Compound Detail
CHEMBL5170932
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Basic Information
| ChEMBL ID | CHEMBL5170932 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | COPHPKBTTIUIKA-KPKJPENVSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
350.4
MW (Da)
0.81
ALogP
6
HBA
3
HBD
114.0
PSA (Ų)
0.27
QED
0
Ro5 Violations
12
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 7.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 7.37 | 5.7375 | 43.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 43.0 | nM | 7.37 | Induction of Vgamma9Vdelta2 T cell proliferation in human peripheral blood | 35405283 |
| Unchecked | EC50 | = | 1600.0 | nM | 5.8 | Induction of interferon gamma production in human Vgamma9Vdelta2 T cells pretrea... | 35405283 |
| Unchecked | EC50 | = | 7200.0 | nM | 5.14 | Induction of interferon gamma production in human Vgamma9Vdelta2 T cells pretrea... | 35405283 |
| Unchecked | EC50 | = | 23000.0 | nM | 4.64 | Induction of interferon gamma production in human Vgamma9Vdelta2 T cells pretrea... | 35405283 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35405283 | 10.1016/j.bmcl.2022.128724 | Unchecked | 5 |
| 35405283 | 10.1016/j.bmcl.2022.128724 | ADMET | 2 |
| 35405283 | 10.1016/j.bmcl.2022.128724 | K562 | 1 |
Data from ChEMBL 36 via Core Engine