Compound Detail
CHEMBL405452
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Basic Information
| ChEMBL ID | CHEMBL405452 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OGBCUZPRUIHGDG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
541.7
MW (Da)
6.74
ALogP
5
HBA
1
HBD
34.6
PSA (Ų)
0.22
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| ScN2a CHEMBL613872 | EC50 | 7.7 | 7.7 | 20.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| ScN2a | EC50 | = | 20.0 | nM | 7.7 | Inhibition of protease-resistant scrapie prion protein activity in ScN2a cells | 17064077 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17064077 | 10.1021/jm060773j | ScN2a | 3 |
Data from ChEMBL 36 via Core Engine