Ligand Id: 2759
Ligand name pregnanedione

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 34.14
Molecular weight 316.24
XLogP 6.54
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Synthetic organic
IUPAC Name
(8S,9S,10S,13R,14S,17S)-17-ethyl-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene-1,2-dione
Synonyms
5β-Pregnane-3,20-dione
Database Links
PubChem CID 21121997
Search on ChemSpider BEKNXRBHZGEANG-HUOPTEJRSA-N
ZINC ZINC65731589, ZINC65731592

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org

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