Molecule

ID:94665

General Information
Structure
MolImage
Molecular Formula
C₈H₁₀FO₂P
Molecular Mass
188.1359642
Exact Mass
188.04024441
Charge
0
InChI
InChI=1S/C8H10FO2P/c1-2-11-12(9,10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKey
GERAEOSSWSKBLE-UHFFFAOYSA-N
Canonic Smiles
CCOP(=O)(c1ccccc1)F
Isomeric Smiles
P(=O)(c1ccccc1)(OCC)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.4275
LogD (pH = 7.4)
2.4275
Log P
2.4275
Molar Refractivity
45.414
Polarizability
17.720615
Polar Surface Area
26.3
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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