Compound Detail
CHEMBL46946
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Basic Information
| ChEMBL ID | CHEMBL46946 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DBIMWULYZNNEPY-ONEGZZNKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
179.2
MW (Da)
0.81
ALogP
3
HBA
3
HBD
69.6
PSA (Ų)
0.47
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 7000.0 | nM | 5.16 | Inhibition of Epidermal growth factor receptor | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80792-7 | Epidermal growth factor receptor | 1 |
| 1479375 | 10.1021/np50089a001 | Epidermal growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine