Compound Detail
CHEMBL524449
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Basic Information
| ChEMBL ID | CHEMBL524449 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CUZRZOGJMYSPPW-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
279.7
MW (Da)
3.84
ALogP
3
HBA
0
HBD
22.0
PSA (Ų)
0.66
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Macrophage migration inhibitory factor CHEMBL2085 | IC50 | 5.38 | 5.38 | 4200.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Macrophage migration inhibitory factor | IC50 | = | 4200.0 | nM | 5.38 | Inhibition of human recombinant MIF tautomerase | 19090668 |
| Macrophage migration inhibitory factor | IC50 | = | 4200.0 | nM | 5.38 | Inhibition of human recombinant MIF tautomerase activity using 4-hydroxyphenylpy... | 21719283 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20485427 | 10.1038/nature09107 | Plasmodium falciparum | 4 |
| 21719283 | 10.1016/j.bmcl.2011.05.127 | Macrophage migration inhibitory factor | 2 |
| 19090668 | 10.1021/jm801100v | Macrophage migration inhibitory factor | 1 |
| 19090668 | 10.1021/jm801100v | MIF/CD74 (Macrophage migration inhibitory factor and HLA-DR antigens-associated invariant chain) | 1 |
| 20485427 | 10.1038/nature09107 | HepG2 | 1 |
| 20485427 | 10.1038/nature09107 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine