Molecule

ID:9701

General Information
Structure
Molecular Formula
C₁₀H₁₁F₅OSi
Molecular Mass
270.271256
Exact Mass
270.0499326
Charge
0
InChI
InChI=1S/C10H11F5OSi/c1-4-16-17(2,3)10-8(14)6(12)5(11)7(13)9(10)15/h4H2,1-3H3
InChIKey
HOENFMGYUBYVDH-UHFFFAOYSA-N
Canonic Smiles
CCO[Si](c1c(F)c(F)c(c(c1F)F)F)(C)C
Isomeric Smiles
c1(c(c(c(c(c1F)[Si](OCC)(C)C)F)F)F)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.9311
LogD (pH = 7.4)
2.9311
Log P
2.9311
Molar Refractivity
49.912
Polarizability
20.25378
Polar Surface Area
9.23
Rotatable Bonds
3
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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