Compound Detail
CHEMBL4791334
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Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCC(=O)n2nc(N)c3c(-c4cccc(NC(=O)Nc5cccc(C(C)C)c5)c4)cccc32)C(C)(C)C)cc1
Basic Information
| ChEMBL ID | CHEMBL4791334 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XCMSXWSOOSQEDL-PDZNDIJHSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
940.2
MW (Da)
8.88
ALogP
11
HBA
6
HBD
213.7
PSA (Ų)
0.05
QED
4
Ro5 Violations
16
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32750566 | 10.1016/j.ejmech.2020.112654 | Vascular endothelial growth factor receptor 2 | 1 |
| 32750566 | 10.1016/j.ejmech.2020.112654 | EA.hy 926 | 1 |
| 32750566 | 10.1016/j.ejmech.2020.112654 | HEK293 | 1 |
Data from ChEMBL 36 via Core Engine