Compound Detail
CHEMBL61498
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Basic Information
| ChEMBL ID | CHEMBL61498 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LRQQXHAERBCTNC-WMCAAGNKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
317.4
MW (Da)
1.99
ALogP
3
HBA
2
HBD
75.4
PSA (Ų)
0.76
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholecystokinin receptor type A CHEMBL2798 | Ki | 8.15 | 8.15 | 7.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholecystokinin receptor type A | Ki | = | 7.0 | nM | 8.15 | Binding affinity in Cholecystokinin type A receptor binding assay (iv) in mice | 9925722 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9925722 | 10.1021/jm980521l | Cholecystokinin receptor type A | 1 |
Data from ChEMBL 36 via Core Engine