Compound Detail
CHEMBL131553
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Basic Information
| ChEMBL ID | CHEMBL131553 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NPOOTUJUMPZTKY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
200.3
MW (Da)
1.89
ALogP
2
HBA
0
HBD
15.6
PSA (Ų)
0.62
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Canis familiaris CHEMBL373 | EC50 | 4.6 | 4.6 | 25000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Canis familiaris | EC50 | = | 25000.0 | nM | 4.6 | Effective concentration for the agonist in the isolated blood vessel using in vi... | 7562941 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7562941 | 10.1021/jm00020a021 | Canis familiaris | 3 |
| 7562941 | 10.1021/jm00020a021 | Adrenergic receptor alpha | 2 |
| 7562941 | 10.1021/jm00020a021 | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine