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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1207889
CHEMBL1207889
Compound Name
ChEMBL Synonyms Sodium Fluorosulfate | Sodium Sulfofluoridate
Max Phase 0
Trade Names
Molecular Formula HFO3S

Additional synonyms for CHEMBL1207889 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES OS(=O)(=O)F
Standard InChI InChI=1S/FHO3S/c1-5(2,3)4/h(H,2,3,4)
Standard InChI Key UQSQSQZYBQSBJZ-UHFFFAOYSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1207889

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
100.1 99.963 -0.24 0 54.37 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 1 0 3 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
-6.29 - -.55 -4.05 0 5 0.34

Structural Alerts

There are 17 structural alerts for CHEMBL1207889. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:UQSQSQZYBQSBJZ-UHFFFAOYSA-N
PubChem SID: 144209345 SID: 17388999

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1207889



ACToR 7789-21-1
BindingDB 50147628
eMolecules 907686
EPA CompTox Dashboard DTXSID3033511
FDA SRS PPX0648643
MolPort MolPort-001-775-455
Nikkaji J95.177C
PubChem 22465582 24603
PubChem: Thomson Pharma 15170452
SureChEMBL SCHEMBL1938
ZINC ZINC000238809473

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