Compound Detail
CHEMBL1929031
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Basic Information
| ChEMBL ID | CHEMBL1929031 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AVOILJLMPQVGEO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
377.3
MW (Da)
4.03
ALogP
4
HBA
1
HBD
56.1
PSA (Ų)
0.69
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mineralocorticoid receptor CHEMBL1994 | IC50 | 5.57 | 5.57 | 2700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mineralocorticoid receptor | IC50 | = | 2700.0 | nM | 5.57 | Displacement of [3H]aldosterone from cytosolic human MR expressed in HEK293 cell... | 22074142 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22074142 | 10.1021/jm2011645 | Mineralocorticoid receptor | 1 |
Data from ChEMBL 36 via Core Engine