Ligand Id: 1916
Ligand name [3H]PGE2

2D Structure
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

Summary Biological activity References Structure Similar ligands Radio analogues
Classification
Compound class Metabolite or derivative
IUPAC Name
(Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
Synonyms
[3H]7-[3-hydroxy-2-(3-hydroxyoct-1-enyl)-5-oxo-cyclopentyl]hept-5-enoic acid
[3H]dinoprostone
[3H]minprositin E2
[3H]minprostin E2
[3H]-PGE2
[3H]prepidil
[3H]prostaglandin E2
[3H]prostarmon E
[3H]prostin E2
Database Links
BindingDB Ligand 35847
CAS Registry No. 363-24-6 (source: DrugBank)
ChEBI CHEBI:116390
ChEMBL Ligand 514345, 517974, 114125, 116390, 197398
PharmGKB Drug PA449345
PubChem CID 5280360
Search on ChemSpider XEYBRNLFEZDVAW-ARSRFYASSA-N
iPHACE DP5DIZ6F

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