Compound Detail
CHEMBL4215072
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COC(=O)C1=C[C@]2(C)[C@H]3CC=C4[C@@H]5CC(C)(C)CC[C@]5(C(=O)OC)CC[C@@]4(C)[C@]3(C)CC[C@H]2C(C)(C)C1=O
Basic Information
| ChEMBL ID | CHEMBL4215072 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QFOZNLVIELMDMK-FPFQSWSYSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
524.7
MW (Da)
6.85
ALogP
5
HBA
0
HBD
69.7
PSA (Ų)
0.22
QED
2
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28753294 | 10.1021/acs.jnatprod.7b00271 | Unchecked | 1 |
| 28753294 | 10.1021/acs.jnatprod.7b00271 | Signal transducer and activator of transcription 3 | 1 |
| 28753294 | 10.1021/acs.jnatprod.7b00271 | Nuclear factor erythroid 2-related factor 2 | 1 |
Data from ChEMBL 36 via Core Engine