Compound Detail
CHEMBL157815
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL157815 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DHTBHIFUXKMUGU-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
208.3
MW (Da)
0.95
ALogP
2
HBA
0
HBD
23.6
PSA (Ų)
0.64
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 5.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cavia porcellus CHEMBL369 | Kd | 5.75 | 5.675 | 1800.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cavia porcellus | Kd | = | 1800.0 | nM | 5.75 | Equilibrium dissociation constant receptor complex, measured in guinea pig ileum | 3346881 |
| Cavia porcellus | Kd | = | 2500.0 | nM | 5.6 | Equilibrium dissociation constant receptor complex, measured in guinea pig urina... | 3346881 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3346881 | 10.1021/jm00398a031 | Cavia porcellus | 4 |
| 3346881 | 10.1021/jm00398a031 | Mus musculus | 2 |
Data from ChEMBL 36 via Core Engine