Ligand id: 3317

Name: AM251

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 50.16
Molecular weight 554.01
XLogP 5.88
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Henstridge CM, Balenga NA, Schröder R, Kargl JK, Platzer W, Martini L, Arthur S, Penman J, Whistler JL, Kostenis E, Waldhoer M, Irving AJ. (2010)
GPR55 ligands promote receptor coupling to multiple signalling pathways.
Br. J. Pharmacol., 160 (3): 604-14. [PMID:20136841]
2. Kapur A, Zhao P, Sharir H, Bai Y, Caron MG, Barak LS, Abood ME. (2009)
Atypical responsiveness of the orphan receptor GPR55 to cannabinoid ligands.
J. Biol. Chem., 284 (43): 29817-27. [PMID:19723626]
3. Lan R, Liu Q, Fan P, Lin S, Fernando SR, McCallion D, Pertwee R, Makriyannis A. (1999)
Structure-activity relationships of pyrazole derivatives as cannabinoid receptor antagonists.
J. Med. Chem., 42 (4): 769-76. [PMID:10052983]
4. McHugh D, Page J, Dunn E, Bradshaw HB. (2012)
Δ(9) -Tetrahydrocannabinol and N-arachidonyl glycine are full agonists at GPR18 receptors and induce migration in human endometrial HEC-1B cells.
Br. J. Pharmacol., 165 (8): 2414-24. [PMID:21595653]
5. Pryce G, Baker D. (2017)
Antidote to cannabinoid intoxication: the CB1 receptor inverse agonist, AM251, reverses hypothermic effects of the CB1 receptor agonist, CB-13, in mice.
Br. J. Pharmacol., 174 (21): 3790-3794. [PMID:28800377]
6. Ryberg E, Larsson N, Sjögren S, Hjorth S, Hermansson NO, Leonova J, Elebring T, Nilsson K, Drmota T, Greasley PJ. (2007)
The orphan receptor GPR55 is a novel cannabinoid receptor.
Br J Pharmacol, 152: 1092-1101. [PMID:17876302]