Compound Detail
CHEMBL57284
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Basic Information
| ChEMBL ID | CHEMBL57284 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GZFGOTFRPZRKDS-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
173.0
MW (Da)
2.15
ALogP
1
HBA
1
HBD
20.2
PSA (Ų)
0.64
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.32 | 4.32 | 48000.0 | 1 |
| Polyunsaturated fatty acid lipoxygenase ALOX15 CHEMBL2903 | IC50 | 4.26 | 4.26 | 55000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 48000.0 | nM | 4.32 | Inhibitory effect on soybean 15-lipoxygenase | 15267244 |
| Polyunsaturated fatty acid lipoxygenase ALOX15 | IC50 | = | 55000.0 | nM | 4.26 | Inhibitory effect on human reticulocyte 15-lipoxygenase | 15267244 |
Literature References
Data from ChEMBL 36 via Core Engine