Molecule

ID:122762

General Information
Structure
MolImage
Molecular Formula
C₁₅H₁₀N₂O₃
Molecular Mass
266.2515
Exact Mass
266.06914219
Charge
0
InChI
InChI=1S/C15H10N2O3/c18-15(19)11-6-3-9-17-14(11)20-12-7-1-4-10-5-2-8-16-13(10)12/h1-9H,(H,18,19)
InChIKey
QKUCENYSZARJKX-UHFFFAOYSA-N
Canonic Smiles
OC(=O)c1cccnc1Oc1cccc2c1nccc2
Isomeric Smiles
c1(c(C(=O)O)cccn1)Oc1c2ncccc2ccc1
Calculated Properties
JChem
Acid pKa
4.4257665
H Acceptors
4
H Donor
1
LogD (pH = 5.5)
1.5501659
LogD (pH = 7.4)
-0.2083356
Log P
2.5065863
Molar Refractivity
71.6329
Polarizability
28.70386
Polar Surface Area
72.31
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
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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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