Compound Detail
CHEMBL192746
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Basic Information
| ChEMBL ID | CHEMBL192746 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XTKNAIQXSUEZPU-CQSZACIVSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
248.4
MW (Da)
2.51
ALogP
3
HBA
0
HBD
25.2
PSA (Ų)
0.72
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(3) dopamine receptor CHEMBL234 | Ki | 7.36 | 7.36 | 43.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(3) dopamine receptor | Ki | = | 43.65 | nM | 7.36 | Inhibition constant against [3H]-spiperone binding to human Dopamine receptor D3... | 15801839 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15801839 | 10.1021/jm049269+ | D(3) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine