Compound Detail
CHEMBL2407299
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CO[C@@]1(C)/C=C/[C@H](C(C)C)CC[C@]2(C)O[C@H]2CC/C(C)=C\[C@@H](OC(C)=O)C1
Basic Information
| ChEMBL ID | CHEMBL2407299 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QZKGTJRIDWIYSB-SQSFQOCOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
378.6
MW (Da)
5.22
ALogP
4
HBA
0
HBD
48.1
PSA (Ų)
0.38
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.56
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hippocampus CHEMBL613631 | EC50 | 6.56 | 6.56 | 277.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hippocampus | EC50 | = | 277.0 | nM | 6.56 | Neuroprotective activity in Sprague-Dawley rat hippocampal slice assessed as rev... | 23769165 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23769165 | 10.1016/j.bmc.2013.05.018 | Hippocampus | 3 |
Data from ChEMBL 36 via Core Engine