Compound Detail
CHEMBL3361364
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Basic Information
| ChEMBL ID | CHEMBL3361364 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IVJHGSGVTGMSNL-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
343.8
MW (Da)
3.86
ALogP
3
HBA
2
HBD
79.4
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | EC50 | 7.14 | 6.715 | 73.1 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | EC50 | = | 73.1 | nM | 7.14 | Antimalarial activity against multi-drug-resistant Plasmodium falciparum TM90-C2... | 25148516 |
| Plasmodium falciparum | EC50 | = | 517.0 | nM | 6.29 | Antimalarial activity against multi-drug-resistant Plasmodium falciparum W2 infe... | 25148516 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25148516 | 10.1021/jm500942v | Plasmodium falciparum | 2 |
| 25148516 | 10.1021/jm500942v | Unchecked | 1 |
| 25148516 | 10.1021/jm500942v | J774 | 1 |
| 25148516 | 10.1021/jm500942v | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine