Compound Detail
CHEMBL4757328
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Basic Information
| ChEMBL ID | CHEMBL4757328 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZNGATDXORWPTPA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
427.9
MW (Da)
3.16
ALogP
8
HBA
3
HBD
96.3
PSA (Ų)
0.52
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 8.6 | 8.6 | 2.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 2.5 | nM | 8.6 | Inhibition of tracer 236 binding to recombinant human GST-tagged full length FAK... | 32784087 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32784087 | 10.1016/j.bmcl.2020.127459 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine