Molecule

ID:85693

General Information
Structure
MolImage
Molecular Formula
C₁₄H₁₀N₂O₄
Molecular Mass
270.2402
Exact Mass
270.06405681
Charge
0
InChI
InChI=1S/C14H10N2O4/c15-5-1-3-7(17)11-9(5)13(19)12-8(18)4-2-6(16)10(12)14(11)20/h1-4,17-18H,15-16H2
InChIKey
HSYLKWSCFRLSKB-UHFFFAOYSA-N
Canonic Smiles
Nc1ccc(c2c1C(=O)c1c(O)ccc(c1C2=O)N)O
Isomeric Smiles
O=C1c2c(c(ccc2O)N)C(=O)c2c(ccc(c12)N)O
Calculated Properties
JChem
Acid pKa
10.026184
H Acceptors
6
H Donor
4
LogD (pH = 5.5)
3.252417
LogD (pH = 7.4)
3.252687
Log P
3.2537236
Molar Refractivity
74.5136
Polarizability
26.833181
Polar Surface Area
126.64
Rotatable Bonds
0
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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