Molecule

ID:98693

General Information
Structure
MolImage
Molecular Formula
C₁₀H₄Cl₃F₁₇Si
Molecular Mass
581.5561144
Exact Mass
579.88763944
Charge
0
InChI
InChI=1S/C10H4Cl3F17Si/c11-31(12,13)2-1-3(14,15)4(16,17)5(18,19)6(20,21)7(22,23)8(24,25)9(26,27)10(28,29)30/h1-2H2
InChIKey
VIFIHLXNOOCGLJ-UHFFFAOYSA-N
Canonic Smiles
Cl[Si](CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(Cl)Cl
Isomeric Smiles
[Si](CCC(F)(F)C(F)(F)C(F)(F)C(C(F)(F)C(C(C(F)(F)F)(F)F)(F)F)(F)F)(Cl)(Cl)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
8.9884
LogD (pH = 7.4)
8.9884
Log P
8.9884
Molar Refractivity
66.4359
Polarizability
27.754734
Polar Surface Area
0.0
Rotatable Bonds
10
Lipinski's Rule of Five
false
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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