Compound Detail
CHEMBL28221
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Basic Information
| ChEMBL ID | CHEMBL28221 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VKQNSQUUFNZWMB-WPWMEQJKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
459.6
MW (Da)
5.81
ALogP
6
HBA
0
HBD
57.1
PSA (Ų)
0.28
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Homo sapiens CHEMBL372 | IC50 | 6.38 | 6.38 | 420.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Homo sapiens | IC50 | = | 420.0 | nM | 6.38 | In vitro inhibitory activity against LTB4 synthesis in A-23187 stimulated human ... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00578-H | Homo sapiens | 1 |
Data from ChEMBL 36 via Core Engine