Compound Detail
CHEMBL351052
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Basic Information
| ChEMBL ID | CHEMBL351052 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CUDXSHIKWVJPHQ-SNVBAGLBSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
381.5
MW (Da)
-1.49
ALogP
7
HBA
5
HBD
153.3
PSA (Ų)
0.15
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Coagulation factor X CHEMBL244 | IC50 | 4.66 | 4.66 | 22000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Coagulation factor X | IC50 | = | 22000.0 | nM | 4.66 | In vitro inhibitory activity against factor Xa | 12639567 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12639567 | 10.1016/s0960-894x(02)01037-5 | Coagulation factor X | 1 |
| 12639567 | 10.1016/s0960-894x(02)01037-5 | Prothrombin | 1 |
Data from ChEMBL 36 via Core Engine