Compound Detail
CHEMBL44052
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Basic Information
| ChEMBL ID | CHEMBL44052 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RJEUWLQUKGSOBG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
315.3
MW (Da)
3.13
ALogP
4
HBA
3
HBD
95.9
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 8.27 | 8.27 | 5.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 5.4 | nM | 8.27 | Inhibition of [125I]L-T3 binding to rat hepatic 3,5,3''-triiodo-L-thyronine rece... | 10937719 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10937719 | 10.1016/s0960-894x(00)00309-7 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine