Compound Detail
CHEMBL236609
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Basic Information
| ChEMBL ID | CHEMBL236609 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BQXNKIUNSHZBLU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
442.6
MW (Da)
5.73
ALogP
4
HBA
1
HBD
33.1
PSA (Ų)
0.38
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.71
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 6.71 | 6.71 | 196.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 196.0 | nM | 6.71 | Antimalarial activity against Plasmodium falciparum 3D7 infected in ARh+ human e... | 29042223 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29042223 | 10.1016/j.bmc.2017.10.004 | Plasmodium falciparum | 5 |
| 18020390 | 10.1021/jm701143p | Somatostatin receptor type 5 | 1 |
Data from ChEMBL 36 via Core Engine