nicorandil

Ligand id: 2411

Name: nicorandil

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 94.36
Molecular weight 211.06
XLogP 0.67
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (source: UK (2009))
IUPAC Name
2-(pyridine-3-carbonylamino)ethyl nitrate
International Nonproprietary Names
INN number INN
4933 nicorandil
Synonyms
Ikorel®
SG-75
Database Links
CAS Registry No. 65141-46-0 (source: Scifinder)
ChEBI CHEBI:31905
ChEMBL Ligand CHEMBL284906
PubChem CID 47528
Search Google for chemical match using the InChIKey LBHIOVVIQHSOQN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LBHIOVVIQHSOQN
Search PubMed clinical trials nicorandil
Search PubMed titles nicorandil
Search PubMed titles/abstracts nicorandil
Wikipedia Nicorandil
Comments
Nicorandil is an antianginal medication that acts as an adenosine triphosphate (ATP)-sensitive K+ (K(ATP)) channel opener and a nitrate [1].