Compound Detail
CHEMBL148024
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Basic Information
| ChEMBL ID | CHEMBL148024 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CLSKBBHRGMBREO-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
366.5
MW (Da)
2.53
ALogP
6
HBA
1
HBD
49.3
PSA (Ų)
0.88
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(4) dopamine receptor CHEMBL219 | Ki | 8.52 | 8.52 | 3.0 | 1 |
| D(2) dopamine receptor CHEMBL217 | Ki | 6.55 | 6.55 | 280.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(4) dopamine receptor | Ki | = | 3.0 | nM | 8.52 | In vitro binding affinity was measured at the cloned human Dopamine receptor D4.... | 9822559 |
| D(2) dopamine receptor | Ki | = | 280.0 | nM | 6.55 | In vitro binding affinity was measured at the cloned human Dopamine receptor D2 ... | 9822559 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9822559 | 10.1021/jm981041x | D(4) dopamine receptor | 1 |
| 9822559 | 10.1021/jm981041x | D(2) dopamine receptor | 1 |
| 9822559 | 10.1021/jm981041x | Dopamine receptors; D2 & D4 | 1 |
Data from ChEMBL 36 via Core Engine