Compound Detail
CHEMBL6026547
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Basic Information
| ChEMBL ID | CHEMBL6026547 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DFFFANVCCDREBV-LLVKDONJSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
458.4
MW (Da)
1.98
ALogP
9
HBA
3
HBD
135.9
PSA (Ų)
0.49
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase JAK2 CHEMBL2971 | IC50 | 5.12 | 5.095 | 7500.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase JAK2 | IC50 | = | 7500.0 | nM | 5.12 | JAK2 Kinase Domain Enzymatic Activity Assay: A reaction buffer containing the fo... | - |
| Tyrosine-protein kinase JAK2 | IC50 | = | 8500.0 | nM | 5.07 | JAK2 Kinase Domain Enzymatic Activity Assay: A reaction buffer containing the fo... | - |
Data from ChEMBL 36 via Core Engine