Compound Detail
CHEMBL5776800
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COc1ccc(Cl)c(S(=O)(=O)Nc2ccc(-c3nc(OCC4(CN)COC4)c4cn[nH]c4n3)cc2)c1
Basic Information
| ChEMBL ID | CHEMBL5776800 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IKRDEPHHZIRHJN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
531.0
MW (Da)
2.84
ALogP
9
HBA
3
HBD
154.3
PSA (Ų)
0.30
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase Sgk1 CHEMBL2343 | IC50 | 9.07 | 9.07 | 0.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase Sgk1 | IC50 | = | 0.85 | nM | 9.07 | Enzymatic Activity Assay: The compounds were tested for serum and glucocorticoid... | - |
Data from ChEMBL 36 via Core Engine