Molecule

ID:8535

General Information
Structure
MolImage
Molecular Formula
C₁₃H₁₁F
Molecular Mass
186.2248432
Exact Mass
186.08447857
Charge
0
InChI
InChI=1S/C13H11F/c14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-9H,10H2
InChIKey
YWWVDXKZLGXVHT-UHFFFAOYSA-N
Canonic Smiles
Fc1ccccc1Cc1ccccc1
Isomeric Smiles
c1ccc(c(c1)Cc1ccccc1)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.2077417
LogD (pH = 7.4)
4.2077417
Log P
4.2077417
Molar Refractivity
56.0116
Polarizability
21.348318
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
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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