Molecule

ID:24820

General Information
Structure
MolImage
Molecular Formula
C₁₁H₂₀N₂O
Molecular Mass
196.2893
Exact Mass
196.15756327
Charge
0
InChI
InChI=1S/C11H20N2O/c14-11-2-1-8-13(11)9-5-10-3-6-12-7-4-10/h10,12H,1-9H2
InChIKey
VXEDMQRKJUGYBQ-UHFFFAOYSA-N
Canonic Smiles
O=C1CCCN1CCC1CCNCC1
Isomeric Smiles
N1(C(=O)CCC1)CCC1CCNCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-3.1165464
LogD (pH = 7.4)
-2.6601887
Log P
0.11504064
Molar Refractivity
56.807
Polarizability
22.265976
Polar Surface Area
32.34
Rotatable Bonds
3
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