Compound Detail
CHEMBL299430
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Basic Information
| ChEMBL ID | CHEMBL299430 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IWFKJEVCXTYAFE-MWLCHTKSSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
219.3
MW (Da)
1.88
ALogP
3
HBA
3
HBD
52.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL339 | IC50 | 7.17 | 7.17 | 68.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | IC50 | = | 68.0 | nM | 7.17 | Displacement of [3H]- -spiperone from Dopamine receptor D2 in rat striatum | 1971308 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1971308 | 10.1021/jm00168a034 | Unchecked | 2 |
| 1971308 | 10.1021/jm00168a034 | D(1A) dopamine receptor | 1 |
| 1971308 | 10.1021/jm00168a034 | D(2) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine