Molecule

ID:3846

General Information
Structure
MolImage
Molecular Formula
C₁₆H₃₄O₅
Molecular Mass
306.43816
Exact Mass
306.24062419
Charge
0
InChI
InChI=1S/C16H34O5/c1-2-3-4-5-6-7-9-18-11-13-20-15-16-21-14-12-19-10-8-17/h17H,2-16H2,1H3
InChIKey
FEOZZFHAVXYAMB-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCOCCOCCOCCOCCO
Isomeric Smiles
CCCCCCCCOCCOCCOCCOCCO
Calculated Properties
JChem
LogD (pH = 7.4)
2.40
LogD (pH = 5.5)
2.40
Log P
2.40
Rotatable Bonds
18
H Donor
1
H Acceptors
5
Lipinski's Rule of Five
true
Acid pKa
15.12
Polar Surface Area
57.15
Polarizability
38.94
Molar Refractivity
84.71
LOG S
-2.71
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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