Compound Detail
CHEMBL5997498
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Basic Information
| ChEMBL ID | CHEMBL5997498 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NDPDENJSSNGRDR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
471.9
MW (Da)
4.60
ALogP
7
HBA
1
HBD
79.8
PSA (Ų)
0.60
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 10.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 10.7 | 10.35 | 0.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 0.02 | nM | 10.7 | Kinase Assay: Buffer formulation: a buffer consisted of 50 mM HEPES (pH 7.5), 0.... | - |
| Epidermal growth factor receptor | IC50 | = | 0.1 | nM | 10.0 | Kinase Assay: Buffer formulation: a buffer consisted of 50 mM HEPES (pH 7.5), 0.... | - |
Data from ChEMBL 36 via Core Engine