Molecule

ID:70673

General Information
Structure
Molecular Formula
C₅H₃FIN
Molecular Mass
222.9868932
Exact Mass
222.92942532
Charge
0
InChI
InChI=1S/C5H3FIN/c6-4-1-2-5(7)8-3-4/h1-3H
InChIKey
SKKQNFJMWPLVDB-UHFFFAOYSA-N
Canonic Smiles
Ic1ccc(cn1)F
Isomeric Smiles
c1(ccc(cn1)F)I
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
1.8598073
LogD (pH = 7.4)
1.8598074
Log P
1.8598074
Molar Refractivity
37.1881
Polarizability
14.6445055
Polar Surface Area
12.89
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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