Compound Detail
CHEMBL22472
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Basic Information
| ChEMBL ID | CHEMBL22472 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GXLRFNYVOBFUES-AWEZNQCLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
320.4
MW (Da)
2.57
ALogP
4
HBA
2
HBD
61.8
PSA (Ų)
0.81
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL339 | IC50 | 8.32 | 8.32 | 4.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | IC50 | = | 4.8 | nM | 8.32 | In vitro binding affinity at Dopamine receptor D2 in rat by displacing [3H]- spi... | 4040977 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 4040977 | 10.1021/jm00147a025 | Rattus norvegicus | 2 |
| 4040977 | 10.1021/jm00147a025 | D(2) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine