Compound Detail
CHEMBL1222922
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1222922 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QTNZNZVMIMWDCV-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
356.4
MW (Da)
3.65
ALogP
5
HBA
0
HBD
61.2
PSA (Ų)
0.61
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Steroid 17-alpha-hydroxylase/17,20 lyase CHEMBL4430 | IC50 | 7.52 | 6.72 | 30.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Steroid 17-alpha-hydroxylase/17,20 lyase | IC50 | = | 30.0 | nM | 7.52 | Inhibition of 17,20-lyase activity of rat testicular microsomal P450-17alpha | 20675132 |
| Steroid 17-alpha-hydroxylase/17,20 lyase | IC50 | = | 1210.0 | nM | 5.92 | Inhibition of 17-alpha-hydroxylase activity of rat testicular microsomal P450-17... | 20675132 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20675132 | 10.1016/j.bmcl.2010.02.100 | Steroid 17-alpha-hydroxylase/17,20 lyase | 2 |
Data from ChEMBL 36 via Core Engine