Compound Detail
CHEMBL60648
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Basic Information
| ChEMBL ID | CHEMBL60648 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BGDYEYPXORXJHR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
469.6
MW (Da)
3.81
ALogP
6
HBA
1
HBD
74.9
PSA (Ų)
0.54
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL339 | Ki | 8.15 | 8.145 | 7.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | Ki | = | 7.0 | nM | 8.15 | Displacement of [3H]-Spiperone from Dopamine receptor D2 in rat striatum | 2902226 |
| D(2) dopamine receptor | Ki | = | 7.3 | nM | 8.14 | Ability to inhibit the [3H]spiperone binding to striatum Dopamine receptor D2 wa... | 2889830 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2889830 | 10.1021/jm00394a028 | D(2) dopamine receptor | 2 |
| 2889830 | 10.1021/jm00394a028 | Mus musculus | 2 |
| 2889830 | 10.1021/jm00394a028 | Rattus norvegicus | 2 |
| 2902226 | 10.1021/jm00118a011 | D(2) dopamine receptor | 1 |
| 2902226 | 10.1021/jm00118a011 | Dopamine receptor | 1 |
| 2902226 | 10.1021/jm00118a011 | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine