Compound Detail
CHEMBL5764715
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C[C@@H]1CN(C(=O)N2Cc3c(Nc4nc(OCC(F)(F)F)ncc4F)n[nH]c3C2(C)C)[C@@H](C)CN1C
Basic Information
| ChEMBL ID | CHEMBL5764715 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CEOVOUHGBMXHLJ-NEPJUHHUSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
500.5
MW (Da)
3.22
ALogP
7
HBA
2
HBD
102.5
PSA (Ų)
0.62
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein kinase C beta type CHEMBL3045 | Ki | 9.78 | 9.78 | 0.2 | 1 |
| Unchecked CHEMBL612545 | Ki | 9.78 | 9.78 | 0.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 0.165 | nM | 9.78 | Inhibition Assay: Protein Kinase C beta 2 (PKCβII) catalyzes the production of A... | - |
| Protein kinase C beta type | Ki | = | 0.165 | nM | 9.78 | Protein Kinase C beta 2 Assay: A typical assay was carried out on a 96-well, cle... | - |
Data from ChEMBL 36 via Core Engine