Molecule

ID:134243

General Information
Structure
MolImage
Molecular Formula
C₁₆H₂₃NO₄
Molecular Mass
293.35812
Exact Mass
293.16270822
Charge
0
InChI
InChI=1S/C16H23NO4/c1-2-3-4-5-6-7-8-9-16(18)21-15-12-10-14(11-13-15)17(19)20/h10-13H,2-9H2,1H3
InChIKey
RRNKCSIEGPOIKI-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCC(=O)Oc1ccc(cc1)[N+](=O)[O-]
Isomeric Smiles
CCCCCCCCCC(=O)Oc1ccc(cc1)[N+](=O)[O-]
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
5.3330073
LogD (pH = 7.4)
5.3330073
Log P
5.3330073
Molar Refractivity
81.349
Polarizability
31.352898
Polar Surface Area
72.12
Rotatable Bonds
11
Lipinski's Rule of Five
false
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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