Molecule

ID:112609

General Information
Structure
MolImage
Molecular Formula
C₂₂H₃₈
Molecular Mass
302.53712
Exact Mass
302.29735122
Charge
0
InChI
InChI=1S/C22H38/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22/h15,17-18,20-21H,2-14,16,19H2,1H3
InChIKey
DEQLTFPCJRGSHW-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCc1ccccc1
Isomeric Smiles
CCCCCCCCCCCCCCCCc1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
9.155197
LogD (pH = 7.4)
9.155197
Log P
9.155197
Molar Refractivity
100.1142
Polarizability
39.863907
Polar Surface Area
0.0
Rotatable Bonds
15
Lipinski's Rule of Five
false
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