Compound Detail
CHEMBL1277608
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Basic Information
| ChEMBL ID | CHEMBL1277608 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JJSHHDVJICWJAP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
310.7
MW (Da)
3.44
ALogP
4
HBA
1
HBD
67.8
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium channel protein type 10 subunit alpha CHEMBL5158 | IC50 | 4.75 | 4.75 | 18000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium channel protein type 10 subunit alpha | IC50 | = | 18000.0 | nM | 4.75 | Inhibition of mouse NaV1.8 expressed in HEK293 cells by isotopic efflux assay | 20965738 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20965738 | 10.1016/j.bmc.2010.09.057 | Sodium channel protein type 10 subunit alpha | 1 |
Data from ChEMBL 36 via Core Engine