Molecule

ID:44967

General Information
Structure
Molecular Formula
C₁₉H₂₉NO₂Si₂
Molecular Mass
359.61006
Exact Mass
359.17368224
Charge
0
InChI
InChI=1S/C19H29NO2Si2/c1-19(2,3)24(7,8)21-14-16-12-17-18(22-16)11-15(13-20-17)9-10-23(4,5)6/h11-13H,14H2,1-8H3
InChIKey
MZLQWINLXUAFEP-UHFFFAOYSA-N
Canonic Smiles
C[Si](C#Cc1cnc2c(c1)oc(c2)CO[Si](C(C)(C)C)(C)C)(C)C
Isomeric Smiles
c1(cnc2c(c1)oc(c2)CO[Si](C(C)(C)C)(C)C)C#C[Si](C)(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
5.2041
LogD (pH = 7.4)
5.204199
Log P
5.2042
Molar Refractivity
89.1483
Polarizability
41.37038
Polar Surface Area
35.26
Rotatable Bonds
6
Lipinski's Rule of Five
false
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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