enoximone   Click here for help

GtoPdb Ligand ID: 9063

Synonyms: fenoximone | MDL 17,043 | MDL-17,043 | MDL-17043 | Perfan®
Approved drug
enoximone is an approved drug (UK)
Compound class: Synthetic organic
Comment: Enoximone is a selective phosphodiesterase inhibitor, targeting PDE3 subtypes [2]. It is a cardiotonic agent [1,3].
Click here for help
IUPHAR Pharmacology Education Project (PEP) logo

View more information in the IUPHAR Pharmacology Education Project: enoximone

2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 91.02
Molecular weight 248.06
XLogP 2.39
No. Lipinski's rules broken 0
Click here for help
Canonical SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Isomeric SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (UK)
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
5582 enoximone
Synonyms Click here for help
fenoximone | MDL 17,043 | MDL-17,043 | MDL-17043 | Perfan®
Database Links Click here for help
BindingDB Ligand 50241379
CAS Registry No. 77671-31-9 (source: PubChem)
ChEMBL Ligand CHEMBL249856
DrugBank Ligand DB04880
DrugCentral Ligand 1014
GtoPdb PubChem SID 315661148
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
Search PubMed titles enoximone
Search PubMed titles/abstracts enoximone
UniChem Compound Search for chemical match using the InChIKey ZJKNESGOIKRXQY-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey ZJKNESGOIKRXQY-UHFFFAOYSA-N

Product suppliers

View disclaimer

Enoximone (links to external site)
Cat. No. 1693