Compound Detail
CHEMBL5202502
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Basic Information
| ChEMBL ID | CHEMBL5202502 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | INQOLNVZMVECCQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
424.4
MW (Da)
4.61
ALogP
8
HBA
1
HBD
76.1
PSA (Ų)
0.62
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Onchocerca gutturosa CHEMBL613143 | EC50 | 7.4 | 7.4 | 40.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Onchocerca gutturosa | EC50 | = | 40.0 | nM | 7.4 | Anti-filarial activity against Onchocerca gutturosa adult worms assessed as redu... | 35972896 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35972896 | 10.1021/acs.jmedchem.2c00960 | No relevant target | 2 |
| 35972896 | 10.1021/acs.jmedchem.2c00960 | ADMET | 2 |
| 35972896 | 10.1021/acs.jmedchem.2c00960 | Onchocerca gutturosa | 1 |
Data from ChEMBL 36 via Core Engine