Compound Detail
CHEMBL170814
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O=C(CNC(=O)OCc1ccccc1)N[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1
Basic Information
| ChEMBL ID | CHEMBL170814 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WJIZWWMYIHVOAM-NDEPHWFRSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
514.7
MW (Da)
5.13
ALogP
5
HBA
3
HBD
82.7
PSA (Ų)
0.31
QED
2
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14684304 | 10.1016/j.bmcl.2003.10.009 | Cathepsin K | 1 |
| 14684304 | 10.1016/j.bmcl.2003.10.009 | Procathepsin L | 1 |
| 14684304 | 10.1016/j.bmcl.2003.10.009 | Cathepsin B | 1 |
Data from ChEMBL 36 via Core Engine