Compound Detail
CHEMBL4080319
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Basic Information
| ChEMBL ID | CHEMBL4080319 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VYESEQLQFXUROZ-HNNXBMFYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
254.3
MW (Da)
3.40
ALogP
3
HBA
0
HBD
35.5
PSA (Ų)
0.82
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Taenia crassiceps CHEMBL612894 | IC50 | 6.0 | 6.0 | 1000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Taenia crassiceps | IC50 | = | 1000.0 | nM | 6.0 | Cysticidal activity against Taenia crassiceps cysts after 11 days by trypan blue... | 28231520 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28231520 | 10.1016/j.ejmech.2017.02.005 | Taenia crassiceps | 1 |
Data from ChEMBL 36 via Core Engine