Compound Detail
CHEMBL4630643
BAY-448 Enter ChEMBL ID:
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Cc1noc([C@H]2C[C@@H](c3ccc(C(F)(F)F)cc3)CN(C(=O)N3CCS(=O)(=O)C3)C2)n1
Basic Information
| ChEMBL ID | CHEMBL4630643 |
| Name | BAY-448 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BCJOKAFRZRDMFV-CABCVRRESA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
458.5
MW (Da)
2.78
ALogP
6
HBA
0
HBD
96.6
PSA (Ų)
0.69
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4507269 | Tyrosine-protein kinase ABL1 | 15 |
| - | 10.6019/CHEMBL5724558 | Colon cancer organoid | 12 |
| - | 10.6019/CHEMBL4507269 | Epidermal growth factor receptor | 12 |
| - | 10.6019/CHEMBL5674860 | Colon cancer organoid | 12 |
| - | 10.6019/CHEMBL4507269 | Receptor-type tyrosine-protein kinase FLT3 | 11 |
| - | 10.6019/CHEMBL4689842 | HEK-293T | 10 |
| - | 10.6019/CHEMBL4507269 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | 10 |
| - | 10.6019/CHEMBL4689842 | Fibroblast | 9 |
| - | 10.6019/CHEMBL4507269 | Mast/stem cell growth factor receptor Kit | 9 |
| - | 10.6019/CHEMBL4689842 | U2OS | 8 |
| - | 10.6019/CHEMBL4507269 | Unchecked | 8 |
| - | 10.6019/CHEMBL5608141 | Colon cancer organoid | 6 |
| - | 10.1158/2159-8290.CD-23-0050 | Colon cancer organoid | 5 |
| - | 10.6019/CHEMBL4507269 | Proto-oncogene tyrosine-protein kinase receptor Ret | 4 |
| - | 10.6019/CHEMBL4507269 | D(2) dopamine receptor | 3 |
| - | 10.6019/CHEMBL4507269 | Histamine H1 receptor | 3 |
| - | 10.6019/CHEMBL4507269 | Histamine H2 receptor | 3 |
| - | 10.6019/CHEMBL4507269 | Histamine H3 receptor | 3 |
| - | 10.6019/CHEMBL4507269 | Alpha-2A adrenergic receptor | 3 |
| - | 10.6019/CHEMBL4507269 | Alpha-1A adrenergic receptor | 3 |
Data from ChEMBL 36 via Core Engine