Compound Detail
CHEMBL1161675
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Basic Information
| ChEMBL ID | CHEMBL1161675 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YRDAAESTPFRNFP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
285.1
MW (Da)
-0.58
ALogP
4
HBA
6
HBD
147.3
PSA (Ų)
0.38
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hypoxanthine-guanine phosphoribosyltransferase CHEMBL5069 | Ki | 4.63 | 4.63 | 23200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hypoxanthine-guanine phosphoribosyltransferase | Ki | = | 23200.0 | nM | 4.63 | Inhibition of hypoxanthine-guanine phosphoribosyltransferase (TcHPRT) | 15357980 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15357980 | 10.1016/j.bmcl.2004.06.042 | Hypoxanthine-guanine phosphoribosyltransferase | 1 |
Data from ChEMBL 36 via Core Engine