cinacalcet

Ligand Id: 3308
Ligand name cinacalcet

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 12.03
Molecular weight 357.17
XLogP 9.81
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
Approved drug? Yes (source: FDA (2004))
DrugBank groups approved
IUPAC Name
N-[(1R)-1-naphthalen-1-ylethyl]-3-[3-(trifluoromethyl)phenyl]propan-1-amine
International Nonproprietary Names
INN number INN
8287 cinacalcet
Database Links
CAS Registry No. 226256-56-0 (source: Scifinder)
ChEMBL Ligand CHEMBL1201284
DrugBank Ligand DB01012
PubChem CID 156419
Search Google for chemical match using the InChIKey VDHAWDNDOKGFTD-MRXNPFEDSA-N
Search Google for chemicals with the same backbone VDHAWDNDOKGFTD
Search PubMed clinical trials cinacalcet
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Wikipedia Cinacalcet
ZINC ZINC01550499
Comments
Cinacalcet is an allosteric activator the calcium-sensing receptor, thus mimicking the effect of calcium on tissues expressing this receptor.