Compound Detail
CHEMBL3818303
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Basic Information
| ChEMBL ID | CHEMBL3818303 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DTWJPYXRTGRSPA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
293.8
MW (Da)
3.38
ALogP
2
HBA
1
HBD
40.5
PSA (Ų)
0.82
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholecystokinin receptor type A CHEMBL2871 | IC50 | 5.35 | 5.35 | 4500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholecystokinin receptor type A | IC50 | = | 4500.0 | nM | 5.35 | Displacement of [125]I-CCK-8 from CCK-A receptor in rat pancreatic membrane afte... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C6MD00052E | Unchecked | 1 |
| - | 10.1039/C6MD00052E | Cholecystokinin receptor type A | 1 |
Data from ChEMBL 36 via Core Engine