Compound Detail
CHEMBL1270121
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Basic Information
| ChEMBL ID | CHEMBL1270121 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QYYHRSROCIJIIK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
365.4
MW (Da)
1.51
ALogP
6
HBA
1
HBD
81.5
PSA (Ų)
0.84
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(4) dopamine receptor CHEMBL3361 | Ki | 8.82 | 8.82 | 1.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(4) dopamine receptor | Ki | = | 1.52 | nM | 8.82 | Displacement of [3H]MSP from rat dopamine D4 receptor expressed in HEK293 cells ... | 20873719 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20873719 | 10.1021/jm100925m | No relevant target | 3 |
| 20873719 | 10.1021/jm100925m | D(4) dopamine receptor | 2 |
| 20873719 | 10.1021/jm100925m | Plasma | 2 |
| 20873719 | 10.1021/jm100925m | D(2) dopamine receptor | 1 |
| 20873719 | 10.1021/jm100925m | Sigma non-opioid intracellular receptor 1 | 1 |
| 20873719 | 10.1021/jm100925m | D(3) dopamine receptor | 1 |
| 20873719 | 10.1021/jm100925m | 5-hydroxytryptamine receptor 1A | 1 |
| 20873719 | 10.1021/jm100925m | 5-hydroxytryptamine receptor 2A | 1 |
| 20873719 | 10.1021/jm100925m | 5-hydroxytryptamine receptor 2C | 1 |
| 20873719 | 10.1021/jm100925m | Cannabinoid receptor 1 | 1 |
| 20873719 | 10.1021/jm100925m | Brain | 1 |
Data from ChEMBL 36 via Core Engine