Compound Detail
CHEMBL1204382
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Basic Information
| ChEMBL ID | CHEMBL1204382 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YILXMZRKQONUCQ-UHFFFAOYSA-N |
| Parent Compound | CHEMBL433602 |
| Active Moiety | CHEMBL433602 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
372.5
MW (Da)
3.54
ALogP
3
HBA
1
HBD
26.7
PSA (Ų)
0.87
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dopamine receptor CHEMBL2093868 | IC50 | 7.68 | 7.68 | 21.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dopamine receptor | IC50 | = | 21.0 | nM | 7.68 | Ability to displace [3H]haloperidol from rat striatal membranes, in order to mea... | 6134833 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6134833 | 10.1021/jm00361a002 | Rattus norvegicus | 2 |
| 6134833 | 10.1021/jm00361a002 | Mus musculus | 1 |
| 6134833 | 10.1021/jm00361a002 | Dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine