Molecule

ID:134441

General Information
Structure
MolImage
Molecular Formula
C₁₃H₂₄O₃Si
Molecular Mass
256.41336
Exact Mass
256.14947116
Charge
0
InChI
InChI=1S/C13H24O3Si/c1-4-14-17(15-5-2,16-6-3)13-10-11-7-8-12(13)9-11/h7-8,11-13H,4-6,9-10H2,1-3H3/t11-,12+,13?/m0/s1
InChIKey
HHKDWDAAEFGBAC-LAGVYOHYSA-N
Canonic Smiles
CCO[Si](C1C[C@@H]2C[C@H]1C=C2)(OCC)OCC
Isomeric Smiles
CCO[Si](C1C[C@@H]2C[C@H]1C=C2)(OCC)OCC
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
2.7564
LogD (pH = 7.4)
2.7564
Log P
2.7564
Molar Refractivity
65.7072
Polarizability
27.989712
Polar Surface Area
27.69
Rotatable Bonds
7
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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