Molecule

ID:64137

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₀BrNSi
Molecular Mass
310.3048
Exact Mass
309.05483818
Charge
0
InChI
InChI=1S/C14H20BrNSi/c1-14(2,3)17(4,5)16-10-9-11-12(15)7-6-8-13(11)16/h6-10H,1-5H3
InChIKey
LTHHTJMKYUPWCR-UHFFFAOYSA-N
Canonic Smiles
Brc1cccc2c1ccn2[Si](C(C)(C)C)(C)C
Isomeric Smiles
n1(c2c(cc1)c(Br)ccc2)[Si](C(C)(C)C)(C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.8419
LogD (pH = 7.4)
4.8419
Log P
4.8419
Molar Refractivity
76.4405
Polarizability
32.164806
Polar Surface Area
4.93
Rotatable Bonds
2
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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