Molecule

ID:112500

General Information
Structure
MolImage
Molecular Formula
C₁₄H₁₀N₂O₄
Molecular Mass
270.2402
Exact Mass
270.06405681
Charge
0
InChI
InChI=1S/C14H10N2O4/c17-13(19-11-7-3-1-4-8-11)15-16-14(18)20-12-9-5-2-6-10-12/h1-10H
InChIKey
WDZOPGZTGVJDMZ-UHFFFAOYSA-N
Canonic Smiles
O=C(Oc1ccccc1)/N=N/C(=O)Oc1ccccc1
Isomeric Smiles
O=C(Oc1ccccc1)/N=N/C(=O)Oc1ccccc1
Calculated Properties
JChem
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
3.3756003
LogD (pH = 7.4)
3.3756003
Log P
3.3756003
Molar Refractivity
68.5342
Polarizability
26.823423
Polar Surface Area
77.32
Rotatable Bonds
4
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
References
Bioactivity
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