Compound Detail
CHEMBL241893
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Basic Information
| ChEMBL ID | CHEMBL241893 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WWVYILSYNASPNE-ONNFQVAWSA-N |
2
Targets
5
Activities
2
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
211.2
MW (Da)
0.26
ALogP
4
HBA
4
HBD
90.9
PSA (Ų)
0.24
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.65
EC50 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.65 | 5.65 | 2250.0 | 1 |
| Tyrosinase CHEMBL3318 | IC50 | 5.19 | 5.19 | 6500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 2250.0 | nM | 5.65 | Inhibition of pieris rapae Phenoloxidase | 17258462 |
| Tyrosinase | IC50 | = | 6500.0 | nM | 5.19 | Inhibition of mushroom tyrosinase using L-dopa as substrate preincubated for 10 ... | 31015905 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17258462 | 10.1016/j.bmc.2006.12.038 | Unchecked | 2 |
| 28118010 | 10.1021/acs.jmedchem.6b01227 | Unchecked | 1 |
| 28118010 | 10.1021/acs.jmedchem.6b01227 | Influenza A virus | 1 |
| 28118010 | 10.1021/acs.jmedchem.6b01227 | HEK293 | 1 |
| 31015905 | 10.1039/C9MD00005D | Tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine