Compound Detail
CHEMBL5560222
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Basic Information
| ChEMBL ID | CHEMBL5560222 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XRXKSVOFXLCHBD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
423.9
MW (Da)
2.39
ALogP
8
HBA
2
HBD
110.0
PSA (Ų)
0.63
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| M-phase inducer phosphatase 3 CHEMBL2378 | IC50 | 7.22 | 7.22 | 60.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| M-phase inducer phosphatase 3 | IC50 | = | 60.0 | nM | 7.22 | Inhibition of full-length recombinant human CDC25C incubated for 5 to 8 mins by ... | 38101038 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38101038 | 10.1016/j.ejmech.2023.116037 | M-phase inducer phosphatase 3 | 1 |
Data from ChEMBL 36 via Core Engine