Compound Detail
CHEMBL4101567
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Basic Information
| ChEMBL ID | CHEMBL4101567 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FBRSCAZBTOPXIQ-UKTHLTGXSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
318.4
MW (Da)
4.54
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.57
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 6.24 | 5.8 | 570.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 570.0 | nM | 6.24 | Antiplasmodial activity against intraerythrocytic stage of Plasmodium falciparum... | 27228055 |
| Plasmodium falciparum | IC50 | = | 4400.0 | nM | 5.36 | Antiplasmodial activity against Plasmodium falciparum FcB1/Columbia infected in ... | 27228055 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27228055 | 10.1021/acs.jnatprod.6b00347 | Plasmodium falciparum | 2 |
Data from ChEMBL 36 via Core Engine