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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1208163
CHEMBL1208163
Compound Name
ChEMBL Synonyms Sodium peroxydisulfate | Sodium Persulfate | Sodium peroxy disulfate
Max Phase 0
Trade Names
Molecular Formula H2O8S2

Additional synonyms for CHEMBL1208163 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES OS(=O)(=O)OOS(=O)(=O)O
Standard InChI InChI=1S/H2O8S2/c1-9(2,3)7-8-10(4,5)6/h(H,1,2,3)(H,4,5,6)
Standard InChI Key JRKICGRDRMAZLK-UHFFFAOYSA-N

Sources

  • Gene Expression Atlas Compounds
  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1208163

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
194.1 193.9191 -1.46 3 127.2 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
6 2 0 8 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
-6.26 - -1.42 -5.92 0 10 0.32

Structural Alerts

There are 11 structural alerts for CHEMBL1208163. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:JRKICGRDRMAZLK-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1208163



ACToR 13445-49-3
BindingDB 50147631
ChEBI 29268
eMolecules 10336941
EPA CompTox Dashboard DTXSID00894926
FDA SRS 2RQ1860626
Human Metabolome Database HMDB0059920
Nikkaji J96.367D
PubChem 24413
PubChem: Thomson Pharma 15322321
SureChEMBL SCHEMBL7217
ZINC ZINC000245189273

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