Compound Detail
CHEMBL4207687
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Basic Information
| ChEMBL ID | CHEMBL4207687 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CUSWDTBBCIXCRB-UHFFFAOYSA-N |
| Parent Compound | CHEMBL189783 |
| Active Moiety | CHEMBL189783 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
145.2
MW (Da)
1.47
ALogP
1
HBA
0
HBD
26.9
PSA (Ų)
0.41
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Toxoplasma gondii CHEMBL612888 | IC50 | 5.3 | 5.3 | 5000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Toxoplasma gondii | IC50 | = | 5000.0 | nM | 5.3 | Antiparasitic activity against Toxoplasma gondii after 4 days by chlorophenol re... | 28242275 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28242275 | 10.1016/j.bmcl.2017.01.046 | Toxoplasma gondii | 1 |
Data from ChEMBL 36 via Core Engine