Compound Detail
CHEMBL517564
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 | CHEMBL517564 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PRUAALOHVVCQPZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
340.9
MW (Da)
3.96
ALogP
2
HBA
2
HBD
39.3
PSA (Ų)
0.75
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(3) dopamine receptor CHEMBL234 | Ki | 5.51 | 5.51 | 3074.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(3) dopamine receptor | Ki | = | 3074.0 | nM | 5.51 | Displacement of [3H]N-methylspiperone from human dopamine D3 receptor by liquid ... | 19155177 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19155177 | 10.1016/j.bmc.2008.12.054 | D(2) dopamine receptor | 1 |
| 19155177 | 10.1016/j.bmc.2008.12.054 | D(3) dopamine receptor | 1 |
| 19155177 | 10.1016/j.bmc.2008.12.054 | D(4) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine