Molecule

ID:93164

General Information
Structure
MolImage
Molecular Formula
C₇H₃Br₂F₃
Molecular Mass
303.9019296
Exact Mass
301.85535876
Charge
0
InChI
InChI=1S/C7H3Br2F3/c8-5-3-1-2-4(6(5)9)7(10,11)12/h1-3H
InChIKey
OZEVVXUSTAMOBK-UHFFFAOYSA-N
Canonic Smiles
Brc1cccc(c1Br)C(F)(F)F
Isomeric Smiles
FC(c1c(c(ccc1)Br)Br)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.3885994
LogD (pH = 7.4)
4.3885994
Log P
4.3885994
Molar Refractivity
47.2773
Polarizability
17.910355
Polar Surface Area
0.0
Rotatable Bonds
1
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