Molecule

ID:58419

General Information
Structure
MolImage
Molecular Formula
C₂₀H₃₀
Molecular Mass
270.4522
Exact Mass
270.23475096
Charge
0
InChI
InChI=1S/C20H30/c1-13-2-15-3-14(1)8-19(7-13,9-15)20-10-16-4-17(11-20)6-18(5-16)12-20/h13-18H,1-12H2
InChIKey
MPXKIFWZOQVOLN-UHFFFAOYSA-N
Canonic Smiles
C1C2CC3CC1CC(C2)(C3)C12CC3CC(C2)CC(C1)C3
Isomeric Smiles
C1C2CC3CC1(CC(C2)C3)C12CC3CC(C1)CC(C3)C2
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.023304
LogD (pH = 7.4)
5.023304
Log P
5.023304
Molar Refractivity
82.338
Polarizability
33.229065
Polar Surface Area
0.0
Rotatable Bonds
1
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
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References
Bioactivity
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