Compound Detail
CHEMBL293674
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Basic Information
| ChEMBL ID | CHEMBL293674 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CRKLFUQLHGESPS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
280.3
MW (Da)
2.53
ALogP
4
HBA
0
HBD
44.1
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.44 | 5.44 | 3600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 3600.0 | nM | 5.44 | In vitro inhibitory concentration against Plasmodium falciparum F32 | 12873511 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12873511 | 10.1016/s0960-894x(03)00509-2 | Plasmodium falciparum | 3 |
| 11591517 | 10.1016/s0960-894x(01)00562-5 | Trypanosoma cruzi | 2 |
| 12873511 | 10.1016/s0960-894x(03)00509-2 | Ferriprotoporphyrin IX | 2 |
| 16513345 | 10.1016/j.bmcl.2006.02.003 | Alpha-1D adrenergic receptor | 2 |
| 11514152 | 10.1016/s0960-894x(01)00387-0 | Leishmania braziliensis | 1 |
| 11514152 | 10.1016/s0960-894x(01)00387-0 | Leishmania amazonensis | 1 |
| 11514152 | 10.1016/s0960-894x(01)00387-0 | Leishmania donovani | 1 |
Data from ChEMBL 36 via Core Engine