Molecule

ID:65154

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₈BrNSSi
Molecular Mass
292.31112
Exact Mass
291.01125911
Charge
0
InChI
InChI=1S/C10H18BrNSSi/c1-7-8(11)13-9(12-7)14(5,6)10(2,3)4/h1-6H3
InChIKey
RKBPKSMLIGSKAS-UHFFFAOYSA-N
Canonic Smiles
Cc1nc(sc1Br)[Si](C(C)(C)C)(C)C
Isomeric Smiles
s1c(c(nc1[Si](C)(C)C(C)(C)C)C)Br
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
4.289111
LogD (pH = 7.4)
4.289199
Log P
4.2892
Molar Refractivity
62.1307
Polarizability
26.691362
Polar Surface Area
12.89
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation