Molecule

ID:112676

General Information
Structure
MolImage
Molecular Formula
C₁₈H₃₀
Molecular Mass
246.4308
Exact Mass
246.23475096
Charge
0
InChI
InChI=1S/C18H30/c1-3-4-5-6-7-8-10-13-17(2)16-18-14-11-9-12-15-18/h9,11-12,14-15,17H,3-8,10,13,16H2,1-2H3
InChIKey
SQYPBKUOPGOKPT-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCC(Cc1ccccc1)C
Isomeric Smiles
CCCCCCCCCC(C)Cc1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
7.2193727
LogD (pH = 7.4)
7.2193727
Log P
7.2193727
Molar Refractivity
81.6578
Polarizability
32.476112
Polar Surface Area
0.0
Rotatable Bonds
10
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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