Compound Detail
CHEMBL1269954
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Basic Information
| ChEMBL ID | CHEMBL1269954 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NXIPTBOTZGWDOZ-CCEZHUSRSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
278.3
MW (Da)
1.85
ALogP
6
HBA
2
HBD
118.0
PSA (Ų)
0.83
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| PH domain leucine-rich repeat-containing protein phosphatase 2 CHEMBL1275209 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| PH domain leucine-rich repeat-containing protein phosphatase 2 | IC50 | = | 7000.0 | nM | 5.16 | Inhibition of PHLPP2 phosphatase domain expressed in Escherichia coli | 20836557 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20836557 | 10.1021/jm100331d | PH domain leucine-rich repeat-containing protein phosphatase 2 | 1 |
| 20836557 | 10.1021/jm100331d | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine