Compound Detail
CHEMBL167062
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Basic Information
| ChEMBL ID | CHEMBL167062 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ADJLOHOSFKJYEC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
246.3
MW (Da)
1.82
ALogP
4
HBA
0
HBD
60.4
PSA (Ų)
0.60
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 4-hydroxyphenylpyruvate dioxygenase CHEMBL3203 | IC50 | 4.93 | 4.93 | 11700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 4-hydroxyphenylpyruvate dioxygenase | IC50 | = | 11700.0 | nM | 4.93 | Inhibition of 4-hydroxyphenylpyruvate dioxygenase of purified pig liver by enol-... | 10853644 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10853644 | 10.1016/s0960-894x(00)00115-3 | 4-hydroxyphenylpyruvate dioxygenase | 1 |
Data from ChEMBL 36 via Core Engine