Compound Detail
CHEMBL2165080
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Basic Information
| ChEMBL ID | CHEMBL2165080 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HJDXXEYRDCOVRG-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
445.4
MW (Da)
3.04
ALogP
6
HBA
2
HBD
104.8
PSA (Ų)
0.47
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.55
Ki 1 meas. best 8.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL3455 | Ki | 8.15 | 8.15 | 7.0 | 1 |
| Fatty-acid amide hydrolase 1 CHEMBL3455 | IC50 | 7.55 | 7.55 | 28.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | Ki | = | 7.0 | nM | 8.15 | Inhibition of mouse FAAH isolated from brain homogenate using [3H-ethanolamine]A... | 22779702 |
| Fatty-acid amide hydrolase 1 | IC50 | = | 28.0 | nM | 7.55 | Inhibition of mouse FAAH isolated from brain homogenate using [3H-ethanolamine]A... | 22779702 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22779702 | 10.1021/jm300689c | Fatty-acid amide hydrolase 1 | 3 |
Data from ChEMBL 36 via Core Engine