Compound Detail
CHEMBL27783
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Basic Information
| ChEMBL ID | CHEMBL27783 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PHBJJKVNDZUAGC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
268.2
MW (Da)
2.40
ALogP
4
HBA
0
HBD
80.5
PSA (Ų)
0.48
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.18
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium channel protein type 2 subunit alpha CHEMBL4187 | Ki | 4.18 | 4.18 | 65560.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium channel protein type 2 subunit alpha | Ki | = | 65560.0 | nM | 4.18 | Binding affinity to Nav 1.2 (unknown origin) | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1007/s00044-013-0870-3 | Mus musculus | 16 |
| 10753468 | 10.1021/jm990068t | Mus musculus | 6 |
| - | 10.1007/s00044-012-0256-y | Mus musculus | 2 |
| - | 10.1007/s00044-012-0256-y | Sodium channel protein type 2 subunit alpha | 1 |
Data from ChEMBL 36 via Core Engine