Molecule

ID:78253

General Information
Structure
MolImage
Molecular Formula
C₁₇H₃₄N₂Sn
Molecular Mass
385.16626
Exact Mass
386.1743931
Charge
0
InChI
InChI=1S/C5H7N2.3C4H9.Sn/c1-2-7-4-3-6-5-7;3*1-3-4-2;/h3-4H,2H2,1H3;3*1,3-4H2,2H3;
InChIKey
MPVBYTOPMQUEND-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn](c1nccn1CC)(CCCC)CCCC
Isomeric Smiles
n1(CC)ccnc1[Sn](CCCC)(CCCC)CCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.086081
LogD (pH = 7.4)
3.8488636
Log P
4.3353
Molar Refractivity
85.9634
Polarizability
38.173946
Polar Surface Area
17.82
Rotatable Bonds
11
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