Molecule

ID:111862

General Information
Structure
MolImage
Molecular Formula
C₂₁H₃₆
Molecular Mass
288.51054
Exact Mass
288.28170115
Charge
0
InChI
InChI=1S/C21H36/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21-19-16-14-17-20-21/h14,16-17,19-20H,2-13,15,18H2,1H3
InChIKey
JIRNEODMTPGRGV-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCc1ccccc1
Isomeric Smiles
CCCCCCCCCCCCCCCc1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
8.7106285
LogD (pH = 7.4)
8.7106285
Log P
8.7106285
Molar Refractivity
95.5132
Polarizability
38.016983
Polar Surface Area
0.0
Rotatable Bonds
14
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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