Compound Detail
CHEMBL5416058
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Basic Information
| ChEMBL ID | CHEMBL5416058 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PUMPILBBQGAQTK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
442.6
MW (Da)
3.25
ALogP
6
HBA
2
HBD
101.0
PSA (Ų)
0.55
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.98
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 5.98 | 5.98 | 1044.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | IC50 | = | 1044.0 | nM | 5.98 | Inhibition of human recombinant FAAH using AMC-AA as substrate preincubated for ... | 36462439 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36462439 | 10.1016/j.ejmech.2022.114952 | Fatty-acid amide hydrolase 1 | 1 |
| 36462439 | 10.1016/j.ejmech.2022.114952 | Monoglyceride lipase | 1 |
Data from ChEMBL 36 via Core Engine