Compound Detail
CHEMBL1173426
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 | CHEMBL1173426 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KZVDVDUSQGIQFG-GOEBONIOSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
362.5
MW (Da)
2.71
ALogP
5
HBA
1
HBD
60.0
PSA (Ų)
0.84
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | EC50 | 7.77 | 6.675 | 17.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | EC50 | = | 17.0 | nM | 7.77 | Negative inotropic activity against potassium-induced contraction in guinea pig ... | 20509610 |
| NON-PROTEIN TARGET | EC50 | = | 2620.0 | nM | 5.58 | Antiarrhythmic activity in sinusoidal alternating current-induced guinea pig lef... | 20509610 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20509610 | 10.1021/jm100298d | NON-PROTEIN TARGET | 5 |
| 20509610 | 10.1021/jm100298d | Aorta | 1 |
Data from ChEMBL 36 via Core Engine