Compound Detail
CHEMBL132466
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Basic Information
| ChEMBL ID | CHEMBL132466 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WBPDZLHNIXGYON-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
407.8
MW (Da)
5.81
ALogP
5
HBA
1
HBD
67.2
PSA (Ų)
0.43
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 6.17 | 5.46 | 680.0 | 2 |
| SW-620 CHEMBL612262 | IC50 | 5.7 | 5.7 | 1990.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 680.0 | nM | 6.17 | Inhibition of EGFR overexpressing A431 cell proliferation | 11814812 |
| SW-620 | IC50 | = | 1990.0 | nM | 5.7 | Inhibition of SW620 cell proliferation | 11814812 |
| Epidermal growth factor receptor | IC50 | = | 18000.0 | nM | 4.75 | Inhibition of epidermal growth factor receptor (EGFR) | 11814812 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11814812 | 10.1016/s0960-894x(01)00776-4 | Epidermal growth factor receptor | 2 |
| 11814812 | 10.1016/s0960-894x(01)00776-4 | SW-620 | 1 |
Data from ChEMBL 36 via Core Engine