Molecule
ID:30798
General Information
Molecular Formula
C₉H₂₀N₂
Molecular Mass
156.2685
Exact Mass
156.16264865
Charge
0
InChI
InChI=1S/C9H20N2/c10-6-2-5-9-11-7-3-1-4-8-11/h1-10H2
InChIKey
ACOXURKIHJSMAC-UHFFFAOYSA-N
Canonic Smiles
NCCCCN1CCCCC1
Isomeric Smiles
N1(CCCCN)CCCCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.6723714
LogD (pH = 7.4)
-4.434549
Log P
0.8208742
Molar Refractivity
49.5899
Polarizability
19.657892
Polar Surface Area
29.26
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
Loading...
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
Loading...
Bioactivity
Loading...