Compound Detail
CHEMBL1204381
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Basic Information
| ChEMBL ID | CHEMBL1204381 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OIQBWKOJNCIYDZ-UHFFFAOYSA-N |
| Parent Compound | CHEMBL174306 |
| Active Moiety | CHEMBL174306 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
388.5
MW (Da)
2.51
ALogP
4
HBA
2
HBD
46.9
PSA (Ų)
0.83
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dopamine receptor CHEMBL2093868 | IC50 | 6.82 | 6.82 | 150.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dopamine receptor | IC50 | = | 150.0 | nM | 6.82 | 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