Molecule

ID:73796

General Information
Structure
MolImage
Molecular Formula
C₁₁H₁₄
Molecular Mass
146.22886
Exact Mass
146.10955045
Charge
0
InChI
InChI=1S/C11H14/c1-3-4-8-11-9-6-5-7-10(11)2/h3,5-7,9H,1,4,8H2,2H3
InChIKey
RBXMJJPKDPWGKJ-UHFFFAOYSA-N
Canonic Smiles
C=CCCc1ccccc1C
Isomeric Smiles
C=CCCc1ccccc1C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.0298066
LogD (pH = 7.4)
4.0298066
Log P
4.0298066
Molar Refractivity
49.9875
Polarizability
19.239618
Polar Surface Area
0.0
Rotatable Bonds
3
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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