Compound Detail
CHEMBL21083
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Basic Information
| ChEMBL ID | CHEMBL21083 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AIGRKPCJNQCZCI-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
267.2
MW (Da)
3.03
ALogP
1
HBA
1
HBD
19.0
PSA (Ų)
0.91
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 6.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serotonin (5-HT) receptor CHEMBL2094123 | Kd | 6.51 | 6.51 | 309.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serotonin (5-HT) receptor | Kd | = | 309.03 | nM | 6.51 | Compound was evaluated for binding affinity towards 5-hydroxytryptamine receptor... | 6779006 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6779006 | 10.1021/jm00185a014 | Serotonin (5-HT) receptor | 1 |
Data from ChEMBL 36 via Core Engine