Compound Detail
CHEMBL481401
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Basic Information
| ChEMBL ID | CHEMBL481401 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NEPZSLDMGYMYSA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
4
PK Parameters
6
Publications
0
Known Names
Molecular Properties
448.3
MW (Da)
4.28
ALogP
5
HBA
2
HBD
74.5
PSA (Ų)
0.62
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Macrophage colony-stimulating factor 1 receptor CHEMBL1844 | IC50 | 8.52 | 8.52 | 3.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 23.0 | mL.min-1.kg-1 | Rattus norvegicus |
| F | - | % | Rattus norvegicus |
| Fu | 0.044 | - | - |
| T1/2 | 0.8 | hr | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Macrophage colony-stimulating factor 1 receptor | IC50 | = | 3.0 | nM | 8.52 | Inhibition of CSF1R | 19114305 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19114305 | 10.1016/j.bmcl.2008.12.044 | Rattus norvegicus | 4 |
| 19114305 | 10.1016/j.bmcl.2008.12.044 | No relevant target | 1 |
| 19114305 | 10.1016/j.bmcl.2008.12.044 | ADMET | 1 |
| 19114305 | 10.1016/j.bmcl.2008.12.044 | Macrophage colony-stimulating factor 1 receptor | 1 |
| 19114305 | 10.1016/j.bmcl.2008.12.044 | NIH3T3 | 1 |
| - | 10.6019/CHEMBL3301361 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine