Molecule

ID:32160

General Information
Structure
MolImage
Molecular Formula
C₅H₉Br
Molecular Mass
149.02896
Exact Mass
147.98876229
Charge
0
InChI
InChI=1S/C5H9Br/c1-2-3-4-5-6/h2H,1,3-5H2
InChIKey
LPNANKDXVBMDKE-UHFFFAOYSA-N
Canonic Smiles
BrCCCC=C
Isomeric Smiles
C=CCCCBr
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.4859898
LogD (pH = 7.4)
2.4859898
Log P
2.4859898
Molar Refractivity
32.8145
Polarizability
12.393583
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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