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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1689064
CHEMBL1689064
Compound Name HYDROXYL RADICAL
ChEMBL Synonyms Hydroxyl Radical
Max Phase 0
Trade Names
Molecular Formula HO

Additional synonyms for CHEMBL1689064 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [OH]
Standard InChI InChI=1S/HO/h1H
Standard InChI Key TUJKJAMUKRIRHC-UHFFFAOYSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1689064

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
17 17.0027 -0.18 0 30 -


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - - - 0 1 0.38

Structural Alerts

There are no structural alerts for CHEMBL1689064

Compound Cross References

ChemSpider ChemSpider:TUJKJAMUKRIRHC-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1689064



Brenda 66807 144051
ChEBI 29191
KEGG Ligand C16844
Nikkaji J408.680E J2.656.835H
PubChem 157350
PubChem: Thomson Pharma 14747255
SureChEMBL SCHEMBL2523

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