Compound Detail
CHEMBL3936896
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL3936896 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CJKKEVCKJUHCKP-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
375.6
MW (Da)
7.09
ALogP
3
HBA
1
HBD
29.9
PSA (Ų)
0.34
QED
1
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sterol O-acyltransferase 1 CHEMBL2782 | IC50 | 4.41 | 4.41 | 39000.0 | 1 |
| Sterol O-acyltransferase 2 CHEMBL4465 | IC50 | 4.01 | 4.01 | 97000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sterol O-acyltransferase 1 | IC50 | = | 39000.0 | nM | 4.41 | Inhibition Assay: Methods for assessing the selectively of ACAT1 inhibitors are ... | - |
| Sterol O-acyltransferase 2 | IC50 | = | 97000.0 | nM | 4.01 | Inhibition Assay: Methods for assessing the selectively of ACAT1 inhibitors are ... | - |
Data from ChEMBL 36 via Core Engine