Compound Detail
CHEMBL358520
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Basic Information
| ChEMBL ID | CHEMBL358520 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | REEOVGYMIOKMOS-UHFFFAOYSA-L |
| Parent Compound | CHEMBL1184604 |
| Active Moiety | CHEMBL1184604 |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
394.7
MW (Da)
6.93
ALogP
0
HBA
0
HBD
0.0
PSA (Ų)
0.19
QED
1
Ro5 Violations
17
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 9.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 9.19 | 9.19 | 0.6 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 0.64 | nM | 9.19 | In vitro activity against Plasmodium falciparum | 10669577 |
| Plasmodium falciparum | IC50 | = | 0.65 | nM | 9.19 | In vitro inhibition of Plasmodium falciparum | 15887971 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19015340 | 10.1128/aac.00576-08 | Plasmodium cynomolgi | 3 |
| 10669577 | 10.1021/jm9911027 | Plasmodium falciparum | 1 |
| 15887971 | 10.1021/jm0492608 | Plasmodium falciparum | 1 |
| 15887971 | 10.1021/jm0492608 | Mus musculus | 1 |
| 20185316 | 10.1016/j.bmc.2010.01.068 | Plasmodium falciparum | 1 |
Data from ChEMBL 36 via Core Engine