Molecule

ID:45803

General Information
Structure
MolImage
Molecular Formula
C₁₁H₂₀ClNO₄
Molecular Mass
265.7338
Exact Mass
265.10808581
Charge
0
InChI
InChI=1S/C11H19NO4.ClH/c1-7(2)4-10(13)16-8-5-9(12-6-8)11(14)15-3;/h7-9,12H,4-6H2,1-3H3;1H/t8-,9-;/m0./s1
InChIKey
FIPKQPSCMCNPLN-OZZZDHQUSA-N
Canonic Smiles
COC(=O)[C@H]1NC[C@H](C1)OC(=O)CC(C)C.Cl
Isomeric Smiles
Cl.[C@@H]1(C[C@H](NC1)C(=O)OC)OC(=O)CC(C)C
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
-0.09897778
LogD (pH = 7.4)
0.74017984
Log P
0.77430403
Molar Refractivity
57.0793
Polarizability
23.368298
Polar Surface Area
64.63
Rotatable Bonds
6
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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