Compound Detail
CHEMBL150523
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Basic Information
| ChEMBL ID | CHEMBL150523 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XFJSSDHKIXXJLM-MRVPVSSYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
221.3
MW (Da)
1.76
ALogP
4
HBA
1
HBD
42.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dopamine receptors; D1 & D2 CHEMBL2096910 | IC50 | 6.9 | 6.9 | 127.0 | 1 |
| D(2) dopamine receptor CHEMBL339 | IC50 | 6.42 | 6.42 | 376.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dopamine receptors; D1 & D2 | IC50 | = | 127.0 | nM | 6.9 | In vitro binding affinity to Dopamine receptor D1/Dopamine receptor D2 in rat st... | - |
| D(2) dopamine receptor | IC50 | = | 376.0 | nM | 6.42 | In vitro binding affinity to Dopamine receptor D2 in rat striatal membranes usin... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80462-5 | Rattus norvegicus | 2 |
| - | 10.1016/S0960-894X(01)80462-5 | D(2) dopamine receptor | 1 |
| - | 10.1016/S0960-894X(01)80462-5 | Dopamine receptors; D1 & D2 | 1 |
| - | 10.1016/S0960-894X(01)80462-5 | D(1A) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine