filorexant

Ligand id: 4460

Name: filorexant

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 68.21
Molecular weight 420.2
XLogP 5.17
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[(2R,5R)-5-[(5-fluoropyridin-2-yl)oxymethyl]-2-methylpiperidin-1-yl]-(5-methyl-2-pyrimidin-2-ylphenyl)methanone
International Nonproprietary Names
INN number INN
9671 filorexant
Synonyms
MK 6096 | MK-6096 | MK6096
Database Links
CAS Registry No. 1088991-73-4
ChEMBL Ligand CHEMBL2107822
PubChem CID 25128145
Search Google for chemical match using the InChIKey NPFDWHQSDBWQLH-QZTJIDSGSA-N
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Search UniChem for chemical match using the InChIKey NPFDWHQSDBWQLH-QZTJIDSGSA-N
Search UniChem for chemicals with the same backbone NPFDWHQSDBWQLH
Wikipedia Filorexant
Comments
Filorexant is a dual orexin receptor antagonist (DORA) [1]. The compound was being developed by Merck Sharp & Dohme Corp. as a potential treatment for insomnia.