Molecule

ID:89834

General Information
Structure
MolImage
Molecular Formula
C₇H₅N
Molecular Mass
103.1213
Exact Mass
103.04219917
Charge
0
InChI
InChI=1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H
InChIKey
JFDZBHWFFUWGJE-UHFFFAOYSA-N
Canonic Smiles
N#Cc1ccccc1
Isomeric Smiles
N#Cc1ccccc1
Calculated Properties
JChem
LogD (pH = 7.4)
1.83
LogD (pH = 5.5)
1.83
Log P
1.83
Rotatable Bonds
0
H Donor
0
H Acceptors
1
Lipinski's Rule of Five
true
Polar Surface Area
23.79
Polarizability
10.83
Molar Refractivity
31.78
LOG S
-1.60
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
References
Bioactivity
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