Molecule

ID:82178

General Information
Structure
MolImage
Molecular Formula
C₂₃H₃₂O₆Si
Molecular Mass
432.58208
Exact Mass
432.19681528
Charge
0
InChI
InChI=1S/C23H32O6Si/c1-23(2,3)30(16-11-7-5-8-12-16,17-13-9-6-10-14-17)28-15-18-19(24)20(25)21(26)22(27-4)29-18/h5-14,18-22,24-26H,15H2,1-4H3/t18-,19+,20-,21+,22-/m1/s1
InChIKey
GZIVUJBHWFXBMB-OQEHDIDLSA-N
Canonic Smiles
CO[C@@H]1O[C@H](CO[Si](C(C)(C)C)(c2ccccc2)c2ccccc2)[C@@H]([C@H]([C@@H]1O)O)O
Isomeric Smiles
O1[C@H]([C@H]([C@@H]([C@H]([C@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)O)O)O)OC
Calculated Properties
JChem
Acid pKa
12.21343
H Acceptors
6
H Donor
3
LogD (pH = 5.5)
3.3337
LogD (pH = 7.4)
3.3336933
Log P
3.3337
Molar Refractivity
109.9111
Polarizability
46.32727
Polar Surface Area
88.38
Rotatable Bonds
7
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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