Compound Detail
CHEMBL262509
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 | CHEMBL262509 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QQTWMSYHJOKNLM-FOIQADDNSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
370.5
MW (Da)
4.07
ALogP
4
HBA
0
HBD
32.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.09
Ki 1 meas. best 6.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Oryctolagus cuniculus CHEMBL374 | IC50 | 7.09 | 7.09 | 82.0 | 1 |
| Voltage-dependent L-type calcium channel subunit alpha-1S CHEMBL3805 | Ki | 6.27 | 6.27 | 540.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Oryctolagus cuniculus | IC50 | = | 82.0 | nM | 7.09 | Vasorelaxant potency determined by relaxation of potassium depolarized rabbit ao... | - |
| Voltage-dependent L-type calcium channel subunit alpha-1S | Ki | = | 540.0 | nM | 6.27 | Displacement of [3H]diltiazem from L-type calcium channel of guinea pig striated... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80767-8 | Oryctolagus cuniculus | 1 |
| - | 10.1016/S0960-894X(01)80767-8 | Voltage-dependent L-type calcium channel subunit alpha-1S | 1 |
Data from ChEMBL 36 via Core Engine