Molecule

ID:107615

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₄
Molecular Mass
134.21816
Exact Mass
134.10955045
Charge
0
InChI
InChI=1S/C10H14/c1-7-5-9(3)10(4)6-8(7)2/h5-6H,1-4H3
InChIKey
SQNZJJAZBFDUTD-UHFFFAOYSA-N
Canonic Smiles
Cc1cc(C)c(cc1C)C
Isomeric Smiles
Cc1cc(C)c(C)cc1C
Calculated Properties
JChem
LogD (pH = 7.4)
4.03
LogD (pH = 5.5)
4.03
Log P
4.03
Rotatable Bonds
0
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
true
Polar Surface Area
0.00
Polarizability
17.15
Molar Refractivity
46.22
LOG S
-3.44
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation