Compound Detail
CHEMBL5169474
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Basic Information
| ChEMBL ID | CHEMBL5169474 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KRWWYRDEGHHIMB-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
357.8
MW (Da)
3.45
ALogP
5
HBA
1
HBD
46.1
PSA (Ų)
0.91
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Salmonella typhimurium CHEMBL351 | EC50 | 4.5 | 4.5 | 31980.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Salmonella typhimurium | EC50 | = | 31980.0 | nM | 4.5 | Antibacterial activity against intracellular multidrug-resistant Salmonella typh... | 36439974 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36439974 | 10.1039/d2md00182a | Salmonella typhimurium | 1 |
| 36439974 | 10.1039/d2md00182a | RAW264.7 | 1 |
| 36439974 | 10.1039/d2md00182a | ADMET | 1 |
Data from ChEMBL 36 via Core Engine