diamorphine

Ligand id: 9082

Name: diamorphine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 65.07
Molecular weight 369.16
XLogP 2.28
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Is prodrug? Yes
Active form morphine
IUPAC Name
[(4R,4aR,7S,7aR,12bS)-9-acetyloxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-yl] acetate
Synonyms
acetomorphine | diacetylmorphine | heroin
Database Links
ChEMBL Ligand CHEMBL459324
DrugBank Ligand DB01452
PubChem CID 5462328
Search Google for chemical match using the InChIKey GVGLGOZIDCSQPN-PVHGPHFFSA-N
Search Google for chemicals with the same backbone GVGLGOZIDCSQPN
Search UniChem for chemical match using the InChIKey GVGLGOZIDCSQPN-PVHGPHFFSA-N
Search UniChem for chemicals with the same backbone GVGLGOZIDCSQPN
Comments
Diamorphine (heroin) is a morphine derivative. It acts as a potent opioid receptor agonist after deacetylation to 6-acetylmorphine and subsequently to morphine [2].
Internationally, heroin is a controlled narcotic drug.