Molecule

ID:76834

General Information
Structure
MolImage
Molecular Formula
C₁₅H₁₅N
Molecular Mass
209.2863
Exact Mass
209.12044949
Charge
0
InChI
InChI=1S/C15H15N/c1-11(2)16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h3-11H,1-2H3
InChIKey
LSZJZNNASZFXKN-UHFFFAOYSA-N
Canonic Smiles
CC(n1c2ccccc2c2c1cccc2)C
Isomeric Smiles
n1(c2c(cccc2)c2c1cccc2)C(C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.0879445
LogD (pH = 7.4)
4.0879445
Log P
4.0879445
Molar Refractivity
67.5363
Polarizability
28.770584
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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