Ligand id: 2423

Name: cinnamaldehyde

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 17.07
Molecular weight 132.06
XLogP 3.98
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Bandell M, Story GM, Hwang SW, Viswanath V, Eid SR, Petrus MJ, Earley TJ, Patapoutian A. (2004)
Noxious cold ion channel TRPA1 is activated by pungent compounds and bradykinin.
Neuron, 41 (6): 849-57. [PMID:15046718]
2. Macpherson LJ, Hwang SW, Miyamoto T, Dubin AE, Patapoutian A, Story GM. (2006)
More than cool: promiscuous relationships of menthol and other sensory compounds.
Mol. Cell. Neurosci., 32 (4): 335-43. [PMID:16829128]