Molecule

ID:93683

General Information
Structure
MolImage
Molecular Formula
C₃H₄Br₂ClF
Molecular Mass
254.3232632
Exact Mass
251.83523003
Charge
0
InChI
InChI=1S/C3H4Br2ClF/c1-3(5,7)2(4)6/h2H,1H3
InChIKey
WBKNWEJIMRYZJQ-UHFFFAOYSA-N
Canonic Smiles
ClC(C(Br)(F)C)Br
Isomeric Smiles
BrC(Cl)C(Br)(C)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.2884858
LogD (pH = 7.4)
2.2884858
Log P
2.2884858
Molar Refractivity
36.5003
Polarizability
14.23956
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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