Molecule

ID:111577

General Information
Structure
MolImage
Molecular Formula
C₁₆H₃₀O₄Zn
Molecular Mass
351.787
Exact Mass
350.14355144
Charge
0
InChI
InChI=1S/2C8H16O2.Zn/c2*1-2-3-4-5-6-7-8(9)10;/h2*2-7H2,1H3,(H,9,10);/q;;+2/p-2
InChIKey
CHJMFFKHPHCQIJ-UHFFFAOYSA-L
Canonic Smiles
CCCCCCCC(=O)O[Zn]OC(=O)CCCCCCC
Isomeric Smiles
CCCCCCCC(=O)O[Zn]OC(=O)CCCCCCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
4.356
LogD (pH = 7.4)
4.356
Log P
4.356
Molar Refractivity
78.696
Polarizability
35.06458
Polar Surface Area
52.6
Rotatable Bonds
16
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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