Compound Detail
CHEMBL87883
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 | CHEMBL87883 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IBATXZHEHNSLNL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
410.5
MW (Da)
3.48
ALogP
4
HBA
1
HBD
55.8
PSA (Ų)
0.74
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.84
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Acetylcholinesterase CHEMBL220 | EC50 | 5.84 | 5.84 | 1440.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Acetylcholinesterase | EC50 | = | 1440.0 | nM | 5.84 | In vitro reversal of vecuronium-induced neuromuscular block in guinea pig hemi-d... | 12182861 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12182861 | 10.1016/s0960-894x(02)00482-1 | Felis catus | 5 |
| 12182861 | 10.1016/s0960-894x(02)00482-1 | Acetylcholinesterase | 1 |
Data from ChEMBL 36 via Core Engine