Molecule

ID:97384

General Information
Structure
Loading...
Molecular Formula
C₇H₅BrF₂Zn
Molecular Mass
272.3954064
Exact Mass
269.8834106
Charge
0
InChI
InChI=1S/C7H5F2.BrH.Zn/c1-5-2-6(8)4-7(9)3-5;;/h2-4H,1H2;1H;/q;;+1/p-1
InChIKey
GCVAILFVPCDSSW-UHFFFAOYSA-M
Canonic Smiles
Br[Zn]Cc1cc(F)cc(c1)F
Isomeric Smiles
[Zn](Cc1cc(cc(c1)F)F)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.6366
LogD (pH = 7.4)
2.6366
Log P
2.6366
Molar Refractivity
39.5329
Polarizability
18.073742
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
Loading...
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
Loading...
References
Loading...
Bioactivity
Loading...