Compound Detail
CHEMBL167597
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Basic Information
| ChEMBL ID | CHEMBL167597 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YPUUTNJQPHSGDA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
352.4
MW (Da)
3.31
ALogP
6
HBA
2
HBD
101.0
PSA (Ų)
0.63
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cysteinyl leukotriene receptor CHEMBL2094254 | IC50 | 7.0 | 7.0 | 100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cysteinyl leukotriene receptor | IC50 | = | 100.0 | nM | 7.0 | Inhibition of LTD4-induced contraction in guinea pig ileum | 3033245 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2704027 | 10.1021/jm00124a014 | Cavia porcellus | 2 |
| 3033245 | 10.1021/jm00388a028 | Cysteinyl leukotriene receptor | 1 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine