Compound Detail
CHEMBL1208820
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Basic Information
| ChEMBL ID | CHEMBL1208820 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VGNAMTKXQSLQJZ-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
164.2
MW (Da)
1.49
ALogP
1
HBA
2
HBD
24.1
PSA (Ų)
0.57
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| B16 CHEMBL381 | IC50 | 4.8 | 4.8 | 15800.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| B16 | IC50 | = | 15800.0 | nM | 4.8 | Antimelanogenic activity in mouse B16 cells assessed as inhibition of alpha-MSH-... | 20638280 |
| B16 | IC50 | = | 15800.0 | nM | 4.8 | Inhibition of alpha-MSH -stimulated melanogenesis in mouse B16 cells assessed as... | 21978680 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20638280 | 10.1016/j.bmcl.2010.06.123 | B16 | 2 |
| 21978680 | 10.1016/j.bmcl.2011.09.024 | Tyrosinase | 1 |
| 21978680 | 10.1016/j.bmcl.2011.09.024 | B16 | 1 |
Data from ChEMBL 36 via Core Engine