Compound Detail
CHEMBL5439533
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Basic Information
| ChEMBL ID | CHEMBL5439533 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ASXVCCPJYGQXBS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
473.0
MW (Da)
3.57
ALogP
6
HBA
3
HBD
93.0
PSA (Ų)
0.26
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.33
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mushroom tyrosinase CHEMBL6066154 | IC50 | 5.33 | 5.33 | 4680.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mushroom tyrosinase | IC50 | = | 4680.0 | nM | 5.33 | Inhibition of mushroom tyrosinase incubated for 10 mins by spectrophotometric an... | 35717871 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35717871 | 10.1016/j.ejmech.2022.114525 | Mushroom tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine