Compound Detail
CHEMBL2314420
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Basic Information
| ChEMBL ID | CHEMBL2314420 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RLPUDUUKHKTMJZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
370.5
MW (Da)
3.34
ALogP
5
HBA
1
HBD
45.2
PSA (Ų)
0.54
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.76
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Emopamil-binding protein-like CHEMBL2311238 | Ki | 8.76 | 8.76 | 1.7 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Emopamil-binding protein-like | Ki | = | 1.72 | nM | 8.76 | Binding affinity to emopamil binding protein (unknown origin) | 23199475 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23199475 | 10.1016/j.bmc.2012.10.038 | Emopamil-binding protein-like | 1 |
Data from ChEMBL 36 via Core Engine