Compound Detail
CHEMBL3098748
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 | CHEMBL3098748 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IGEMKSYEPSTRAZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
335.2
MW (Da)
3.10
ALogP
3
HBA
2
HBD
79.3
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sortilin CHEMBL3091 | IC50 | 4.92 | 4.92 | 12000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sortilin | IC50 | = | 12000.0 | nM | 4.92 | Displacement of [3H]-neurotensin from sortilin (unknown origin) incubated 30 min... | 24355129 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24355129 | 10.1016/j.bmcl.2013.11.046 | Sortilin | 1 |
Data from ChEMBL 36 via Core Engine