Compound Detail
CHEMBL571701
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Basic Information
| ChEMBL ID | CHEMBL571701 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CWOLIIXBWRRZPE-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
250.4
MW (Da)
1.18
ALogP
4
HBA
0
HBD
15.7
PSA (Ų)
0.60
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Monoglyceride lipase CHEMBL4191 | IC50 | 5.19 | 5.19 | 6456.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Monoglyceride lipase | IC50 | = | 6456.54 | nM | 5.19 | Inhibition of human MGL activity using [3H]2-oleoylglycerol substrate by liquid ... | 19883085 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29216562 | 10.1016/j.ejmech.2017.11.060 | Candida albicans | 5 |
| 19883085 | 10.1021/jm901323s | Monoglyceride lipase | 2 |
| 29216562 | 10.1016/j.ejmech.2017.11.060 | Trichomonas vaginalis | 2 |
| 29216562 | 10.1016/j.ejmech.2017.11.060 | Unchecked | 2 |
| 19883085 | 10.1021/jm901323s | Fatty-acid amide hydrolase 1 | 1 |
| 29216562 | 10.1016/j.ejmech.2017.11.060 | HeLa | 1 |
| 29216562 | 10.1016/j.ejmech.2017.11.060 | Cryptococcus neoformans | 1 |
| 29216562 | 10.1016/j.ejmech.2017.11.060 | Sporothrix schenckii | 1 |
| 29216562 | 10.1016/j.ejmech.2017.11.060 | Trichophyton mentagrophytes | 1 |
| 29216562 | 10.1016/j.ejmech.2017.11.060 | Nakaseomyces glabratus | 1 |
| 29216562 | 10.1016/j.ejmech.2017.11.060 | Candida parapsilosis | 1 |
Data from ChEMBL 36 via Core Engine