Compound Detail
CHEMBL5871672
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O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc2c(-c3cccc(OC(F)F)c3)cn(-c3ccc(F)cc3)c2c1
Basic Information
| ChEMBL ID | CHEMBL5871672 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AZDATXZJTDOEOA-IBGZPJMESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
514.5
MW (Da)
4.95
ALogP
5
HBA
1
HBD
77.4
PSA (Ų)
0.39
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.28
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Diacylglycerol O-acyltransferase 2 CHEMBL5853 | IC50 | 9.28 | 9.28 | 0.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Diacylglycerol O-acyltransferase 2 | IC50 | = | 0.52 | nM | 9.28 | DGAT2 Enzymatic Activity Assay: DGAT2 activity was determined by measuring the a... | - |
Data from ChEMBL 36 via Core Engine