Compound Detail
CHEMBL392324
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL392324 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NZQPLTFMMZVHAD-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
363.3
MW (Da)
4.69
ALogP
2
HBA
0
HBD
32.7
PSA (Ų)
0.75
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Acetylcholinesterase CHEMBL4078 | IC50 | 7.17 | 7.17 | 67.5 | 1 |
| Acetylcholinesterase CHEMBL220 | IC50 | 7.16 | 7.16 | 70.0 | 1 |
| Acetylcholinesterase CHEMBL3199 | IC50 | 7.16 | 7.16 | 70.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Acetylcholinesterase | IC50 | = | 67.5 | nM | 7.17 | Inhibition of electric eel AChE by Ellman colorimetric assay | 17888667 |
| Acetylcholinesterase | IC50 | = | 70.0 | nM | 7.16 | Inhibition of Wistar rat brain AChE by Ellman colorimetric assay | 17888667 |
| Acetylcholinesterase | IC50 | = | 70.0 | nM | 7.16 | Inhibition of human serum AChE by Ellman colorimetric assay | 17888667 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17888667 | 10.1016/j.bmc.2007.07.014 | Acetylcholinesterase | 3 |
Data from ChEMBL 36 via Core Engine