L838417

Ligand id: 4241

Name: L838417

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 83.02
Molecular weight 399.16
XLogP 4.48
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-({[7-tert-butyl-3-(2,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]oxy}methyl)-1-methyl-1H-1,2,4-triazole
Synonyms
L 838,417 | L-838417
Database Links
CAS Registry No. 286456-42-6 (source: Scifinder)
ChEBI CHEBI:435324
ChEMBL Ligand CHEMBL373250
PubChem CID 9908880
Search Google for chemical match using the InChIKey BQDUNOMMYOKHEP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BQDUNOMMYOKHEP
Search UniChem for chemical match using the InChIKey BQDUNOMMYOKHEP-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BQDUNOMMYOKHEP
Wikipedia L-838,417