Compound Detail
CHEMBL478737
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N#C[C@]1(NC(=O)[C@H](N)Cc2cccs2)C[C@H]1c1ccccc1.O=C(O)C(F)(F)F
Basic Information
| ChEMBL ID | CHEMBL478737 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HSOZEOMYHDEMKF-FFMLRVAQSA-N |
| Parent Compound | CHEMBL1186795 |
| Active Moiety | CHEMBL1186795 |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
311.4
MW (Da)
2.18
ALogP
4
HBA
2
HBD
78.9
PSA (Ų)
0.89
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17535802 | 10.1074/jbc.m702615200 | Dipeptidyl peptidase 1 | 2 |
| 17535802 | 10.1074/jbc.m702615200 | Cathepsin G | 2 |
| 17535802 | 10.1074/jbc.m702615200 | Neutrophil elastase | 2 |
| 17535802 | 10.1074/jbc.m702615200 | Cathepsin B | 1 |
| 17535802 | 10.1074/jbc.m702615200 | Procathepsin L | 1 |
| 17535802 | 10.1074/jbc.m702615200 | Pro-cathepsin H | 1 |
| 17535802 | 10.1074/jbc.m702615200 | Cathepsin S | 1 |
| 17535802 | 10.1074/jbc.m702615200 | U-937 | 1 |
| 17535802 | 10.1074/jbc.m702615200 | Myeloblastin | 1 |
Data from ChEMBL 36 via Core Engine