pinacidil   Click here for help

GtoPdb Ligand ID: 2412

Synonyms: pinacidil hydrate | Pindac®
Approved drug
pinacidil is an approved drug (FDA (1989))
Compound class: Synthetic organic
Comment: Pinacidil is a cyanoguanidine anti-hypertensive drug, which acts as an ATP-sensitive potassium channel opener in smooth muscle cells.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 73.1
Molecular weight 245.16
XLogP 2.19
No. Lipinski's rules broken 0
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Canonical SMILES CC(C(C)(C)C)N=C(Nc1ccncc1)NC#N
Isomeric SMILES CC(C(C)(C)C)N=C(Nc1ccncc1)NC#N
InChI InChI=1S/C13H19N5/c1-10(13(2,3)4)17-12(16-9-14)18-11-5-7-15-8-6-11/h5-8,10H,1-4H3,(H2,15,16,17,18)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1989))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
5013 pinacidil
Synonyms Click here for help
pinacidil hydrate | Pindac®
Database Links Click here for help
BindingDB Ligand 50240750
CAS Registry No. 60560-33-0 (source: Scifinder)
ChEBI CHEBI:287515
ChEMBL Ligand CHEMBL1159
DrugCentral Ligand 2173
GtoPdb PubChem SID 135650826
PubChem CID 4826
Search Google for chemical match using the InChIKey IVVNZDGDKPTYHK-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey IVVNZDGDKPTYHK-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey IVVNZDGDKPTYHK-UHFFFAOYSA-N
Wikipedia Pinacidil