lemborexant

Ligand id: 9302

Name: lemborexant

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 77
Molecular weight 410.16
XLogP 4.45
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(1R,2S)-2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]-2-(3-fluorophenyl)-N-(5-fluoropyridin-2-yl)cyclopropane-1-carboxamide
International Nonproprietary Names
INN number INN
9988 lemborexant
Synonyms
compound 34 [PMID: 25953512] | E-2006 | E2006
Database Links
CAS Registry No. 1369764-02-2 (source: WHO INN record)
ChEMBL Ligand CHEMBL3545367
PubChem CID 56944144
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Comments
Lemborexant (E2006) is an orally active, potent dual orexin receptor antagonist (DORA) [1].