CN2CCNCC[NH2+]CCNCCN(CC[NH2+]CCNCC[NH2+]CC2)C1,OC1CN2CCNCCNCC[NH2+]CCN(CC[NH2+]CCNCC[NH2+]CC2)C1	OC1CN2CCNCCNCCNCC[NH+](CCNCCNCC[NH2+]CC2)C1,OC1CN2CCNCC[NH2+]CCNCCN(CCNCC[NH2+]CCNCC2)C1,OC1CN2CCNCCNCCNCC[NH+](CCNCC[NH2+]CCNCC2)C1,OC1CN2CCNCCNCC[NH2+]CCN(CC[NH2+]CCNCCNCC2)C1,OC1CN2CCNCCNCC[NH2+]CCN(CCNCCNCC[NH2+]CC2)C1,OC1CN2CCNCCNCC[NH2+]CCN(CCNCC[NH2+]CCNCC2)C1	mol38109	OC1CN2CCNCCNCCNCCN(CCNCCNCCNCC2)C1