Compound Detail
CHEMBL4587854
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Basic Information
| ChEMBL ID | CHEMBL4587854 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WANJFSCKXWECBQ-KRWDZBQOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
377.4
MW (Da)
4.03
ALogP
5
HBA
2
HBD
75.6
PSA (Ų)
0.55
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 4.99
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Kd | 4.99 | 4.99 | 10270.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Kd | = | 10270.0 | nM | 4.99 | Binding affinity to influenza virus PB2 transformed into Escherichia coli rosset... | 31053507 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31053507 | 10.1016/j.bmcl.2019.04.042 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine