Ligand id: 9613

Name: AM841

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 94.14
Molecular weight 443.25
XLogP 6.77
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Hua T, Vemuri K, Nikas SP, Laprairie RB, Wu Y, Qu L, Pu M, Korde A, Jiang S, Ho JH et al.. (2017)
Crystal structures of agonist-bound human cannabinoid receptor CB1.
Nature, 547 (7664): 468-471. [PMID:28678776]