Compound Detail
CHEMBL91228
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Basic Information
| ChEMBL ID | CHEMBL91228 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WIXVSIWFYYDDMJ-OAHLLOKOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
224.3
MW (Da)
2.37
ALogP
2
HBA
0
HBD
27.0
PSA (Ų)
0.72
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL217 | Ki | 5.93 | 5.93 | 1178.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | Ki | = | 1178.0 | nM | 5.93 | In vitro binding affinity against cloned mammalian dopamine D2 autoreceptor, exp... | 8064801 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8064801 | 10.1021/jm00043a013 | D(2) dopamine receptor | 3 |
| 8064801 | 10.1021/jm00043a013 | Rattus norvegicus | 2 |
| 8064801 | 10.1021/jm00043a013 | D(3) dopamine receptor | 1 |
| 8064801 | 10.1021/jm00043a013 | 5-hydroxytryptamine receptor 1A | 1 |
Data from ChEMBL 36 via Core Engine