Molecule

ID:60579

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₇NO₄
Molecular Mass
285.37918
Exact Mass
285.19400835
Charge
0
InChI
InChI=1S/C15H27NO4/c1-6-7-15(12(17)19-5)8-10-16(11-9-15)13(18)20-14(2,3)4/h6-11H2,1-5H3
InChIKey
IMGOLPSJOGREBO-UHFFFAOYSA-N
Canonic Smiles
CCCC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)OC
Isomeric Smiles
C1CN(CCC1(CCC)C(=O)OC)C(=O)OC(C)(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
2.7544708
LogD (pH = 7.4)
2.7544708
Log P
2.7544708
Molar Refractivity
76.5425
Polarizability
30.321398
Polar Surface Area
55.84
Rotatable Bonds
6
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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