daporinad

Ligand id: 7745

Name: daporinad

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 10
Topological polar surface area 62.3
Molecular weight 391.23
XLogP 5.44
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(E)-N-[4-[1-(benzoyl)piperidin-4-yl]butyl]-3-pyridin-3-ylprop-2-enamide
International Nonproprietary Names
INN number INN
8912 daporinad
Synonyms
APO-866 | FK-866 | FK866
Database Links
CAS Registry No. 658084-64-1
ChEMBL Ligand CHEMBL566757
GtoPdb PubChem SID 223366078
PubChem CID 6914657
RCSB PDB Ligand DGB
Search Google for chemical match using the InChIKey KPBNHDGDUADAGP-VAWYXSNFSA-N
Search Google for chemicals with the same backbone KPBNHDGDUADAGP
Search PubMed clinical trials daporinad
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Search UniChem for chemical match using the InChIKey KPBNHDGDUADAGP-VAWYXSNFSA-N
Search UniChem for chemicals with the same backbone KPBNHDGDUADAGP
Comments
FK866 is a highly specific non-competitive inhibitor of nicotinamide phosphoribosyltransferase (NAMPT; P43490) [2], an enzyme required for the biosynthesis of nicotinamide adenine dinucleotide (NAD+).