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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1235997
CHEMBL1235997
Compound Name SULFUR DIOXIDE
ChEMBL Synonyms E220 | Sulfur Dioxide
Max Phase 0
Trade Names
Molecular Formula O2S

Additional synonyms for CHEMBL1235997 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES O=S=O
Standard InChI InChI=1S/O2S/c1-3-2
Standard InChI Key RAHZWNYVWXNFOC-UHFFFAOYSA-N

Molecule Features

CHEMBL1235997 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

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are no structural alerts for CHEMBL1235997

Alternate Forms of Compound in ChEMBL


CHEMBL1235997

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
64.1 63.9619 -0.05 0 45.44 -


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - - - 0 3 0.4

Compound Cross References

ChemSpider ChemSpider:RAHZWNYVWXNFOC-UHFFFAOYSA-N
Wikipedia Sulfur_dioxide

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1235997



ACToR 12624-32-7 12396-99-5 7446-09-5
Atlas sulfur dioxide
ChEBI 18422
eMolecules 495598
FDA SRS 0UZA3422Q4
Human Metabolome Database HMDB34834
KEGG Ligand C09306
Nikkaji J3.737K
NMRShiftDB 20148800
PDBe SO2
PubChem 1119
PubChem: Thomson Pharma 14940409
SureChEMBL SCHEMBL92

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