Compound Detail
CHEMBL5788711
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
CC1(C(=O)N2CC(CN3C(=O)C(C)(C)N=C3c3ccc(-c4ccc5cc(F)ccc5c4)cc3F)C2)CC1
Basic Information
| ChEMBL ID | CHEMBL5788711 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UDVYJDDXFMTKLM-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
501.6
MW (Da)
5.41
ALogP
3
HBA
0
HBD
53.0
PSA (Ų)
0.47
QED
2
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.45
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty acid synthase CHEMBL4158 | IC50 | 7.45 | 7.45 | 35.5 | 2 |
| Unchecked CHEMBL612545 | IC50 | 7.23 | 7.23 | 58.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty acid synthase | IC50 | = | 35.5 | nM | 7.45 | Fatty Acid Synthase (FASN) Inhibition Scintillation Proximity Assay: In this ass... | - |
| Fatty acid synthase | IC50 | = | 35.5 | nM | 7.45 | Inhibition Scintillation Proximity Assay: In this assay, inhibition of FASN acti... | - |
| Unchecked | IC50 | = | 58.9 | nM | 7.23 | Fatty Acid Synthase Keto-reductase Domain (FASN KR) Inhibition: 10 μL assay buff... | - |
Data from ChEMBL 36 via Core Engine