Molecule

ID:66067

General Information
Structure
MolImage
Molecular Formula
C₁₅H₁₄F₂
Molecular Mass
232.2684664
Exact Mass
232.10635689
Charge
0
InChI
InChI=1S/C15H14F2/c16-15(17,14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKey
AXLZISRMDBEUDI-UHFFFAOYSA-N
Canonic Smiles
FC(c1ccccc1)(CCc1ccccc1)F
Isomeric Smiles
c1ccccc1C(CCc1ccccc1)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.825642
LogD (pH = 7.4)
4.825642
Log P
4.825642
Molar Refractivity
65.3286
Polarizability
24.724693
Polar Surface Area
0.0
Rotatable Bonds
4
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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