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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL156378
CHEMBL156378
Compound Name BROMOETHANE
ChEMBL Synonyms Bromo-Ethane | Bromoethane | Ethylbromidium | Ethyl Bromide
Max Phase 0
Trade Names
Molecular Formula C2H5Br

Additional synonyms for CHEMBL156378 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCBr
Standard InChI InChI=1S/C2H5Br/c1-2-3/h2H2,1H3
Standard InChI Key RDHPKYGYEGBMSE-UHFFFAOYSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL156378

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
109 107.9575 1.4 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
- - 1.81 1.81 0 3 0.41

Structural Alerts

There are 8 structural alerts for CHEMBL156378. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:RDHPKYGYEGBMSE-UHFFFAOYSA-N
PubChem SID: 144207553 SID: 17390006
Wikipedia Bromoethane

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL156378



ACToR 74-96-4
Brenda 12460
eMolecules 475226
EPA CompTox Dashboard DTXSID6020199
FDA SRS LI8384T9PH
KEGG Ligand C19354
Mcule MCULE-9840669634
MolPort MolPort-000-872-074
Nikkaji J2.383C
NMRShiftDB 10005619
PDBe BBX
PubChem 6332
PubChem: Thomson Pharma 15218785
SureChEMBL SCHEMBL2322

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