Molecule

ID:50351

General Information
Structure
MolImage
Molecular Formula
C₁₄H₁₅N
Molecular Mass
197.2756
Exact Mass
197.12044949
Charge
0
InChI
InChI=1S/C14H15N/c1-11-7-9-13(10-8-11)14(15)12-5-3-2-4-6-12/h2-10,14H,15H2,1H3
InChIKey
UHPQFNXOFFPHJW-UHFFFAOYSA-N
Canonic Smiles
Cc1ccc(cc1)C(c1ccccc1)N
Isomeric Smiles
C(c1ccc(cc1)C)(c1ccccc1)N
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
0.46970844
LogD (pH = 7.4)
1.71688
Log P
3.3966758
Molar Refractivity
63.8554
Polarizability
25.157047
Polar Surface Area
26.02
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation