enoximone

Ligand id: 9063

Name: enoximone

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 83.5
Molecular weight 248.06
XLogP 2.71
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (UK)
IUPAC Name
4-methyl-5-(4-methylsulfanylbenzoyl)-1,3-dihydroimidazol-2-one
International Nonproprietary Names
INN number INN
5582 enoximone
Synonyms
fenoximone | MDL 17,043 | MDL-17,043 | MDL-17043 | Perfan®
Database Links
BindingDB Ligand 50241379
CAS Registry No. 77671-31-9 (source: PubChem)
ChEMBL Ligand CHEMBL249856
DrugBank Ligand DB04880
PubChem CID 53708
Search Google for chemical match using the InChIKey ZJKNESGOIKRXQY-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ZJKNESGOIKRXQY
Search PubMed clinical trials enoximone
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Search UniChem for chemical match using the InChIKey ZJKNESGOIKRXQY-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ZJKNESGOIKRXQY
Comments
Enoximone is a selective phosphodiesterase inhibitor, targeting PDE3 subtypes [2]. It is a cardiotonic agent [1,3].