Compound Detail
CHEMBL335570
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Basic Information
| ChEMBL ID | CHEMBL335570 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YOILXOMTHPUMRG-PUODRLBUSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
249.3
MW (Da)
1.94
ALogP
4
HBA
1
HBD
41.9
PSA (Ų)
0.87
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(3) dopamine receptor CHEMBL234 | Ki | 8.96 | 8.96 | 1.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(3) dopamine receptor | Ki | = | 1.1 | nM | 8.96 | Compound was measured for its ability to compete with [3H]spiperone binding to t... | 14521403 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14521403 | 10.1021/jm030085p | D(3) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine