Compound Detail
CHEMBL202713
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 | CHEMBL202713 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RZKVFRDPHKJKDU-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
447.5
MW (Da)
3.65
ALogP
6
HBA
2
HBD
86.6
PSA (Ų)
0.40
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.25
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL217 | Ki | 7.25 | 7.25 | 56.6 | 1 |
| D(3) dopamine receptor CHEMBL234 | Ki | 6.9 | 6.9 | 127.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | Ki | = | 56.6 | nM | 7.25 | Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) ex... | 16392820 |
| D(3) dopamine receptor | Ki | = | 127.0 | nM | 6.9 | Displacement of [3H]spiroperidol from cloned human dopamine receptor D3 expresse... | 16392820 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16392820 | 10.1021/jm050734s | D(3) dopamine receptor | 1 |
| 16392820 | 10.1021/jm050734s | D(2) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine