Compound Detail
CHEMBL1082307
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1082307 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XPRUEADMUIYAMQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
346.4
MW (Da)
4.78
ALogP
5
HBA
2
HBD
63.0
PSA (Ų)
0.49
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Toll-like receptor 7 CHEMBL5936 | EC50 | 6.14 | 6.14 | 723.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Toll-like receptor 7 | EC50 | = | 723.0 | nM | 6.14 | Agonist activity at human TLR7 expressed in NF-kappaB-stimulated HEK293 cells as... | 20481492 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20481492 | 10.1021/jm100358c | Toll-like receptor 8 | 1 |
| 20481492 | 10.1021/jm100358c | Toll-like receptor 7 | 1 |
Data from ChEMBL 36 via Core Engine