apremilast

Ligand id: 7372

Name: apremilast

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 127.46
Molecular weight 460.13
XLogP 2.06
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (2014))
IUPAC Name
N-[2-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1,3-dioxoisoindol-4-yl]acetamide
International Nonproprietary Names
INN number INN
8872 apremilast
Synonyms
CC-10004 | Otezla®
Database Links
CAS Registry No. 608141-41-9 (source: SciFinder)
ChEMBL Ligand CHEMBL514800
PubChem CID 11561674
Search Google for chemical match using the InChIKey IMOZEMNVLZVGJZ-QGZVFWFLSA-N
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Wikipedia Apremilast
Comments
Apremilast is an oral small molecule phosphodiesterase 4 (PDE4) inhibitor [1-2] (additional comment in [3]). It is selective for PDE4 over other PDE isozymes, but non-selective over PDE4 isoforms [4].