Molecule
ID:125444
General Information
Molecular Formula
C₁₀H₁₅N
Molecular Mass
149.2328
Exact Mass
149.12044949
Charge
0
InChI
InChI=1S/C10H15N/c1-8-3-5-10(6-4-8)7-9(2)11/h3-6,9H,7,11H2,1-2H3
InChIKey
ZDHZDWSHLNBTEB-UHFFFAOYSA-N
Canonic Smiles
CC(Cc1ccc(cc1)C)N
Isomeric Smiles
NC(Cc1ccc(cc1)C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.7020011
LogD (pH = 7.4)
-0.17240587
Log P
2.3176718
Molar Refractivity
48.7464
Polarizability
19.128872
Polar Surface Area
26.02
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
No Data Available
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Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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