Compound Detail
CHEMBL5423265
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C=C(CC[C@@H](C(=O)O)[C@H]1CC[C@H]2C3=C[C@@H](O)[C@@]45O[C@@H]4[C@H](O)[C@@H]4O[C@@H]4[C@]5(C)[C@H]3CC[C@]12C)C(C)C
Basic Information
| ChEMBL ID | CHEMBL5423265 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BCIFEPPRUZWALS-DZJUOKOYSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
472.6
MW (Da)
3.71
ALogP
5
HBA
3
HBD
102.8
PSA (Ų)
0.40
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37676247 | 10.1021/acs.jnatprod.3c00089 | A549 | 1 |
| 37676247 | 10.1021/acs.jnatprod.3c00089 | HL-60 | 1 |
| 37676247 | 10.1021/acs.jnatprod.3c00089 | HepG2 | 1 |
| 37676247 | 10.1021/acs.jnatprod.3c00089 | SU-DHL-2 | 1 |
| 37676247 | 10.1021/acs.jnatprod.3c00089 | Unchecked | 1 |
| 37676247 | 10.1021/acs.jnatprod.3c00089 | B-cell line | 1 |
Data from ChEMBL 36 via Core Engine