pinacidil

Ligand id: 2412

Name: pinacidil

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 73.1
Molecular weight 245.16
XLogP 2.81
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1989))
IUPAC Name
3-cyano-2-(3,3-dimethylbutan-2-yl)-1-pyridin-4-ylguanidine
International Nonproprietary Names
INN number INN
5013 pinacidil
Synonyms
pinacidil hydrate | Pindac®
Database Links
BindingDB Ligand 50240750
CAS Registry No. 60560-33-0 (source: Scifinder)
ChEBI CHEBI:287515
ChEMBL Ligand CHEMBL1159
GtoPdb PubChem SID 135650826
PubChem CID 4826
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Search UniChem for chemical match using the InChIKey IVVNZDGDKPTYHK-UHFFFAOYSA-N
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Wikipedia Pinacidil
Comments
Pinacidil is a cyanoguanidine anti-hypertensive drug, which acts as an ATP-sensitive potassium channel opener in smooth muscle cells.