Compound Detail
CHEMBL2071267
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CCOC(=O)C(=O)N[C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)O[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
Basic Information
| ChEMBL ID | CHEMBL2071267 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | STQVZLVECVQICA-ISJGIBHGSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
579.7
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.95
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 4.95 | 4.935 | 11120.0 | 2 |
| HeLa CHEMBL399 | IC50 | 4.19 | 4.19 | 63970.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 11120.0 | nM | 4.95 | Antiplasmodial activity against Plasmodium falciparum 3D7 ring stage cells asses... | 22858300 |
| Plasmodium falciparum | IC50 | = | 12100.0 | nM | 4.92 | Antiplasmodial activity against drug resistant Plasmodium falciparum Dd2 ring st... | 22858300 |
| HeLa | IC50 | = | 63970.0 | nM | 4.19 | Cytotoxicity against human HeLa cells by MTT assay | 22858300 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22858300 | 10.1016/j.bmc.2012.06.038 | Unchecked | 3 |
| 22858300 | 10.1016/j.bmc.2012.06.038 | Plasmodium falciparum | 2 |
| 22858300 | 10.1016/j.bmc.2012.06.038 | Human immunodeficiency virus 1 | 1 |
| 22858300 | 10.1016/j.bmc.2012.06.038 | HeLa | 1 |
Data from ChEMBL 36 via Core Engine