Molecule ID: mol37613

SMILES: C1NC[C@H]2[C@@H]1[C@H]2N1CCN([C@@H]2[C@@H]3CNC[C@@H]32)CC1

InChI: InChI=1S/C14H24N4/c1-2-18(14-11-7-16-8-12(11)14)4-3-17(1)13-9-5-15-6-10(9)13/h9-16H,1-8H2/t9-,10+,11-,12+,13-,14-

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.70 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization