Molecule

ID:110956

General Information
Structure
MolImage
Molecular Formula
C₃H₆Br₂
Molecular Mass
201.88774
Exact Mass
199.88362419
Charge
0
InChI
InChI=1S/C3H6Br2/c1-3(5)2-4/h3H,2H2,1H3
InChIKey
XFNJYAKDBJUJAJ-UHFFFAOYSA-N
Canonic Smiles
BrCC(Br)C
Isomeric Smiles
CC(Br)CBr
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.2880702
LogD (pH = 7.4)
2.2880702
Log P
2.2880702
Molar Refractivity
31.0414
Polarizability
12.187596
Polar Surface Area
0.0
Rotatable Bonds
1
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
No Data Available
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Molecule Details
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References
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Bioactivity
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