Ligand Id: 1881
Ligand name PGD2

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 2.9
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Summary Biological activity References Structure Similar ligands Radio analogues Suppliers
Classification
Compound class Metabolite or derivative
IUPAC Name
(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-3-oxocyclopentyl]hept-5-enoic acid
Synonyms
11-dehydroprostaglandin F2-α
9S,15S-dihydroxy-11-oxo-5Z,13E-prostadienoic acid
BRN 2170623
PGD2
prostaglandin D2
Database Links
CAS Registry No. 41598-07-6 (source: ChEBI)
ChEBI CHEBI:15555
ChEMBL Ligand 376798, 403320
Human Metabolome Database HMDB01403
PubChem CID 448457
RCSB PDB Ligand PG2
Search Google for chemical match using the InChIKey BHMBVRSPMRCCGG-OUTUXVNYSA-N
Search Google for chemicals with the same backbone BHMBVRSPMRCCGG
Wikipedia Prostaglandin_D2
ZINC ZINC18130819

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