Compound Detail
CHEMBL1097153
GANODERIC ALDEHYDE TR Enter ChEMBL ID:
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C/C(C=O)=C/CC[C@@H](C)[C@H]1C[C@H](O)[C@@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
Basic Information
| ChEMBL ID | CHEMBL1097153 |
| Name | GANODERIC ALDEHYDE TR |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CQYCAQYQKRBNHY-RGKQSROTSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
452.7
MW (Da)
6.61
ALogP
3
HBA
1
HBD
54.4
PSA (Ų)
0.38
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.22 | 5.22 | 6000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 6000.0 | nM | 5.22 | Antiplasmodial activity against Plasmodium falciparum | 20384295 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20384295 | 10.1021/np100031c | Plasmodium falciparum | 1 |
Data from ChEMBL 36 via Core Engine