Compound Detail
CHEMBL2105855
ELDACIMIBE 🧪 Phase II
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🧪 Phase II
CCCCCCN(Cc1ccc(CC(C)(C)C)cc1)C(Nc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)=C1C(=O)OC(C)(C)OC1=O
Basic Information
| ChEMBL ID | CHEMBL2105855 |
| Name | ELDACIMIBE |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | HGLFNRGXRCKGSW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
5
Known Names
Molecular Properties
634.9
MW (Da)
9.12
ALogP
7
HBA
2
HBD
88.1
PSA (Ų)
0.08
QED
2
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Activity Summary
IC50 1 meas. best 7.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Acetyl-CoA acetyltransferase, mitochondrial CHEMBL2616 | IC50 | 7.52 | 7.52 | 30.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Acetyl-CoA acetyltransferase, mitochondrial | IC50 | = | 30.0 | nM | 7.52 | Inhibition of ACAT1 (unknown origin) | 38569434 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38569434 | 10.1016/j.ejmech.2024.116333 | Acetyl-CoA acetyltransferase, mitochondrial | 1 |
Data from ChEMBL 36 via Core Engine