Molecule
ID:110308
General Information
Molecular Formula
C₁₈H₃₀
Molecular Mass
246.4308
Exact Mass
246.23475096
Charge
0
InChI
InChI=1S/C18H30/c1-7-13-14(8-2)16(10-4)18(12-6)17(11-5)15(13)9-3/h7-12H2,1-6H3
InChIKey
LXSMILGNHYBUCG-UHFFFAOYSA-N
Canonic Smiles
CCc1c(CC)c(CC)c(c(c1CC)CC)CC
Isomeric Smiles
CCc1c(CC)c(CC)c(CC)c(CC)c1CC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
7.721186
LogD (pH = 7.4)
7.721186
Log P
7.721186
Molar Refractivity
83.9112
Polarizability
32.059128
Polar Surface Area
0.0
Rotatable Bonds
6
Lipinski's Rule of Five
false
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
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Molecule Details
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References
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Bioactivity
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