Molecule

ID:75103

General Information
Structure
MolImage
Molecular Formula
C₁₆H₂₃NO₈
Molecular Mass
357.35572
Exact Mass
357.1423667
Charge
0
InChI
InChI=1S/C16H23NO8/c18-17(19)14-1-2-15-16(13-14)25-12-10-23-8-6-21-4-3-20-5-7-22-9-11-24-15/h1-2,13H,3-12H2
InChIKey
LQXOKBZWNFJJGI-UHFFFAOYSA-N
Canonic Smiles
[O-][N+](=O)c1ccc2c(c1)OCCOCCOCCOCCOCCO2
Isomeric Smiles
O1c2c(cc(cc2)[N+](=O)[O-])OCCOCCOCCOCCOCC1
Calculated Properties
JChem
H Acceptors
8
H Donor
0
LogD (pH = 5.5)
1.2384605
LogD (pH = 7.4)
1.2384605
Log P
1.2384605
Molar Refractivity
87.5099
Polarizability
34.16847
Polar Surface Area
98.52
Rotatable Bonds
1
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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