Compound Detail
CHEMBL270904
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Basic Information
| ChEMBL ID | CHEMBL270904 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FADVRXOASKIWLY-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
234.3
MW (Da)
-0.32
ALogP
4
HBA
3
HBD
85.0
PSA (Ų)
0.68
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Purine nucleoside phosphorylase CHEMBL2935 | Ki | 8.32 | 8.32 | 4.8 | 1 |
| Purine nucleoside phosphorylase CHEMBL4338 | Ki | 8.2 | 8.2 | 6.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Purine nucleoside phosphorylase | Ki | = | 4.8 | nM | 8.32 | Inhibition of bovine PNP | 18251493 |
| Purine nucleoside phosphorylase | Ki | = | 6.3 | nM | 8.2 | Inhibition of human PNP | 18251493 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18251493 | 10.1021/jm701265n | Purine nucleoside phosphorylase | 3 |
Data from ChEMBL 36 via Core Engine