Compound Detail
CHEMBL5979560
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C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3nc(N(C)C)ncc3F)n[nH]c2C1(C)C
Basic Information
| ChEMBL ID | CHEMBL5979560 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QECHNSUNXZVJGC-ZDUSSCGKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
459.6
MW (Da)
2.73
ALogP
7
HBA
2
HBD
96.5
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.06
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 8.06 | 8.06 | 8.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 8.75 | nM | 8.06 | Inhibition Assay: Protein Kinase C beta 2 (PKCβII) catalyzes the production of A... | - |
Data from ChEMBL 36 via Core Engine