Compound Detail
CHEMBL125327
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Basic Information
| ChEMBL ID | CHEMBL125327 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MXHSFPJPOSZOQI-QGZVFWFLSA-N |
1
Targets
1
Activities
1
Assay Types
2
PK Parameters
2
Publications
0
Known Names
Molecular Properties
355.5
MW (Da)
4.64
ALogP
4
HBA
1
HBD
68.0
PSA (Ų)
0.79
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily KQT member 1 CHEMBL5135 | IC50 | 8.7 | 8.7 | 2.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| F | 1.0 | % | Rattus norvegicus |
| T1/2 | 3.2 | hr | - |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily KQT member 1 | IC50 | = | 2.0 | nM | 8.7 | Molar concentration required to inhibit 50% of the activating delayed-rectifier ... | 11689063 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11689063 | 10.1021/jm015505u | ADMET | 2 |
| 11689063 | 10.1021/jm015505u | Potassium voltage-gated channel subfamily KQT member 1 | 1 |
Data from ChEMBL 36 via Core Engine