Compound Detail
CHEMBL933
METYRAPOL Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL933 |
| Name | METYRAPOL |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DDFNHFXLQJLFSX-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
1
Known Names
Molecular Properties
228.3
MW (Da)
2.49
ALogP
3
HBA
1
HBD
46.0
PSA (Ų)
0.88
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.99
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 8.99 | 8.99 | 1.0 | 1 |
| Cytochrome P450 11B1, mitochondrial CHEMBL2927 | IC50 | 5.15 | 5.15 | 7050.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1.02 | nM | 8.99 | Displacement of [131I]IMTO from CYP450c 11 in Wistar rat adrenal membrane | 18348518 |
| Cytochrome P450 11B1, mitochondrial | IC50 | = | 7050.0 | nM | 5.15 | Evaluated for inhibition of bovine adrenal cortical mitochondrial 11 beta-hydrox... | 6606707 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19497738 | 10.1016/j.bmcl.2009.05.065 | Unchecked | 2 |
| 874952 | 10.1021/jm00216a005 | Cytochrome P450 11B1, mitochondrial | 2 |
| 6606707 | 10.1021/jm00367a004 | Cytochrome P450 11B1, mitochondrial | 1 |
| 18348518 | 10.1021/jm800012w | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine