Compound Detail
CHEMBL3265059
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Basic Information
| ChEMBL ID | CHEMBL3265059 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZPVPORQSKRMVEP-NEPJUHHUSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
175.3
MW (Da)
2.54
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 5.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(3) dopamine receptor CHEMBL3138 | Ki | 5.93 | 5.93 | 1171.0 | 1 |
| D(2) dopamine receptor CHEMBL339 | Ki | 4.02 | 4.02 | 95593.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(3) dopamine receptor | Ki | = | 1171.0 | nM | 5.93 | Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley r... | 24848155 |
| D(2) dopamine receptor | Ki | = | 95593.0 | nM | 4.02 | Displacement of [3H]Spiperone from dopamine D2-like receptor in Sprague-Dawley r... | 24848155 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24848155 | 10.1021/jm401798r | Unchecked | 3 |
| 24848155 | 10.1021/jm401798r | D(2) dopamine receptor | 1 |
| 24848155 | 10.1021/jm401798r | D(3) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine