Compound Detail
CHEMBL153232
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Basic Information
| ChEMBL ID | CHEMBL153232 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GUUZXORJVABSSF-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
222.2
MW (Da)
1.79
ALogP
2
HBA
2
HBD
74.6
PSA (Ų)
0.77
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mast cell carboxypeptidase A CHEMBL2645 | Ki | 5.3 | 5.3 | 5000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mast cell carboxypeptidase A | Ki | = | 5000.0 | nM | 5.3 | The compound was evaluated for the inhibition of Carboxypeptidase A | 12477342 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12477342 | 10.1021/jm020424z | Mast cell carboxypeptidase A | 1 |
Data from ChEMBL 36 via Core Engine