Compound Detail
CHEMBL242961
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Basic Information
| ChEMBL ID | CHEMBL242961 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VSHHPJNIKLWJMV-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
448.6
MW (Da)
5.89
ALogP
4
HBA
0
HBD
51.5
PSA (Ų)
0.31
QED
1
Ro5 Violations
13
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cytosolic phospholipase A2 CHEMBL3816 | IC50 | 6.08 | 6.08 | 840.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytosolic phospholipase A2 | IC50 | = | 840.0 | nM | 6.08 | Inhibition of human platelet cPLA2-alpha assessed as arachidonic acid release by... | 17320401 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17320401 | 10.1016/j.bmc.2007.02.016 | Cytosolic phospholipase A2 | 1 |
Data from ChEMBL 36 via Core Engine