Molecule

ID:58926

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₃NO
Molecular Mass
233.34922
Exact Mass
233.17796436
Charge
0
InChI
InChI=1S/C15H23NO/c17-14-2-1-3-16(14)10-15-7-11-4-12(8-15)6-13(5-11)9-15/h11-13H,1-10H2
InChIKey
WKGFLDXBABFMNH-UHFFFAOYSA-N
Canonic Smiles
O=C1CCCN1CC12CC3CC(C2)CC(C1)C3
Isomeric Smiles
C1C2(CC3CC1CC(C2)C3)CN1CCCC1=O
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.0699549
LogD (pH = 7.4)
2.0699563
Log P
2.0699563
Molar Refractivity
67.3391
Polarizability
26.64865
Polar Surface Area
20.31
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