Compound Detail
CHEMBL4550010
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Basic Information
| ChEMBL ID | CHEMBL4550010 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HCXDSTXYBRCIQC-HNNXBMFYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
295.4
MW (Da)
3.46
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.85
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.83
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL217 | EC50 | 5.83 | 5.815 | 1496.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | EC50 | = | 1496.0 | nM | 5.83 | Agonist activity at D2 long receptor (unknown origin) transfected in human HEK29... | 32184974 |
| D(2) dopamine receptor | EC50 | = | 1584.89 | nM | 5.8 | Agonist activity at D2 long receptor (unknown origin) transfected in human HEK29... | 32184974 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32184974 | 10.1021/acsmedchemlett.9b00575 | D(2) dopamine receptor | 3 |
Data from ChEMBL 36 via Core Engine