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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL44019
CHEMBL44019
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C23H22ClF3O2

Additional synonyms for CHEMBL44019 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cc1c(COC(=O)[C@H]2[C@@H](\C=C(/Cl)\C(F)(F)F)C2(C)C)cccc1c3cc ...
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Standard InChI InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15 ...
Download InChI
Standard InChI Key OMFRMAHOUUJSGP-JHEGMOCKSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL44019

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
422.9 422.126 6.66 5 26.3 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 0 1 2 0 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 7.31 7.31 2 29 0.5

Structural Alerts

There are 5 structural alerts for CHEMBL44019. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:OMFRMAHOUUJSGP-JHEGMOCKSA-N
Wikipedia Bifenthrin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL44019



ChemicalBook CB1714667
eMolecules 26754881
EPA CompTox Dashboard DTXSID9020160
MolPort MolPort-023-220-312
Nikkaji J384.275D J389.190I
PubChem 10938769
PubChem: Thomson Pharma 15991235
SureChEMBL SCHEMBL12410049
ZINC ZINC000004098964

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/OMFRMAHOUUJSGP-JHEGMOCKSA-N spacer
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