Molecule

ID:10026

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₇BrN₂OSi
Molecular Mass
289.24428
Exact Mass
288.02935171
Charge
0
InChI
InChI=1S/C10H17BrN2OSi/c1-10(2,3)15(4,5)14-9-12-6-8(11)7-13-9/h6-7H,1-5H3
InChIKey
GCALLZMACFTOPD-UHFFFAOYSA-N
Canonic Smiles
CC([Si](Oc1ncc(cn1)Br)(C)C)(C)C
Isomeric Smiles
c1(cnc(nc1)O[Si](C)(C)C(C)(C)C)Br
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
3.3187969
LogD (pH = 7.4)
3.3188
Log P
3.3188
Molar Refractivity
62.1201
Polarizability
26.04273
Polar Surface Area
35.01
Rotatable Bonds
3
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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