Molecule

ID:87285

General Information
Structure
MolImage
Molecular Formula
C₂₀H₄₁Br
Molecular Mass
361.44354
Exact Mass
360.23916331
Charge
0
InChI
InChI=1S/C20H41Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h2-20H2,1H3
InChIKey
CZASMUMJSKOHFJ-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCCCCCBr
Isomeric Smiles
BrCCCCCCCCCCCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
9.458508
LogD (pH = 7.4)
9.458508
Log P
9.458508
Molar Refractivity
101.7854
Polarizability
40.10876
Polar Surface Area
0.0
Rotatable Bonds
18
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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