Compound Detail
CHEMBL117163
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Basic Information
| ChEMBL ID | CHEMBL117163 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JOZTXLKBELNSQL-MXTKCAFNSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
345.4
MW (Da)
3.40
ALogP
3
HBA
2
HBD
77.8
PSA (Ų)
0.74
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Thromboxane A2 receptor CHEMBL2069 | Kd | 6.7 | 6.7 | 199.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Thromboxane A2 receptor | Kd | = | 199.53 | nM | 6.7 | Antagonistic activity against TP-receptor by inhibition of U 46619-induced contr... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(96)00021-2 | Thromboxane A2 receptor | 1 |
| - | 10.1016/0960-894X(96)00021-2 | Cavia porcellus | 1 |
| - | 10.1016/0960-894X(96)00021-2 | Homo sapiens | 1 |
Data from ChEMBL 36 via Core Engine