Compound Detail
CHEMBL301133
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Basic Information
| ChEMBL ID | CHEMBL301133 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GCZXCWWIJNGSKF-INIZCTEOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
438.3
MW (Da)
3.67
ALogP
3
HBA
1
HBD
41.6
PSA (Ų)
0.73
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL339 | Ki | 6.78 | 6.78 | 168.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | Ki | = | 168.0 | nM | 6.78 | In vivo compound was evaluated for binding towards Dopamine receptor D2 in rat s... | 2136916 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2136916 | 10.1021/jm00163a029 | D(2) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine