Compound Detail
CHEMBL1627420
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 | CHEMBL1627420 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OMLNKIQCBRKHOW-OKSLILNBSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
330.5
MW (Da)
3.53
ALogP
3
HBA
3
HBD
60.7
PSA (Ų)
0.79
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Estrogen receptor CHEMBL2093866 | EC50 | 6.3 | 5.79 | 495.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Estrogen receptor | EC50 | = | 495.0 | nM | 6.3 | Induction of pS2 mRNA expression in human MCF-7 mammary carcinoma cells | 8627615 |
| Estrogen receptor | EC50 | = | 5220.0 | nM | 5.28 | Affinity estrogen receptor of MCF-7 human mammary cancer cells | 8627615 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8627615 | 10.1021/jm9508245 | Estrogen receptor | 5 |
Data from ChEMBL 36 via Core Engine