Compound Detail
CHEMBL5569922
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Basic Information
| ChEMBL ID | CHEMBL5569922 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DOWZGTBSGMKEBE-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
465.6
MW (Da)
4.77
ALogP
6
HBA
2
HBD
100.4
PSA (Ų)
0.49
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mononuclear cell line CHEMBL614723 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.15 | 5.15 | 7150.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mononuclear cell line | IC50 | = | 250.0 | nM | 6.6 | Cytotoxicity against human Mononuclear cell line assessed as reduction in cell v... | 37862815 |
| Unchecked | IC50 | = | 7150.0 | nM | 5.15 | Inhibition of soybean 15-LOX by chemiluminescence based analysis | 37862815 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37862815 | 10.1016/j.ejmech.2023.115866 | Mononuclear cell line | 1 |
| 37862815 | 10.1016/j.ejmech.2023.115866 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine