Molecule
ID:66155
General Information
Molecular Formula
C₁₁H₂₀F₂
Molecular Mass
190.2733064
Exact Mass
190.15330708
Charge
0
InChI
InChI=1S/C11H20F2/c1-2-3-4-5-10-6-8-11(12,13)9-7-10/h10H,2-9H2,1H3
InChIKey
AKBCNUYALVQUGW-UHFFFAOYSA-N
Canonic Smiles
CCCCCC1CCC(CC1)(F)F
Isomeric Smiles
C1(CCC(CC1)CCCCC)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.219562
LogD (pH = 7.4)
4.219562
Log P
4.219562
Molar Refractivity
51.1544
Polarizability
19.66373
Polar Surface Area
0.0
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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