nicorandil

Ligand Id: 2411
Ligand name nicorandil

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
IUPAC Name
2-(pyridine-3-carbonylamino)ethyl nitrate
International Nonproprietary Names
INN number INN
4933 nicorandil
Database Links
CAS Registry No. 65141-46-0 (source: Scifinder)
ChEBI CHEBI:137980
ChEMBL Ligand 137980
PubChem CID 47528
Search Google for chemical match using the InChIKey LBHIOVVIQHSOQN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LBHIOVVIQHSOQN
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Wikipedia Nicorandil
ZINC ZINC01533102