Compound Detail
CHEMBL401942
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Basic Information
| ChEMBL ID | CHEMBL401942 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OJACUCXUGGOJND-PCUGXKRQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
362.4
MW (Da)
4.90
ALogP
3
HBA
1
HBD
51.2
PSA (Ų)
0.63
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 8.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily KQT member 2 CHEMBL2985 | EC50 | 8.62 | 8.62 | 2.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily KQT member 2 | EC50 | = | 2.4 | nM | 8.62 | Induction of mouse KCNQ2 expressed in HEK293 cells at -40 mV holding potential b... | 24070783 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24070783 | 10.1016/j.bmcl.2013.08.092 | Rattus norvegicus | 6 |
| 24070783 | 10.1016/j.bmcl.2013.08.092 | Potassium voltage-gated channel subfamily KQT member 2 | 3 |
| 24070783 | 10.1016/j.bmcl.2013.08.092 | Brain | 2 |
| 17489574 | 10.1021/jm060989l | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine