Molecule

ID:60679

General Information
Structure
MolImage
Molecular Formula
C₁₆H₁₆FNO₂
Molecular Mass
273.3021432
Exact Mass
273.11650698
Charge
0
InChI
InChI=1S/C16H16FNO2/c1-9-8-16(4-2-3-5-16)18-13-11(9)6-10(17)7-12(13)14(19)15(18)20/h6-7,9H,2-5,8H2,1H3
InChIKey
PEWOKABNOXENPC-UHFFFAOYSA-N
Canonic Smiles
Fc1cc2C(C)CC3(N4c2c(c1)C(=O)C4=O)CCCC3
Isomeric Smiles
N12C(=O)C(=O)c3c1c(C(CC12CCCC1)C)cc(c3)F
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.0082583
LogD (pH = 7.4)
3.0082583
Log P
3.0082583
Molar Refractivity
72.5693
Polarizability
27.488504
Polar Surface Area
37.38
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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