Compound Detail
CHEMBL94019
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Basic Information
| ChEMBL ID | CHEMBL94019 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UFOPWVBMLYVOQR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
321.4
MW (Da)
3.75
ALogP
5
HBA
1
HBD
56.3
PSA (Ų)
0.79
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 6.04 | 5.9 | 910.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 910.0 | nM | 6.04 | Tested for inhibition of Epidermal growth factor receptor from A431 vulval squam... | - |
| Epidermal growth factor receptor | IC50 | = | 1730.0 | nM | 5.76 | Inhibition of EGF-stimulated proliferation of KB cells in culture | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(97)10059-2 | Epidermal growth factor receptor | 2 |
Data from ChEMBL 36 via Core Engine