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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL2447938
CHEMBL2447938
Compound Name OZONE
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula O3

Additional synonyms for CHEMBL2447938 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [O-][O+]=O
Standard InChI InChI=1S/O3/c1-3-2
Standard InChI Key CBENFWSGALASAD-UHFFFAOYSA-N

Sources

  • Gene Expression Atlas Compounds

Alternate Forms of Compound in ChEMBL


CHEMBL2447938

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
48 47.9847 -1.12 0 51.43 -


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - - - 0 3 0.2

Structural Alerts

There are 9 structural alerts for CHEMBL2447938. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:CBENFWSGALASAD-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL2447938



ACToR 10028-15-6
Atlas 500ppb ozone ozone
Brenda 7264 139502
ChEBI 25812
ChemicalBook CB6851738
DrugBank DB12510
EPA CompTox Dashboard DTXSID0021098
FDA SRS 66H7ZZK23N
Nikkaji J2.505.688D
PubChem 24823
PubChem: Thomson Pharma 15320978
SureChEMBL SCHEMBL17235

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