Compound Detail
CHEMBL1269471
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Basic Information
| ChEMBL ID | CHEMBL1269471 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BUQYFIXVECYNAL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
274.3
MW (Da)
1.84
ALogP
5
HBA
1
HBD
84.6
PSA (Ų)
0.77
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.31
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosinase CHEMBL3318 | IC50 | 4.31 | 4.31 | 49150.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosinase | IC50 | = | 49150.0 | nM | 4.31 | Inhibition of mushroom tyrosinase after 20 mins by microplate reader analysis | 20934336 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20934336 | 10.1016/j.bmcl.2010.09.042 | RAW264.7 | 2 |
| 20934336 | 10.1016/j.bmcl.2010.09.042 | Tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine