Compound Detail
CHEMBL5431275
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 | CHEMBL5431275 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IQBJNQGOSPKPNX-RNCFNFMXSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
324.4
MW (Da)
0.29
ALogP
6
HBA
3
HBD
118.7
PSA (Ų)
0.73
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| threonine--tRNA ligase CHEMBL5465377 | IC50 | 4.52 | 4.52 | 30000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| threonine--tRNA ligase | IC50 | = | 30000.0 | nM | 4.52 | Inhibition of 6xHis-tag recombinant Plasmodium falciparum threonyl tRNA syntheta... | 38229753 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38229753 | 10.1021/acsmedchemlett.3c00403 | threonine--tRNA ligase | 1 |
Data from ChEMBL 36 via Core Engine