Compound Detail
CHEMBL1255975
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Basic Information
| ChEMBL ID | CHEMBL1255975 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JJXKGUBHEQGADG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
255.3
MW (Da)
2.66
ALogP
4
HBA
1
HBD
55.4
PSA (Ų)
0.77
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Macrophage migration inhibitory factor CHEMBL2085 | IC50 | 8.0 | 8.0 | 10.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Macrophage migration inhibitory factor | IC50 | = | 10.0 | nM | 8.0 | Inhibition of human recombinant MIF tautomerase | 20728358 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20728358 | 10.1016/j.bmcl.2010.07.129 | Macrophage migration inhibitory factor | 4 |
| 20728358 | 10.1016/j.bmcl.2010.07.129 | MIF/CD74 (Macrophage migration inhibitory factor and HLA-DR antigens-associated invariant chain) | 2 |
| 27156768 | 10.1016/j.bmcl.2016.04.074 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine