Molecule

ID:55951

General Information
Structure
MolImage
Molecular Formula
C₁₉H₁₃NO₂
Molecular Mass
287.31202
Exact Mass
287.09462866
Charge
0
InChI
InChI=1S/C19H13NO2/c21-18-16-10-3-4-11-17(16)20(19(18)22)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-11H,12H2
InChIKey
JZHKGMPFIUHFTK-UHFFFAOYSA-N
Canonic Smiles
O=C1c2ccccc2N(C1=O)Cc1cccc2c1cccc2
Isomeric Smiles
N1(C(=O)C(=O)c2c1cccc2)Cc1c2c(ccc1)cccc2
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.5295596
LogD (pH = 7.4)
3.5295596
Log P
3.5295596
Molar Refractivity
84.6537
Polarizability
33.503105
Polar Surface Area
37.38
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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