Compound Detail
CHEMBL23519
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Basic Information
| ChEMBL ID | CHEMBL23519 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QRMZHEDLUQMLGK-JTQLQIEISA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
357.2
MW (Da)
2.38
ALogP
4
HBA
2
HBD
61.8
PSA (Ų)
0.85
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.25
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL339 | IC50 | 7.25 | 7.25 | 56.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | IC50 | = | 56.0 | nM | 7.25 | In vitro binding affinity at Dopamine receptor D2 in rat by displacing [3H]- spi... | 4040977 |
| D(2) dopamine receptor | IC50 | = | 56.0 | nM | 7.25 | In vivo inhibitory activity against dopamine (D2) receptor in rat caudate-putame... | 14592497 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 4040977 | 10.1021/jm00147a025 | Rattus norvegicus | 2 |
| 4040977 | 10.1021/jm00147a025 | D(2) dopamine receptor | 1 |
| 14592497 | 10.1016/j.bmcl.2003.08.063 | D(2) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine