Δ12-PGJ2

Ligand id: 1876

Name: Δ12-PGJ2

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 12
Topological polar surface area 74.6
Molecular weight 334.21
XLogP 3.91
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
(Z)-7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-oxo-1-cyclopent-2-enyl]hept-5-enoic acid
Synonyms
Dddd-PGD2 | delta(12)-PGJ2 | delta-12-prostaglandin D2
Database Links
CAS Registry No. 87893-54-7
ChEBI CHEBI:28130
ChEMBL Ligand CHEMBL519797
PubChem CID 5280885
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