Compound Detail
CHEMBL117368
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Basic Information
| ChEMBL ID | CHEMBL117368 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HKWYQWIBPAFXEK-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
1
PK Parameters
4
Publications
0
Known Names
Molecular Properties
237.3
MW (Da)
2.35
ALogP
5
HBA
2
HBD
76.7
PSA (Ų)
0.72
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Urokinase-type plasminogen activator CHEMBL3286 | Ki | 6.43 | 6.015 | 370.0 | 2 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| F | 38.0 | % | Eutheria |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Urokinase-type plasminogen activator | Ki | = | 370.0 | nM | 6.43 | Binding affinity towards Urokinase-type plasminogen activator | 15214773 |
| Urokinase-type plasminogen activator | Ki | = | 2511.89 | nM | 5.6 | Inhibition of urokinase | 19385614 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL3301361 | No relevant target | 2 |
| 15214773 | 10.1021/jm040031v | Urokinase-type plasminogen activator | 1 |
| 15214773 | 10.1021/jm040031v | ADMET | 1 |
| 19385614 | 10.1021/jm801444x | Urokinase-type plasminogen activator | 1 |
Data from ChEMBL 36 via Core Engine