cebranopadol

Ligand id: 8866

Name: cebranopadol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 28.26
Molecular weight 378.21
XLogP 5.96
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

References
1. Lambert DG, Bird MF, Rowbotham DJ. (2015)
Cebranopadol: a first in-class example of a nociceptin/orphanin FQ receptor and opioid receptor agonist.
Br J Anaesth114 (3): 364-6. [PMID:25248647]
2. Linz K, Christoph T, Tzschentke TM, Koch T, Schiene K, Gautrois M, Schröder W, Kögel BY, Beier H, Englberger W et al.. (2014)
Cebranopadol: a novel potent analgesic nociceptin/orphanin FQ peptide and opioid receptor agonist.
J. Pharmacol. Exp. Ther.349 (3): 535-48. [PMID:24713140]
3. Schunk S, Linz K, Hinze C, Frormann S, Oberbörsch S, Sundermann B, Zemolka S, Englberger W, Germann T, Christoph T et al.. (2014)
Discovery of a Potent Analgesic NOP and Opioid Receptor Agonist: Cebranopadol.
ACS Med Chem Lett5 (8): 857-62. [PMID:25147603]