Molecule

ID:44885

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₆ClNO₃Si
Molecular Mass
331.91034
Exact Mass
331.13704791
Charge
0
InChI
InChI=1S/C15H26ClNO3Si/c1-15(2,3)21(6,7)20-10-11-8-9-17-13(16)12(11)14(18-4)19-5/h8-9,14H,10H2,1-7H3
InChIKey
JITGZOPYNOGRBO-UHFFFAOYSA-N
Canonic Smiles
COC(c1c(ccnc1Cl)CO[Si](C(C)(C)C)(C)C)OC
Isomeric Smiles
c1cnc(c(c1CO[Si](C(C)(C)C)(C)C)C(OC)OC)Cl
Calculated Properties
JChem
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
3.5673952
LogD (pH = 7.4)
3.5674
Log P
3.5674
Molar Refractivity
83.7794
Polarizability
34.801014
Polar Surface Area
40.58
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
References
Bioactivity
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