Compound Detail
CHEMBL490408
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Basic Information
| ChEMBL ID | CHEMBL490408 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DJYCTTVILKPUFQ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
433.8
MW (Da)
5.29
ALogP
6
HBA
2
HBD
92.9
PSA (Ų)
0.45
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mast/stem cell growth factor receptor Kit CHEMBL1936 | IC50 | 7.96 | 7.96 | 11.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 6.66 | 6.66 | 217.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mast/stem cell growth factor receptor Kit | IC50 | = | 11.0 | nM | 7.96 | Inhibition of c-kit | 18723346 |
| Unchecked | IC50 | = | 217.0 | nM | 6.66 | Inhibition of p38 | 18723346 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18723346 | 10.1016/j.bmcl.2008.07.111 | Unchecked | 2 |
| 18723346 | 10.1016/j.bmcl.2008.07.111 | Mast/stem cell growth factor receptor Kit | 1 |
Data from ChEMBL 36 via Core Engine