Compound Detail
CHEMBL103436
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Basic Information
| ChEMBL ID | CHEMBL103436 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AZSJYUNXTSRXEI-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
223.3
MW (Da)
2.20
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.76
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 6.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serotonin (5-HT) receptor CHEMBL2094123 | Kd | 6.5 | 6.5 | 316.2 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serotonin (5-HT) receptor | Kd | = | 316.23 | nM | 6.5 | Affinity against 5-hydroxytryptamine receptors in rat fundus model | 7365744 |
| Serotonin (5-HT) receptor | Kd | = | 316.23 | nM | 6.5 | Competitive antagonist activity at 5-HT serotonin receptor in Sprague-Dawley rat... | 278843 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7365744 | 10.1021/jm00177a017 | Serotonin (5-HT) receptor | 1 |
| 278843 | 10.1021/jm00206a022 | Serotonin (5-HT) receptor | 1 |
Data from ChEMBL 36 via Core Engine