Molecule

ID:121520

General Information
Structure
MolImage
Molecular Formula
C₁₉H₁₆O₃
Molecular Mass
292.32854
Exact Mass
292.10994437
Charge
0
InChI
InChI=1S/C19H16O3/c1-21-19-11-14(12-20)9-10-18(19)22-13-16-7-4-6-15-5-2-3-8-17(15)16/h2-12H,13H2,1H3
InChIKey
LGEUVGFZNAWGCA-UHFFFAOYSA-N
Canonic Smiles
COc1cc(C=O)ccc1OCc1cccc2c1cccc2
Isomeric Smiles
c1(c(OCc2c3c(ccc2)cccc3)ccc(c1)C=O)OC
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
4.0843554
LogD (pH = 7.4)
4.0843554
Log P
4.0843554
Molar Refractivity
86.6312
Polarizability
34.395332
Polar Surface Area
35.53
Rotatable Bonds
5
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
Click here to submit data
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