Compound Detail
CHEMBL4877433
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Basic Information
| ChEMBL ID | CHEMBL4877433 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FOLKXKPXNNIKMY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
359.4
MW (Da)
3.62
ALogP
6
HBA
1
HBD
77.2
PSA (Ų)
0.68
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosinase CHEMBL3318 | IC50 | 7.75 | 7.75 | 18.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosinase | IC50 | = | 18.0 | nM | 7.75 | Inhibition of mushroom tyrosinase using L-DOPA as substrate | 34058664 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34058664 | 10.1016/j.bmc.2021.116222 | Tyrosinase | 1 |
| 34058664 | 10.1016/j.bmc.2021.116222 | B16-F10 | 1 |
Data from ChEMBL 36 via Core Engine