Compound Detail
CHEMBL594156
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Basic Information
| ChEMBL ID | CHEMBL594156 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PAKZAKJEQWGGBZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
399.4
MW (Da)
4.34
ALogP
5
HBA
1
HBD
81.2
PSA (Ų)
0.66
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuropeptide Y receptor type 5 CHEMBL2548 | IC50 | 8.6 | 8.6 | 2.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuropeptide Y receptor type 5 | IC50 | = | 2.5 | nM | 8.6 | Inhibition of rat Y5 receptor | 19720539 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19720539 | 10.1016/j.bmc.2009.08.019 | LLC-PK1 | 2 |
| 19720539 | 10.1016/j.bmc.2009.08.019 | Rattus norvegicus | 1 |
| 19720539 | 10.1016/j.bmc.2009.08.019 | Neuropeptide Y receptor type 5 | 1 |
| 19720539 | 10.1016/j.bmc.2009.08.019 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine