Molecule
ID:121368
General Information
Molecular Formula
C₁₂H₁₂N₂
Molecular Mass
184.23708
Exact Mass
184.10004839
Charge
0
InChI
InChI=1S/C12H12N2/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,13H2
InChIKey
YHYKLKNNBYLTQY-UHFFFAOYSA-N
Canonic Smiles
NN(c1ccccc1)c1ccccc1
Isomeric Smiles
N(c1ccccc1)(c1ccccc1)N
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
2.7052424
LogD (pH = 7.4)
2.8631647
Log P
2.8656
Molar Refractivity
69.3476
Polarizability
22.537434
Polar Surface Area
29.26
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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