Molecule
ID:73734
General Information
Molecular Formula
C₁₁H₂₂
Molecular Mass
154.29238
Exact Mass
154.1721507
Charge
0
InChI
InChI=1S/C11H22/c1-4-5-6-7-8-9-10-11(2)3/h2,4-10H2,1,3H3
InChIKey
HLMACKQLXSEXIY-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCC(=C)C
Isomeric Smiles
C=C(CCCCCCCC)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.848786
LogD (pH = 7.4)
4.848786
Log P
4.848786
Molar Refractivity
52.1383
Polarizability
20.835823
Polar Surface Area
0.0
Rotatable Bonds
7
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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