Molecule

ID:74541

General Information
Structure
MolImage
Molecular Formula
C₁₅H₁₃N
Molecular Mass
207.27042
Exact Mass
207.10479942
Charge
0
InChI
InChI=1S/C15H13N/c1-16-14-10-6-5-9-13(14)11-15(16)12-7-3-2-4-8-12/h2-11H,1H3
InChIKey
SFWZZSXCWQTORH-UHFFFAOYSA-N
Canonic Smiles
Cn1c(cc2c1cccc2)c1ccccc1
Isomeric Smiles
n1(c(cc2c1cccc2)c1ccccc1)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.8629103
LogD (pH = 7.4)
3.8629103
Log P
3.8629103
Molar Refractivity
67.0549
Polarizability
28.55276
Polar Surface Area
4.93
Rotatable Bonds
1
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
References
Bioactivity
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