Compound Detail
CHEMBL507953
PSEUDOCARDATOLIDE C Enter ChEMBL ID:
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Cc1cc(=O)oc2c3c(c4c(c12)O[C@@H](C)[C@@H](C)[C@H]4O)OC(C)(C)C=C3
Basic Information
| ChEMBL ID | CHEMBL507953 |
| Name | PSEUDOCARDATOLIDE C |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AAPFBQWCKBJQGL-OHUAYANFSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
342.4
MW (Da)
3.74
ALogP
5
HBA
1
HBD
68.9
PSA (Ų)
0.74
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| H9 CHEMBL614806 | IC50 | 5.58 | 5.58 | 2600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| H9 | IC50 | = | 2600.0 | nM | 5.58 | Cytotoxicity against human H9 cells | 8792623 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8792623 | 10.1021/np9603784 | Human immunodeficiency virus 1 | 1 |
| 8792623 | 10.1021/np9603784 | H9 | 1 |
Data from ChEMBL 36 via Core Engine