Compound Detail
CHEMBL5197749
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Basic Information
| ChEMBL ID | CHEMBL5197749 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SWAOBCQKKPYMOI-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
406.9
MW (Da)
3.94
ALogP
6
HBA
2
HBD
87.5
PSA (Ų)
0.53
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.69
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ebolavirus CHEMBL4434621 | IC50 | 5.69 | 5.69 | 2040.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ebolavirus | IC50 | = | 2040.0 | nM | 5.69 | Antiviral activity against HIV based pseudotyped virus expressing Ebola-GP infec... | 34175537 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34175537 | 10.1016/j.ejmech.2021.113654 | Ebolavirus | 1 |
Data from ChEMBL 36 via Core Engine