Molecule

ID:15262

General Information
Structure
MolImage
Molecular Formula
C₁₈H₁₀F₁₄O₂Si
Molecular Mass
552.3339448
Exact Mass
552.02265117
Charge
0
InChI
InChI=1S/C18H10F14O2Si/c1-3-33-35(34-4-2,15-11(23)7(19)5(17(27,28)29)8(20)12(15)24)16-13(25)9(21)6(18(30,31)32)10(22)14(16)26/h3-4H2,1-2H3
InChIKey
OWTBYQCFUUXZMA-UHFFFAOYSA-N
Canonic Smiles
CCO[Si](c1c(F)c(F)c(c(c1F)F)C(F)(F)F)(c1c(F)c(F)c(c(c1F)F)C(F)(F)F)OCC
Isomeric Smiles
[Si](OCC)(OCC)(c1c(c(c(c(c1F)F)C(F)(F)F)F)F)c1c(c(c(c(c1F)F)C(F)(F)F)F)F
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
7.6214
LogD (pH = 7.4)
7.6214
Log P
7.6214
Molar Refractivity
88.2182
Polarizability
33.53805
Polar Surface Area
18.46
Rotatable Bonds
8
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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