Compound Detail
CHEMBL2333501
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Basic Information
| ChEMBL ID | CHEMBL2333501 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QMQGTWADIOTYLO-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
400.4
MW (Da)
3.35
ALogP
6
HBA
0
HBD
81.5
PSA (Ų)
0.69
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium/iodide cotransporter CHEMBL2331047 | IC50 | 8.19 | 7.69 | 6.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium/iodide cotransporter | IC50 | = | 6.5 | nM | 8.19 | inhibition of sodium iodide symporter in rat FRTL5 cells after 1 hr by arsenic/c... | 23454514 |
| Sodium/iodide cotransporter | IC50 | = | 65.0 | nM | 7.19 | Inhibition of sodium iodide symporter in rat FRTL5 cells assessed as inhibition ... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23454514 | 10.1016/j.ejmech.2013.01.043 | FRTL-5 | 1 |
| 23454514 | 10.1016/j.ejmech.2013.01.043 | Sodium/iodide cotransporter | 1 |
Data from ChEMBL 36 via Core Engine