Compound Detail
CHEMBL5765459
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Basic Information
| ChEMBL ID | CHEMBL5765459 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZTGQWQGSBKBHPP-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
369.4
MW (Da)
1.11
ALogP
8
HBA
4
HBD
160.4
PSA (Ų)
0.39
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 10.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Xanthine dehydrogenase/oxidase CHEMBL1929 | IC50 | 10.4 | 10.4 | 0.0 | 1 |
| Solute carrier family 22 member 12 CHEMBL6120 | IC50 | 5.12 | 5.12 | 7500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Xanthine dehydrogenase/oxidase | IC50 | = | 0.04 | nM | 10.4 | xanthine oxidase activity assay: Xanthine oxidase inhibition was determined usin... | - |
| Solute carrier family 22 member 12 | IC50 | = | 7500.0 | nM | 5.12 | URAT1 activity assay: URAT1 (SLC22A12) activity was evaluated in a cellular upta... | - |
Data from ChEMBL 36 via Core Engine