Compound Detail
CHEMBL576776
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 | CHEMBL576776 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PHWQUBVNOCLQJQ-KRWDZBQOSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
411.9
MW (Da)
3.97
ALogP
6
HBA
2
HBD
84.2
PSA (Ų)
0.64
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.33
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.33 | 5.91 | 470.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 470.0 | nM | 6.33 | Inhibition of gamma-secretase-mediated cleavage of human APP expressed in CHO ce... | 19443228 |
| Unchecked | EC50 | = | 3260.0 | nM | 5.49 | Inhibition of gamma-secretase-mediated mouse notch cleavage expressed in CHOK1 c... | 19443228 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19443228 | 10.1016/j.bmc.2009.04.052 | Unchecked | 6 |
Data from ChEMBL 36 via Core Engine