Molecule

ID:14197

General Information
Structure
MolImage
Molecular Formula
C₁₅H₁₀FNO₂
Molecular Mass
255.2438032
Exact Mass
255.06955679
Charge
0
InChI
InChI=1S/C15H10FNO2/c16-10-7-5-9(6-8-10)14(18)15-13(17)11-3-1-2-4-12(11)19-15/h1-8H,17H2
InChIKey
ZJOADABWGYOXRG-UHFFFAOYSA-N
Canonic Smiles
Fc1ccc(cc1)C(=O)c1oc2c(c1N)cccc2
Isomeric Smiles
c12c(oc(c1N)C(=O)c1ccc(cc1)F)cccc2
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
3.4754994
LogD (pH = 7.4)
3.4754994
Log P
3.4754994
Molar Refractivity
70.2689
Polarizability
27.143688
Polar Surface Area
56.23
Rotatable Bonds
2
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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