Molecule

ID:70221

General Information
Structure
MolImage
Molecular Formula
C₂₄H₁₅Br
Molecular Mass
383.2799
Exact Mass
382.03571248
Charge
0
InChI
InChI=1S/C24H15Br/c25-24-21-13-5-3-11-19(21)23(20-12-4-6-14-22(20)24)18-15-7-9-16-8-1-2-10-17(16)18/h1-15H
InChIKey
SYACRXBYRNYMLN-UHFFFAOYSA-N
Canonic Smiles
Brc1c2ccccc2c(c2c1cccc2)c1cccc2c1cccc2
Isomeric Smiles
c1cccc2c(c3ccccc3c(c12)Br)c1cccc2ccccc12
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
7.357654
LogD (pH = 7.4)
7.357654
Log P
7.357654
Molar Refractivity
108.1676
Polarizability
46.67931
Polar Surface Area
0.0
Rotatable Bonds
0
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
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References
Bioactivity
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