Compound Detail
CHEMBL5282360
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL5282360 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ATUISHMNSVOAKG-HKOYGPOVSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
432.5
MW (Da)
4.00
ALogP
8
HBA
1
HBD
82.3
PSA (Ų)
0.63
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Apoptosis regulator BAX CHEMBL5318 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Apoptosis regulator BAX | IC50 | = | 250.0 | nM | 6.6 | Binding affinity to recombinant human full length GST-tagged BAX expressed in Es... | 33939407 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33939407 | 10.1021/acs.jmedchem.0c02200 | Apoptosis regulator BAX | 1 |
Data from ChEMBL 36 via Core Engine