Compound Detail
CHEMBL275973
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 | CHEMBL275973 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WHSAGRCSNXHRBG-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
300.3
MW (Da)
2.64
ALogP
5
HBA
1
HBD
100.5
PSA (Ų)
0.23
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | EC50 | 7.05 | 7.05 | 89.1 | 1 |
| Cavia porcellus CHEMBL369 | EC50 | 6.77 | 6.77 | 169.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | EC50 | = | 89.13 | nM | 7.05 | Tested for relaxation of rat aorta smooth muscle precontracted with 30 mM KCI by... | - |
| Cavia porcellus | EC50 | = | 169.82 | nM | 6.77 | Tested for the ability to inhibit spontaneous tone in guinea pig trachealis by 5... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80297-8 | Rattus norvegicus | 2 |
| - | 10.1016/S0960-894X(00)80297-8 | Cavia porcellus | 2 |
Data from ChEMBL 36 via Core Engine