Compound Detail
CHEMBL83056
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 | CHEMBL83056 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VHZPIMFKLUZYKJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
346.4
MW (Da)
3.42
ALogP
5
HBA
3
HBD
97.0
PSA (Ų)
0.51
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.83
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Purine nucleoside phosphorylase CHEMBL2395 | IC50 | 6.83 | 6.83 | 147.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Purine nucleoside phosphorylase | IC50 | = | 147.0 | nM | 6.83 | Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (P... | 8057293 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8057293 | 10.1021/jm00041a027 | Purine nucleoside phosphorylase | 2 |
Data from ChEMBL 36 via Core Engine