Compound Detail
CHEMBL165857
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Basic Information
| ChEMBL ID | CHEMBL165857 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HBNCSFUNXVMMIC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
394.4
MW (Da)
4.29
ALogP
6
HBA
1
HBD
67.3
PSA (Ų)
0.55
QED
0
Ro5 Violations
5
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 |
|---|---|---|---|---|---|
| Dopamine receptor CHEMBL2093868 | IC50 | 7.17 | 7.17 | 68.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dopamine receptor | IC50 | = | 68.0 | nM | 7.17 | Ability to inhibit the binding of [3H]spiroperidol in rat striatal tissue | 2861286 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2861286 | 10.1021/jm00383a012 | Mus musculus | 1 |
| 2861286 | 10.1021/jm00383a012 | Dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine