Compound Detail
CHEMBL2436181
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Basic Information
| ChEMBL ID | CHEMBL2436181 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WQYCDVRRXFMVBC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
271.3
MW (Da)
4.07
ALogP
4
HBA
0
HBD
42.2
PSA (Ų)
0.59
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Toxoplasma gondii CHEMBL612888 | EC50 | 5.4 | 5.4 | 3950.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Toxoplasma gondii | EC50 | = | 3950.0 | nM | 5.4 | Antiparasitic activity against Toxoplasma gondii assessed as parasitic growth in... | 37871407 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24090919 | 10.1016/j.ejmech.2013.09.009 | Vero | 1 |
| 24090919 | 10.1016/j.ejmech.2013.09.009 | Toxoplasma gondii | 1 |
| 24090919 | 10.1016/j.ejmech.2013.09.009 | Trypanosoma cruzi | 1 |
| 37871407 | 10.1016/j.ejmech.2023.115885 | Toxoplasma gondii | 1 |
Data from ChEMBL 36 via Core Engine