Compound Detail
CHEMBL58115
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Basic Information
| ChEMBL ID | CHEMBL58115 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YMZDRVLWLRZEMP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
302.8
MW (Da)
2.18
ALogP
6
HBA
1
HBD
72.9
PSA (Ų)
0.59
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| rhinovirus A1B CHEMBL613713 | IC50 | 6.52 | 6.52 | 300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| rhinovirus A1B | IC50 | = | 300.0 | nM | 6.52 | In vitro activity against Rhinovirus type 1B by plaque inhibition assay. | 2845083 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2845083 | 10.1021/jm00118a025 | rhinovirus A1B | 1 |
Data from ChEMBL 36 via Core Engine