Compound Detail
CHEMBL4097451
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 | CHEMBL4097451 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BYBBDYRAOQNBDP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
269.3
MW (Da)
3.15
ALogP
4
HBA
2
HBD
92.0
PSA (Ų)
0.55
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.77 | 5.77 | 1690.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1690.0 | nM | 5.77 | Inhibition of Wnt/beta-catenin signaling (unknown origin) expressed in HEK293 ce... | 28233680 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28233680 | 10.1016/j.bmc.2017.01.046 | Unchecked | 2 |
| 28233680 | 10.1016/j.bmc.2017.01.046 | AMP-activated protein kinase, AMPK | 2 |
| 28233680 | 10.1016/j.bmc.2017.01.046 | HCT-116 | 1 |
Data from ChEMBL 36 via Core Engine