Compound Detail
CHEMBL5595575
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N#CCNC(=O)c1ccc(-c2ccnc(Nc3ccc(N4CCC(C(=O)NCCCCCC#Cc5cccc6c5C(=O)N(C5CCC(=O)NC5=O)C6=O)CC4)cc3)n2)cc1
Basic Information
| ChEMBL ID | CHEMBL5595575 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZFFKARYWSKLSMW-UHFFFAOYSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
805.9
MW (Da)
4.49
ALogP
11
HBA
4
HBD
206.6
PSA (Ų)
0.06
QED
2
Ro5 Violations
13
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38838918 | 10.1016/j.bmcl.2024.129838 | HEL | 1 |
| 38838918 | 10.1016/j.bmcl.2024.129838 | K562 | 1 |
| 38838918 | 10.1016/j.bmcl.2024.129838 | Tyrosine-protein kinase JAK1 | 1 |
| 38838918 | 10.1016/j.bmcl.2024.129838 | Protein cereblon/JAK1 | 1 |
| 38838918 | 10.1016/j.bmcl.2024.129838 | Protein cereblon/Tyrosine-protein kinase JAK2 | 1 |
| 38838918 | 10.1016/j.bmcl.2024.129838 | THP-1 | 1 |
Data from ChEMBL 36 via Core Engine