Compound Detail
CHEMBL5970628
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Basic Information
| ChEMBL ID | CHEMBL5970628 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PMXDENUWARWPTE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
345.3
MW (Da)
0.63
ALogP
8
HBA
4
HBD
149.5
PSA (Ų)
0.40
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Xanthine dehydrogenase/oxidase CHEMBL1929 | IC50 | 9.42 | 9.42 | 0.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Xanthine dehydrogenase/oxidase | IC50 | = | 0.377 | nM | 9.42 | xanthine oxidase activity assay: Xanthine oxidase inhibition was determined usin... | - |
Data from ChEMBL 36 via Core Engine