Compound Detail
CHEMBL5280083
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Basic Information
| ChEMBL ID | CHEMBL5280083 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KBXAZHQFZMWLIH-PMAMJGADSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
374.9
MW (Da)
3.03
ALogP
3
HBA
1
HBD
58.6
PSA (Ų)
0.87
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 10.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Monoglyceride lipase CHEMBL4191 | IC50 | 10.12 | 10.12 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Monoglyceride lipase | IC50 | = | 0.075 | nM | 10.12 | Inhibition of MGL activity in human HeLa cells assessed as reduction in cleaved ... | 37197472 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37197472 | 10.1021/acsmedchemlett.3c00121 | Monoglyceride lipase | 1 |
Data from ChEMBL 36 via Core Engine