Molecule

ID:15937

General Information
Structure
MolImage
Molecular Formula
C₃₈H₇₀O₂
Molecular Mass
558.9612
Exact Mass
558.53758148
Charge
0
InChI
InChI=1S/C38H70O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-35-39-37-33-29-30-34-38(37)40-36-32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-30,33-34H,3-28,31-32,35-36H2,1-2H3
InChIKey
IEXKETVYEHZCDX-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCOc1ccccc1OCCCCCCCCCCCCCCCC
Isomeric Smiles
c1(c(cccc1)OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
14.975349
LogD (pH = 7.4)
14.975349
Log P
14.975349
Molar Refractivity
177.1556
Polarizability
70.73825
Polar Surface Area
18.46
Rotatable Bonds
32
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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