Molecule

ID:26199

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₅N
Molecular Mass
149.2328
Exact Mass
149.12044949
Charge
0
InChI
InChI=1S/C10H15N/c1-7-4-5-10(9(3)11)8(2)6-7/h4-6,9H,11H2,1-3H3
InChIKey
LFJDRMQPKZCUNL-UHFFFAOYSA-N
Canonic Smiles
Cc1ccc(c(c1)C)C(N)C
Isomeric Smiles
c1(c(cc(cc1)C)C)C(N)C
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.46690473
LogD (pH = 7.4)
0.24591133
Log P
2.542432
Molar Refractivity
49.0326
Polarizability
19.125973
Polar Surface Area
26.02
Rotatable Bonds
1
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