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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL44814
CHEMBL44814
Compound Name CARBON TETRACHLORIDE
ChEMBL Synonyms Carbon Tetrachloride
Max Phase 0
Trade Names
Molecular Formula CCl4

Additional synonyms for CHEMBL44814 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES ClC(Cl)(Cl)Cl
Standard InChI InChI=1S/CCl4/c2-1(3,4)5
Standard InChI Key VZGDMQKNWNREIO-UHFFFAOYSA-N

Molecule Features

CHEMBL44814 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 3 structural alerts for CHEMBL44814. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL44814

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
153.8 151.8754 3.58 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
- - 2.92 2.92 0 5 0.47

Compound Cross References

ChemSpider ChemSpider:VZGDMQKNWNREIO-UHFFFAOYSA-N
PubChem SID: 17389121 SID: 17389990
Wikipedia Carbon_tetrachloride

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL44814



ACToR 56-23-5
Atlas carbon tetrachloride
ChEBI 27385
eMolecules 475296
FDA SRS CL2T97X0V0
Human Metabolome Database HMDB31330
IBM Patent System 3B7ECF025B67391EA935D058E775B318 BE229824460BB1546842009F5366FA5F
KEGG Ligand C07561
Mcule MCULE-3052028115
MolPort MolPort-000-871-945
Nikkaji J2.317E
PubChem 5943
PubChem: Thomson Pharma 14747943
SureChEMBL SCHEMBL100

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