Compound Detail
CHEMBL5618194
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 | CHEMBL5618194 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZRNKZXCUMOHKFS-YRNVUSSQSA-N |
1
Targets
1
Activities
1
Assay Types
5
PK Parameters
5
Publications
0
Known Names
Molecular Properties
328.4
MW (Da)
4.03
ALogP
4
HBA
1
HBD
63.6
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Solute carrier family 22 member 12 CHEMBL6120 | IC50 | 6.07 | 6.07 | 860.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 14683.4 | ng.hr.mL-1 | Rattus norvegicus |
| Cmax | 2091.36 | ng/mg | Rattus norvegicus |
| MRT | 11.39 | hr | Rattus norvegicus |
| T1/2 | 5.14 | hr | Rattus norvegicus |
| Tmax | 0.83 | hr | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Solute carrier family 22 member 12 | IC50 | = | 860.0 | nM | 6.07 | Inhibition of human URAT1 transfected in HEK293 cells by measuring 14C-uric acid... | 39142150 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 39142150 | 10.1016/j.ejmech.2024.116753 | ADMET | 8 |
| 39142150 | 10.1016/j.ejmech.2024.116753 | Mus musculus | 6 |
| 39142150 | 10.1016/j.ejmech.2024.116753 | HK-2 | 2 |
| 39142150 | 10.1016/j.ejmech.2024.116753 | Solute carrier family 22 member 12 | 1 |
| 39142150 | 10.1016/j.ejmech.2024.116753 | Solute carrier family 2, facilitated glucose transporter member 9 | 1 |
Data from ChEMBL 36 via Core Engine