Compound Detail
CHEMBL10867
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Basic Information
| ChEMBL ID | CHEMBL10867 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YBEHUPABZXNTEU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
430.4
MW (Da)
1.81
ALogP
7
HBA
2
HBD
110.2
PSA (Ų)
0.62
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neutrophil elastase CHEMBL248 | Ki | 7.0 | 7.0 | 100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neutrophil elastase | Ki | = | 100.0 | nM | 7.0 | In vitro inhibition of human leukocyte elastase mediated hydrolysis of the synth... | 7837246 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7837246 | 10.1021/jm00001a015 | Cricetinae gen. sp. | 3 |
| 7837246 | 10.1021/jm00001a015 | Neutrophil elastase | 1 |
Data from ChEMBL 36 via Core Engine