Compound Detail
CHEMBL5987790
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Basic Information
| ChEMBL ID | CHEMBL5987790 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SXIVSVSDFGYPBQ-NORZTXRYSA-N |
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
274.4
MW (Da)
3.97
ALogP
2
HBA
2
HBD
40.5
PSA (Ų)
0.70
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Estrogen receptor CHEMBL206 | IC50 | 9.0 | 8.3833 | 1.0 | 3 |
| Estrogen receptor beta CHEMBL242 | IC50 | 8.18 | 8.03 | 6.6 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Estrogen receptor | IC50 | = | 1.0 | nM | 9.0 | Competitive Binding Assay: Competitive binding assays were performed by incubati... | - |
| Estrogen receptor beta | IC50 | = | 6.6 | nM | 8.18 | Competitive Binding Assay: Competitive binding assays were performed by incubati... | - |
| Estrogen receptor | IC50 | = | 7.0 | nM | 8.15 | Competitive Binding Assay: Competitive binding assays were performed by incubati... | - |
| Estrogen receptor beta | IC50 | = | 8.2 | nM | 8.09 | Competitive Binding Assay: Competitive binding assays were performed by incubati... | - |
| Estrogen receptor | IC50 | = | 10.0 | nM | 8.0 | Competitive Binding Assay: Competitive binding assays were performed by incubati... | - |
| Estrogen receptor beta | IC50 | = | 15.0 | nM | 7.82 | Competitive Binding Assay: Competitive binding assays were performed by incubati... | - |
Data from ChEMBL 36 via Core Engine