Molecule

ID:134749

General Information
Structure
MolImage
Molecular Formula
C₉H₁₆O₃Si
Molecular Mass
200.30704
Exact Mass
200.0868709
Charge
0
InChI
InChI=1S/C9H16O3Si/c1-5-11-9(10)7-6-8-12-13(2,3)4/h5,8H2,1-4H3
InChIKey
TYKGOIUOOCPLLA-UHFFFAOYSA-N
Canonic Smiles
CCOC(=O)C#CCO[Si](C)(C)C
Isomeric Smiles
CCOC(=O)C#CCO[Si](C)(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
2.7374
LogD (pH = 7.4)
2.7374
Log P
2.7374
Molar Refractivity
48.7031
Polarizability
20.630245
Polar Surface Area
35.53
Rotatable Bonds
6
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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