Compound Detail
CHEMBL4284527
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Basic Information
| ChEMBL ID | CHEMBL4284527 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FQUHBKWYCHZDLT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
215.2
MW (Da)
2.15
ALogP
3
HBA
2
HBD
70.4
PSA (Ų)
0.80
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.06
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Macrophage cell line CHEMBL613891 | IC50 | 4.06 | 4.06 | 87900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Macrophage cell line | IC50 | = | 87900.0 | nM | 4.06 | Cytotoxicity against human PBMC-differentiated macrophages treated for 24 hrs fo... | 30108991 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30108991 | 10.1039/C8MD00139A | Macrophage cell line | 9 |
| 30108991 | 10.1039/C8MD00139A | Staphylococcus aureus | 6 |
| 30108991 | 10.1039/C8MD00139A | Streptococcus pyogenes | 6 |
| 30108991 | 10.1039/C8MD00139A | Klebsiella pneumoniae | 6 |
| 30108991 | 10.1039/C8MD00139A | Enterococcus faecium | 6 |
| 30108991 | 10.1039/C8MD00139A | Pseudomonas aeruginosa | 6 |
| 30108991 | 10.1039/C8MD00139A | Escherichia coli | 6 |
Data from ChEMBL 36 via Core Engine