Compound Detail
CHEMBL511437
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Basic Information
| ChEMBL ID | CHEMBL511437 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XFEMWIUWAKCBPD-MQCYKSAASA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
557.7
MW (Da)
6.69
ALogP
9
HBA
1
HBD
114.9
PSA (Ų)
0.12
QED
2
Ro5 Violations
23
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vaccinia virus CHEMBL613493 | IC50 | 6.24 | 6.24 | 580.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vaccinia virus | IC50 | = | 580.0 | nM | 6.24 | Antiviral activity against Vaccinia virus | 19112024 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19112024 | 10.1016/j.bmc.2008.11.075 | Vaccinia virus | 1 |
Data from ChEMBL 36 via Core Engine