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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1233550
CHEMBL1233550
Compound Name IODO GROUP
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula HI

Additional synonyms for CHEMBL1233550 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES I
Standard InChI InChI=1S/HI/h1H
Standard InChI Key XMBWDFGMSWQBCA-UHFFFAOYSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1233550

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
127.9 127.9123 0.62 0 0 -


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - - - 0 1 0.42

Structural Alerts

There are 3 structural alerts for CHEMBL1233550. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:XMBWDFGMSWQBCA-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1233550



ACToR 17144-19-3 10034-85-2 142733-60-6
Brenda 16451
ChEBI 43451
ChemicalBook CB7852570
eMolecules 475248
EPA CompTox Dashboard DTXSID2044349
FDA SRS 694C0EFT9Q
Human Metabolome Database HMDB0059634
KEGG Ligand C05590
Mcule MCULE-6152801555
Metabolights MTBLC43451
MolPort MolPort-001-783-703
Nikkaji J95.185D J1.900.581J
PubChem 24841 21844680
PubChem: Thomson Pharma 14793753 15146578
SureChEMBL SCHEMBL527

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