Compound Detail
CHEMBL252204
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Basic Information
| ChEMBL ID | CHEMBL252204 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QELOIXSGJMIHBZ-ZWKOTPCHSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
361.4
MW (Da)
3.12
ALogP
3
HBA
3
HBD
100.6
PSA (Ų)
0.60
QED
0
Ro5 Violations
9
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 |
|---|---|---|---|---|---|
| Cytosol aminopeptidase CHEMBL3965 | Ki | 6.57 | 6.57 | 271.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytosol aminopeptidase | Ki | = | 271.0 | nM | 6.57 | Inhibition of pig kidney cytosolic leucine aminopeptidase | 18262419 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18262419 | 10.1016/j.bmcl.2008.01.107 | Cytosol aminopeptidase | 1 |
Data from ChEMBL 36 via Core Engine