Molecule

ID:73795

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₂
Molecular Mass
132.20228
Exact Mass
132.09390038
Charge
0
InChI
InChI=1S/C10H12/c1-3-6-10-8-5-4-7-9(10)2/h3-5,7-8H,1,6H2,2H3
InChIKey
SVIHJJUMPAUQNO-UHFFFAOYSA-N
Canonic Smiles
C=CCc1ccccc1C
Isomeric Smiles
C=CCc1c(cccc1)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.585238
LogD (pH = 7.4)
3.585238
Log P
3.585238
Molar Refractivity
45.3865
Polarizability
17.475256
Polar Surface Area
0.0
Rotatable Bonds
2
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
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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