Molecule

ID:107488

General Information
Structure
MolImage
Molecular Formula
C₂₀H₁₉N
Molecular Mass
273.37156
Exact Mass
273.15174961
Charge
0
InChI
InChI=1S/C20H19N/c1-4-10-18(11-5-1)16-21(20-14-8-3-9-15-20)17-19-12-6-2-7-13-19/h1-15H,16-17H2
InChIKey
ISGXOWLMGOPVPB-UHFFFAOYSA-N
Canonic Smiles
c1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
Isomeric Smiles
C(N(Cc1ccccc1)c1ccccc1)c1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
5.529103
LogD (pH = 7.4)
5.5302215
Log P
5.530236
Molar Refractivity
89.7118
Polarizability
34.47629
Polar Surface Area
3.24
Rotatable Bonds
5
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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