Compound Detail
CHEMBL269003
DIMETHYLSTILBESTROL Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL269003 |
| Name | DIMETHYLSTILBESTROL |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XPINIPXARSNZDM-VAWYXSNFSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
240.3
MW (Da)
4.05
ALogP
2
HBA
2
HBD
40.5
PSA (Ų)
0.78
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Androgen receptor CHEMBL3072 | IC50 | 4.85 | 4.85 | 14125.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Androgen receptor | IC50 | = | 14125.38 | nM | 4.85 | Inhibitory concentration against recombinant rat androgen receptor expressed in ... | 16134935 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3005573 | 10.1021/jm00153a004 | Estrogen receptor | 15 |
| 3005573 | 10.1021/jm00153a004 | Mus musculus | 3 |
| 6251218 | 10.1021/jm00183a008 | Estrogen receptor | 1 |
| 9632359 | 10.1021/jm9705521 | Estrogen receptor | 1 |
| 16134935 | 10.1021/jm050403f | Androgen receptor | 1 |
Data from ChEMBL 36 via Core Engine