Compound Detail
CHEMBL333409
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Basic Information
| ChEMBL ID | CHEMBL333409 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CCEDGPLTQRLYHE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
436.5
MW (Da)
4.43
ALogP
2
HBA
3
HBD
82.2
PSA (Ų)
0.43
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Gastrin/cholecystokinin type B receptor CHEMBL2854 | Ki | 5.12 | 5.12 | 7585.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gastrin/cholecystokinin type B receptor | Ki | = | 7585.78 | nM | 5.12 | Tested for its receptor affinity from competition with 20 pM [125I]BH-CCK-8S for... | 7966125 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7966125 | 10.1021/jm00048a001 | Rattus norvegicus | 1 |
| 7966125 | 10.1021/jm00048a001 | Gastrin/cholecystokinin type B receptor | 1 |
| 7966125 | 10.1021/jm00048a001 | Cholecystokinin receptor type A | 1 |
Data from ChEMBL 36 via Core Engine