ChEMBL logo

ChEMBL

spacer
ChEMBL Statistics
  Loading Statistics...
spacer

Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1796998
CHEMBL1796998
Compound Name SULFUR HEXAFLUORIDE
ChEMBL Synonyms SULFUR HEXAFLUORIDE | SONOVUE (FOR THE MICROBUBBLE FORMULATION) | BRI
Max Phase 3
Trade Names
Molecular Formula F6S

Additional synonyms for CHEMBL1796998 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES FS(F)(F)(F)(F)F
Standard InChI InChI=1S/F6S/c1-7(2,3,4,5)6
Standard InChI Key SFZCNBIFKDRMGX-UHFFFAOYSA-N

Sources

  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL1796998

Molecule Features

CHEMBL1796998 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
StrokeD020521EFO:0000712stroke2ClinicalTrials

Clinical Data

ClinicalTrials.gov SULFUR HEXAFLUORIDE
The Cochrane Collaboration SULFUR HEXAFLUORIDE

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
146.1 145.9625 3.17 0 0 -


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 1.68 1.68 0 7 0.46

Structural Alerts

There are 7 structural alerts for CHEMBL1796998. To view alerts please click here.

Compound Cross References

ATC V - VARIOUS
V08 - CONTRAST MEDIA
V08D - ULTRASOUND CONTRAST MEDIA
V08DA - Ultrasound contrast media
V08DA05 - sulfur hexafluoride

ChemSpider ChemSpider:SFZCNBIFKDRMGX-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1796998



ACToR 2551-62-4
ChEBI 30496
ChemicalBook CB7724783
DrugBank DB11104
DrugCentral 4039
eMolecules 495600
EPA CompTox Dashboard DTXSID8029656
FDA SRS WS7LR3I1D6
MolPort MolPort-001-776-565
Nikkaji J95.218D
PubChem 17358
PubChem: Thomson Pharma 15321556
SureChEMBL SCHEMBL24171
ZINC ZINC000245224194

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