Molecule

ID:70059

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₁N
Molecular Mass
145.20104
Exact Mass
145.08914936
Charge
0
InChI
InChI=1S/C10H11N/c1-8-7-9-5-3-4-6-10(9)11(8)2/h3-7H,1-2H3
InChIKey
BJMUOUXGBFNLSN-UHFFFAOYSA-N
Canonic Smiles
Cn1c(C)cc2c1cccc2
Isomeric Smiles
n1(c(cc2ccccc12)C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.4952452
LogD (pH = 7.4)
2.4952452
Log P
2.4952452
Molar Refractivity
47.1909
Polarizability
19.180647
Polar Surface Area
4.93
Rotatable Bonds
0
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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