Compound Detail
CHEMBL2440179
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CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)c1ccc(/C=C2\SC(=O)NC2=O)cc1)C(N)=O
Basic Information
| ChEMBL ID | CHEMBL2440179 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XDBKZTGXEHEECN-MBVSDOOSSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
645.8
MW (Da)
0.15
ALogP
9
HBA
9
HBD
264.5
PSA (Ų)
0.04
QED
2
Ro5 Violations
19
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24083834 | 10.1021/jm400828u | Unchecked | 2 |
| 24083834 | 10.1021/jm400828u | Huh-7 | 1 |
| 24083834 | 10.1021/jm400828u | dengue virus type 2 | 1 |
| 24083834 | 10.1021/jm400828u | Prothrombin | 1 |
Data from ChEMBL 36 via Core Engine