PGE2

Ligand id: 1883

Name: PGE2

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Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 12
Topological polar surface area 94.83
Molecular weight 352.22
XLogP 2.79
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
Approved drug? Yes (FDA (1977))
WHO Essential Medicine WHO Model List of Essential Medicines (21st List, 2019). Access PDF version.
IUPAC Name
(Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
International Nonproprietary Names
INN number INN
3075 dinoprostone
Synonyms
Cervidil® | minprositin E2 | minprostin E2 | Propess® | prostaglandin E2
Comments
PGE2 is a the major endogenous prostaglandin. Synthetic PGE2 is known as dinoprostone. PGE2 activates prostanoid family GPCRs.
Database Links
CAS Registry No. 363-24-6
ChEBI CHEBI:116390
ChEMBL Ligand CHEMBL548
DrugBank Ligand DB00917
GtoPdb PubChem SID 135651539
PubChem CID 5280360
RCSB PDB Ligand P2E
Search Google for chemical match using the InChIKey XEYBRNLFEZDVAW-ARSRFYASSA-N
Search Google for chemicals with the same backbone XEYBRNLFEZDVAW
Search PubMed clinical trials dinoprostone
Search PubMed titles dinoprostone
Search PubMed titles/abstracts dinoprostone
Search UniChem for chemical match using the InChIKey XEYBRNLFEZDVAW-ARSRFYASSA-N
Search UniChem for chemicals with the same backbone XEYBRNLFEZDVAW
Wikipedia Prostaglandin_E2

Product suppliers

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Tocris
Prostaglandin E2
Cat. No. 2296