isosorbide dinitrate

Ligand id: 7051

Name: isosorbide dinitrate

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 123.2
Molecular weight 236.03
XLogP 0.04
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (no history prior to 1968))
IUPAC Name
[(3S,3aS,6R,6aS)-6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[2,3-d]furan-3-yl] nitrate
International Nonproprietary Names
INN number INN
996 isosorbide dinitrate
Synonyms
Dilatrate-Sr® | ISDN | Isordil®
Database Links
CAS Registry No. 87-33-2 (source: Scifinder)
ChEMBL Ligand CHEMBL6622
DrugBank Ligand DB00883
PubChem CID 6883
Search Google for chemical match using the InChIKey MOYKHGMNXAOIAT-JGWLITMVSA-N
Search Google for chemicals with the same backbone MOYKHGMNXAOIAT
Search PubMed clinical trials isosorbide dinitrate
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Search UniChem for chemical match using the InChIKey MOYKHGMNXAOIAT-JGWLITMVSA-N
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Wikipedia Isosorbide_dinitrate
Comments
Isosorbide dinitrate acts as a vasodilator. It is similar to nitroglycerin, but is slower to act.