Compound Detail
CHEMBL421389
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 | CHEMBL421389 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NAPIZYZVKMASNP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
427.6
MW (Da)
6.03
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.46
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.88
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Estrogen receptor CHEMBL2094114 | IC50 | 6.88 | 6.88 | 132.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Estrogen receptor | IC50 | = | 132.0 | nM | 6.88 | Inhibition of estradiol binding to estrogen receptor | 9685230 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9685230 | 10.1021/jm980048b | Estrogen receptor | 1 |
Data from ChEMBL 36 via Core Engine