Molecule

ID:96816

General Information
Structure
MolImage
Molecular Formula
C₄F₉KO₄S
Molecular Mass
354.1893288
Exact Mass
353.90106514
Charge
0
InChI
InChI=1S/C4HF9O4S.K/c5-1(6,7)2(8,9)17-3(10,11)4(12,13)18(14,15)16;/h(H,14,15,16);/q;+1/p-1
InChIKey
LRLOPVLXVNLHIC-UHFFFAOYSA-M
Canonic Smiles
[K]OS(=O)(=O)C(C(OC(C(F)(F)F)(F)F)(F)F)(F)F
Isomeric Smiles
O(C(F)(F)C(F)(F)F)C(F)(F)C(S(=O)(=O)O[K])(F)F
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
3.7186
LogD (pH = 7.4)
3.7186
Log P
3.7186
Molar Refractivity
33.9302
Polarizability
16.570093
Polar Surface Area
52.6
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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