Molecule

ID:93554

General Information
Structure
MolImage
Molecular Formula
C₇H₉F₉O₄SSi
Molecular Mass
388.2800888
Exact Mass
387.98471028
Charge
0
InChI
InChI=1S/C7H9F9O4SSi/c1-22(2,3)20-21(17,18)7(15,16)6(13,14)19-5(11,12)4(8,9)10/h1-3H3
InChIKey
TXHZECVJWFWGDH-UHFFFAOYSA-N
Canonic Smiles
C[Si](OS(=O)(=O)C(C(OC(C(F)(F)F)(F)F)(F)F)(F)F)(C)C
Isomeric Smiles
O(C(F)(F)C(S(=O)(=O)O[Si](C)(C)C)(F)F)C(C(F)(F)F)(F)F
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
4.8969
LogD (pH = 7.4)
4.8969
Log P
4.8969
Molar Refractivity
51.2705
Polarizability
21.985853
Polar Surface Area
52.6
Rotatable Bonds
7
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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