pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.64999961853027	QSARToolbox	1	0	NCCNCC[NH2+]CCNCCNCc1cccc2ccccc12,NCCNCCNCCNCC[NH2+]Cc1cccc2ccccc12,NCC[NH2+]CCNCCNCCNCc1cccc2ccccc12,NCCNCCNCC[NH2+]CCNCc1cccc2ccccc12,[NH3+]CCNCCNCCNCCNCc1cccc2ccccc12	NCCNCCNCCNCCNCc1cccc2ccccc12	mol35266	NCCNCCNCCNCCNCc1cccc2ccccc12