Molecule

ID:32119

General Information
Structure
MolImage
Molecular Formula
C₉H₇F₅
Molecular Mass
210.143896
Exact Mass
210.04679132
Charge
0
InChI
InChI=1S/C9H7F5/c1-8(10,11)6-3-2-4-7(5-6)9(12,13)14/h2-5H,1H3
InChIKey
MEDFXZNUPIQYBA-UHFFFAOYSA-N
Canonic Smiles
CC(c1cccc(c1)C(F)(F)F)(F)F
Isomeric Smiles
FC(F)(C)c1cc(C(F)(F)F)ccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.488245
LogD (pH = 7.4)
3.488245
Log P
3.488245
Molar Refractivity
42.1375
Polarizability
14.913611
Polar Surface Area
0.0
Rotatable Bonds
2
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