CVT-6883

Ligand id: 5615

Name: CVT-6883

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 90.5
Molecular weight 446.17
XLogP 5.4
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-ethyl-1-propyl-8-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-7H-purine-2,6-dione
Synonyms
CVT 6883 | CVT6883
Database Links
CAS Registry No. 752222-83-6 (source: SciFinder)
ChEMBL Ligand CHEMBL260933
GtoPdb PubChem SID 178102249
PubChem CID 11270783
Search Google for chemical match using the InChIKey KOYXXLLNCXWUNF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KOYXXLLNCXWUNF
Search UniChem for chemical match using the InChIKey KOYXXLLNCXWUNF-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KOYXXLLNCXWUNF

Product suppliers

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Tocris
GS 6201
Cat. No. 4727