Molecule

ID:38294

General Information
Structure
MolImage
Molecular Formula
C₅H₃FIN
Molecular Mass
222.9868932
Exact Mass
222.92942532
Charge
0
InChI
InChI=1S/C5H3FIN/c6-5-3-4(7)1-2-8-5/h1-3H
InChIKey
ADPRIAVYIGHFSO-UHFFFAOYSA-N
Canonic Smiles
Ic1ccnc(c1)F
Isomeric Smiles
c1cnc(cc1I)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.2211504
LogD (pH = 7.4)
2.2211504
Log P
2.2211504
Molar Refractivity
38.4947
Polarizability
14.568013
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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