Compound Detail
CHEMBL28354
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Basic Information
| ChEMBL ID | CHEMBL28354 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZMKRWFZFMOKVCP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
232.3
MW (Da)
2.00
ALogP
3
HBA
1
HBD
37.5
PSA (Ų)
0.88
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | Kd | 6.4 | 6.4 | 398.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | Kd | = | 398.11 | nM | 6.4 | The ability to inhibit the 5-HT-induced contraction of isolated rat fundus muscl... | 6815326 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7120280 | 10.1021/jm00350a005 | Rattus norvegicus | 12 |
| 6815326 | 10.1021/jm00353a021 | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine