Compound Detail
CHEMBL1464584
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Basic Information
| ChEMBL ID | CHEMBL1464584 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PNIBPPKZAFXEIM-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
401.8
MW (Da)
3.34
ALogP
5
HBA
0
HBD
100.8
PSA (Ų)
0.43
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 2/Corticotropin-releasing factor-binding protein CHEMBL3885546 | EC50 | 6.15 | 6.15 | 709.0 | 1 |
| Kappa-type opioid receptor CHEMBL237 | EC50 | 5.25 | 5.25 | 5660.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 2/Corticotropin-releasing factor-binding protein | EC50 | = | 709.0 | nM | 6.15 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS hits for small molecule ago... | - |
| Kappa-type opioid receptor | EC50 | = | 5660.0 | nM | 5.25 | PUBCHEM_BIOASSAY: uHTS identification of small molecule agonists of the kappa op... | - |
Data from ChEMBL 36 via Core Engine