Compound Detail
CHEMBL320894
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CCOC(=O)NC(=O)O[C@@H]1CO[C@]2(COC(C)(C)O2)[C@@](O)(C2OC2CC(C)C)[C@@H]1OC
Basic Information
| ChEMBL ID | CHEMBL320894 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AFOCVGXBWOEVIU-QEHHDJDUSA-N |
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
447.5
MW (Da)
1.31
ALogP
10
HBA
2
HBD
134.3
PSA (Ų)
0.57
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(96)00564-1 | Gallus gallus | 1 |
| - | 10.1016/S0960-894X(96)00564-1 | A-431 | 1 |
| - | 10.1016/S0960-894X(96)00564-1 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine