Molecule

ID:81273

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₇NO₄
Molecular Mass
215.24628
Exact Mass
215.11575803
Charge
0
InChI
InChI=1S/C10H17NO4/c1-5-14-9(12)8(7-11(3)4)10(13)15-6-2/h7H,5-6H2,1-4H3
InChIKey
XNSXXTKUKYWLAH-UHFFFAOYSA-N
Canonic Smiles
CCOC(=O)C(=CN(C)C)C(=O)OCC
Isomeric Smiles
O=C(C(=CN(C)C)C(=O)OCC)OCC
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
1.1802961
LogD (pH = 7.4)
1.1802961
Log P
1.1802961
Molar Refractivity
56.1056
Polarizability
21.631107
Polar Surface Area
55.84
Rotatable Bonds
7
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
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References
Bioactivity
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