Compound Detail
CHEMBL2322222
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL2322222 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JOSHHVFQAVLXLP-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
441.5
MW (Da)
5.59
ALogP
4
HBA
3
HBD
71.0
PSA (Ų)
0.30
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.6 | 7.05 | 24.9 | 2 |
| L6 CHEMBL614793 | IC50 | 5.45 | 5.45 | 3556.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 24.9 | nM | 7.6 | Antimalarial activity against chloroquine-sensitive Plasmodium falciparum NF54 a... | 23360309 |
| Plasmodium falciparum | IC50 | = | 312.6 | nM | 6.5 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum K1 aft... | 23360309 |
| L6 | IC50 | = | 3556.0 | nM | 5.45 | Toxicity against rat L6 cells after 72 hrs by Alamar blue assay | 23360309 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23360309 | 10.1021/jm300887b | Plasmodium falciparum | 3 |
| 23360309 | 10.1021/jm300887b | Unchecked | 2 |
| 23360309 | 10.1021/jm300887b | L6 | 1 |
Data from ChEMBL 36 via Core Engine