Molecule

ID:64986

General Information
Structure
MolImage
Molecular Formula
C₁₇H₃₀FNSn
Molecular Mass
386.1262032
Exact Mass
387.13842219
Charge
0
InChI
InChI=1S/C5H3FN.3C4H9.Sn/c6-5-2-1-3-7-4-5;3*1-3-4-2;/h2-4H;3*1,3-4H2,2H3;
InChIKey
JVQSRANXWHNNRM-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn](c1cncc(c1)F)(CCCC)CCCC
Isomeric Smiles
c1(cncc(c1)[Sn](CCCC)(CCCC)CCCC)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.957225
LogD (pH = 7.4)
3.958484
Log P
3.9585
Molar Refractivity
81.9495
Polarizability
36.569164
Polar Surface Area
12.89
Rotatable Bonds
10
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