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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL2105852
CHEMBL2105852
Compound Name CALCIUM BROMIDE
ChEMBL Synonyms CALCIUM BROMIDE
Max Phase 0
Trade Names
Molecular Formula Br2Ca

Additional synonyms for CHEMBL2105852 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Ca+2].[Br-].[Br-]
Standard InChI InChI=1S/2BrH.Ca/h2*1H;/q;;+2/p-2
Standard InChI Key WGEFECGEFUFIQW-UHFFFAOYSA-L

Sources

  • PubChem BioAssays
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL2105852

Molecule Features

CHEMBL2105852 compound icon
Drug Type:Inorganic Rule of Five:N First In Class:N Chirality:Unknown Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

ClinicalTrials.gov CALCIUM BROMIDE
The Cochrane Collaboration CALCIUM BROMIDE

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
199.9 197.7993 - - - -


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


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

Structural Alerts

There are no structural alerts for CHEMBL2105852

Compound Cross References

ChemSpider ChemSpider:WGEFECGEFUFIQW-UHFFFAOYSA-L
PubChem SID: 144212176

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL2105852



ACToR 7789-41-5
ChEBI 31338
ChemicalBook CB3210471
eMolecules 882253 506042
EPA CompTox Dashboard DTXSID0044577
FDA SRS 87CNY2EEBH
KEGG Ligand C13189
MolPort MolPort-006-119-093
Nikkaji J43.725E
PubChem 5360316 24608
PubChem: Thomson Pharma 14773079 16878286
SureChEMBL SCHEMBL26682

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