Compound Detail
CHEMBL422388
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Basic Information
| ChEMBL ID | CHEMBL422388 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LCOBFNPHFDALDJ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
527.7
MW (Da)
5.36
ALogP
6
HBA
2
HBD
103.3
PSA (Ų)
0.32
QED
2
Ro5 Violations
14
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Leukotriene B4 receptor 1 CHEMBL3911 | IC50 | 10.0 | 10.0 | 0.1 | 1 |
| Homo sapiens CHEMBL372 | IC50 | 9.96 | 9.96 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Leukotriene B4 receptor 1 | IC50 | = | 0.1 | nM | 10.0 | Inhibitory activity against leukotriene B4 receptor | - |
| Homo sapiens | IC50 | = | 0.11 | nM | 9.96 | Compound was tested for inhibitory activity against leukotriene B4 induced neutr... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80853-2 | Leukotriene B4 receptor 1 | 1 |
| - | 10.1016/S0960-894X(01)80853-2 | Homo sapiens | 1 |
Data from ChEMBL 36 via Core Engine