Compound Detail
CHEMBL4562624
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Basic Information
| ChEMBL ID | CHEMBL4562624 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YNTKURSKMLATKI-XBXARRHUSA-N |
1
Targets
3
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
185.3
MW (Da)
0.92
ALogP
3
HBA
2
HBD
50.4
PSA (Ų)
0.41
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.37
Ki 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosinase CHEMBL3318 | IC50 | 6.37 | 6.37 | 430.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosinase | IC50 | = | 430.0 | nM | 6.37 | Inhibition of mushroom tyrosinase diphenolase activity using L-dopa as substrate | 31015905 |
| Tyrosinase | IC50 | = | 430.0 | nM | 6.37 | Inhibition of mushroom tyrosinase using L-DOPA as a substrate by UV-2450 spectro... | 34365131 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31015905 | 10.1039/C9MD00005D | Tyrosinase | 3 |
| 34365131 | 10.1016/j.ejmech.2021.113744 | Tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine