Compound Detail
CHEMBL282253
L-648051 Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL282253 |
| Name | L-648051 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZAKKEARLDPTRLX-UHFFFAOYSA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
476.6
MW (Da)
3.84
ALogP
7
HBA
2
HBD
135.0
PSA (Ų)
0.33
QED
0
Ro5 Violations
13
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 7.3
Ki 1 meas. best 5.21
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cavia porcellus CHEMBL369 | Kd | 7.3 | 7.3 | 50.1 | 2 |
| Cysteinyl leukotriene receptor CHEMBL2094254 | Ki | 5.21 | 5.21 | 6200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cavia porcellus | Kd | = | 50.12 | nM | 7.3 | Compound was tested for LTD4 guinea pig trachea contraction | 8709092 |
| Cavia porcellus | Kd | = | 50.12 | nM | 7.3 | Antagonistic activity against LTD4 induced contraction in guinea pig trachea | 1849993 |
| Cysteinyl leukotriene receptor | Ki | = | 6200.0 | nM | 5.21 | Binding affinity against Cysteinyl leukotriene D4 receptor | 8709092 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2547071 | 10.1021/jm00128a028 | Cavia porcellus | 4 |
| 8709092 | 10.1021/jm960088k | Cysteinyl leukotriene receptor | 1 |
| 8709092 | 10.1021/jm960088k | Cavia porcellus | 1 |
| 8709092 | 10.1021/jm960088k | Homo sapiens | 1 |
| 1849993 | 10.1021/jm00108a001 | Cavia porcellus | 1 |
| 2547071 | 10.1021/jm00128a028 | Cysteinyl leukotriene receptor | 1 |
Data from ChEMBL 36 via Core Engine