ChEMBL logo

ChEMBL

spacer
ChEMBL Statistics
  Loading Statistics...
spacer

Compound Report Card

Compound Name and Classification

Compound ID CHEMBL185537
CHEMBL185537
Compound Name IODIDE
ChEMBL Synonyms I-123
Max Phase 0
Trade Names
Molecular Formula I

Additional synonyms for CHEMBL185537 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [I-]
Standard InChI InChI=1S/HI/h1H/p-1
Standard InChI Key XMBWDFGMSWQBCA-UHFFFAOYSA-M

Structural Alerts

There are 2 structural alerts for CHEMBL185537. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL185537

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
126.9 126.9045 -3.11 0 58.08 -


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 0.31

Compound Cross References

ChemSpider ChemSpider:XMBWDFGMSWQBCA-UHFFFAOYSA-M
Wikipedia Iodide

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL185537



ACToR 20461-54-5
BindingDB 26981
ChEBI 16382
eMolecules 883725
FDA SRS 09G4I6V86Q
Human Metabolome Database HMDB12238
KEGG Ligand C00708
Nikkaji J209.354E
PDBe IOD
PubChem 30165
PubChem: Thomson Pharma 15146579
Recon i

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