Compound Detail
CHEMBL3142431
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Basic Information
| ChEMBL ID | CHEMBL3142431 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZNORQQGTBXRFHW-YNEHKIRRSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
324.4
MW (Da)
1.44
ALogP
7
HBA
2
HBD
84.6
PSA (Ų)
0.87
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HEL CHEMBL613888 | EC50 | 6.82 | 6.81 | 150.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HEL | EC50 | = | 150.0 | nM | 6.82 | Antiviral activity was measured as effective concentration required to reduce Va... | 11549457 |
| HEL | EC50 | = | 160.0 | nM | 6.8 | Antiviral activity was measured as effective concentration required to reduce Va... | 11549457 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11549457 | 10.1016/s0960-894x(01)00471-1 | HEL | 6 |
Data from ChEMBL 36 via Core Engine