Compound Detail
CHEMBL53248
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Basic Information
| ChEMBL ID | CHEMBL53248 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NFHIPZYAYZPXJE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
211.3
MW (Da)
3.07
ALogP
2
HBA
0
HBD
30.0
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.11
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cytochrome P450 11B1, mitochondrial CHEMBL2927 | IC50 | 5.11 | 5.11 | 7720.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytochrome P450 11B1, mitochondrial | IC50 | = | 7720.0 | nM | 5.11 | Evaluated for inhibition of bovine adrenal cortical mitochondrial 11 beta-hydrox... | 6606707 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 874952 | 10.1021/jm00216a005 | Cytochrome P450 11B1, mitochondrial | 2 |
| 6606707 | 10.1021/jm00367a004 | Cytochrome P450 11B1, mitochondrial | 1 |
Data from ChEMBL 36 via Core Engine