Compound Detail
CHEMBL506721
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Basic Information
| ChEMBL ID | CHEMBL506721 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RHZAGARGKYFZJB-MRXNPFEDSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
280.4
MW (Da)
3.03
ALogP
3
HBA
1
HBD
38.5
PSA (Ų)
0.82
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.11
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(1A) dopamine receptor CHEMBL2056 | Ki | 7.11 | 7.11 | 78.0 | 1 |
| 5-hydroxytryptamine receptor 1A CHEMBL273 | Ki | 6.19 | 6.19 | 640.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(1A) dopamine receptor | Ki | = | 78.0 | nM | 7.11 | Displacement of [3H]SCH-23390 from human dopamine D1 receptor expressed in HEK29... | 18562201 |
| 5-hydroxytryptamine receptor 1A | Ki | = | 640.0 | nM | 6.19 | Displacement of [3H]8-OH-DPAT from rat 5HT1A receptor expressed in CHO cells | 18562201 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18562201 | 10.1016/j.bmc.2008.05.077 | D(1A) dopamine receptor | 2 |
| 18562201 | 10.1016/j.bmc.2008.05.077 | 5-hydroxytryptamine receptor 1A | 2 |
| 18562201 | 10.1016/j.bmc.2008.05.077 | D(2) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine