Molecule

ID:65529

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₄ClNO₂Si
Molecular Mass
243.76216
Exact Mass
243.04823291
Charge
0
InChI
InChI=1S/C10H14ClNO2Si/c1-15(2,3)9-7(11)6-12-10-8(9)13-4-5-14-10/h6H,4-5H2,1-3H3
InChIKey
QLBAIHABKWUNLW-UHFFFAOYSA-N
Canonic Smiles
Clc1cnc2c(c1[Si](C)(C)C)OCCO2
Isomeric Smiles
c1(cnc2c(c1[Si](C)(C)C)OCCO2)Cl
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
2.8526921
LogD (pH = 7.4)
2.8527
Log P
2.8527
Molar Refractivity
56.0404
Polarizability
24.128468
Polar Surface Area
31.35
Rotatable Bonds
1
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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