Compound Detail
CHEMBL42260
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Basic Information
| ChEMBL ID | CHEMBL42260 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XGLIHZCJAFMECG-AWEZNQCLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
350.5
MW (Da)
2.58
ALogP
5
HBA
2
HBD
71.0
PSA (Ų)
0.75
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL339 | Ki | 8.89 | 8.89 | 1.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | Ki | = | 1.28 | nM | 8.89 | Displacement of [3H]- spiperone from dopamine receptor D2 of striatal membranes ... | 1827843 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1827843 | 10.1021/jm00109a013 | D(2) dopamine receptor | 2 |
Data from ChEMBL 36 via Core Engine