Molecule

ID:133147

General Information
Structure
MolImage
Molecular Formula
C₁₆H₂₀N₂
Molecular Mass
240.3434
Exact Mass
240.16264865
Charge
0
InChI
InChI=1S/C16H20N2/c1-17(2)15-9-5-13(6-10-15)14-7-11-16(12-8-14)18(3)4/h5-12H,1-4H3
InChIKey
YRNWIFYIFSBPAU-UHFFFAOYSA-N
Canonic Smiles
CN(c1ccc(cc1)c1ccc(cc1)N(C)C)C
Isomeric Smiles
CN(C)c1ccc(cc1)c1ccc(cc1)N(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.6319482
LogD (pH = 7.4)
3.8335712
Log P
3.8365588
Molar Refractivity
80.0514
Polarizability
31.054642
Polar Surface Area
6.48
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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