Molecule

ID:16029

General Information
Structure
MolImage
Molecular Formula
C₇H₄I₂O₂
Molecular Mass
373.9144
Exact Mass
373.83007537
Charge
0
InChI
InChI=1S/C7H4I2O2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-2H,3H2
InChIKey
BXUOIEPSOIEXIN-UHFFFAOYSA-N
Canonic Smiles
Ic1cc2OCOc2cc1I
Isomeric Smiles
O1COc2c1cc(c(c2)I)I
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.4543684
LogD (pH = 7.4)
3.4543684
Log P
3.4543684
Molar Refractivity
58.5499
Polarizability
23.641638
Polar Surface Area
18.46
Rotatable Bonds
0
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