Compound Detail
CHEMBL4127374
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CC(C)C[C@H](NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@H](CCl)C[C@@H]1CCCNC1=O
Basic Information
| ChEMBL ID | CHEMBL4127374 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YKZCRZPQPWXTBC-QMMMHVTISA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
635.2
MW (Da)
4.85
ALogP
5
HBA
4
HBD
125.6
PSA (Ų)
0.19
QED
1
Ro5 Violations
14
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29779977 | 10.1016/j.bmcl.2018.05.012 | Protease | 2 |
| 29779977 | 10.1016/j.bmcl.2018.05.012 | Nonstructural polyprotein | 2 |
| 29779977 | 10.1016/j.bmcl.2018.05.012 | Norovirus | 2 |
| 29779977 | 10.1016/j.bmcl.2018.05.012 | Huh-7 | 1 |
| 29779977 | 10.1016/j.bmcl.2018.05.012 | PBMC | 1 |
| 29779977 | 10.1016/j.bmcl.2018.05.012 | CCRF-CEM | 1 |
| 29779977 | 10.1016/j.bmcl.2018.05.012 | Vero | 1 |
Data from ChEMBL 36 via Core Engine