Compound Detail
CHEMBL96505
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Basic Information
| ChEMBL ID | CHEMBL96505 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QALRCZZLZWMYQG-KGZKBUQUSA-N |
| Parent Compound | CHEMBL1179722 |
| Active Moiety | CHEMBL1179722 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
171.2
MW (Da)
0.02
ALogP
3
HBA
2
HBD
80.4
PSA (Ų)
0.63
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Xaa-Pro dipeptidase CHEMBL4185 | Ki | 6.57 | 6.57 | 270.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Xaa-Pro dipeptidase | Ki | = | 270.0 | nM | 6.57 | Inhibitory activity against porcine kidney prolidase | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00494-E | Xaa-Pro dipeptidase | 1 |
Data from ChEMBL 36 via Core Engine