Compound Detail
CHEMBL345138
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Basic Information
| ChEMBL ID | CHEMBL345138 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YJAAOLADPIKBIG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
326.4
MW (Da)
3.23
ALogP
5
HBA
0
HBD
52.8
PSA (Ų)
0.55
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human rhinovirus sp. CHEMBL612470 | EC50 | 5.43 | 5.43 | 3680.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human rhinovirus sp. | EC50 | = | 3680.0 | nM | 5.43 | In vitro concentration required to achieve 50% protection of HeLa cells from HRV... | 7877145 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)81153-7 | Vero | 6 |
| - | 10.1016/S0960-894X(01)81153-7 | HeLa | 2 |
| 7877145 | 10.1021/jm00005a007 | HeLa | 2 |
| 7877145 | 10.1021/jm00005a007 | Human rhinovirus sp. | 2 |
| - | 10.1016/S0960-894X(01)81153-7 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine