Compound Detail
CHEMBL2151778
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Basic Information
| ChEMBL ID | CHEMBL2151778 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QEMIBFSROWXPLM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
293.4
MW (Da)
3.34
ALogP
4
HBA
0
HBD
39.9
PSA (Ų)
0.63
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium channel protein type 8 subunit alpha CHEMBL2752 | IC50 | 4.5 | 4.5 | 31700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium channel protein type 8 subunit alpha | IC50 | = | 31700.0 | nM | 4.5 | Inhibition of rat NaV1.6-mediated current expressed in human HEK293 cells by pat... | 22981330 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22981330 | 10.1016/j.bmcl.2012.08.067 | Sodium channel protein type 8 subunit alpha | 2 |
Data from ChEMBL 36 via Core Engine