Compound Detail
CHEMBL236710
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Basic Information
| ChEMBL ID | CHEMBL236710 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RPSJMYPIWSSFQA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
322.2
MW (Da)
0.93
ALogP
4
HBA
5
HBD
145.1
PSA (Ų)
0.52
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.76
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Purine nucleoside phosphorylase CHEMBL4338 | IC50 | 6.76 | 6.76 | 173.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Purine nucleoside phosphorylase | IC50 | = | 173.0 | nM | 6.76 | Inhibition of human PNP in presence of 1 mM phosphate | 17544667 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17544667 | 10.1016/j.bmcl.2007.05.054 | Purine nucleoside phosphorylase | 1 |
Data from ChEMBL 36 via Core Engine