Compound Detail
CHEMBL3196263
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 | CHEMBL3196263 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QVEYSWPEIDVNNI-ODCIPOBUSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
369.4
MW (Da)
2.96
ALogP
8
HBA
2
HBD
124.3
PSA (Ų)
0.40
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.4
EC50 1 meas. best 5.33
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Krueppel-like factor 5 CHEMBL1293249 | IC50 | 6.4 | 6.4 | 401.4 | 1 |
| HEK293 CHEMBL614818 | IC50 | 5.75 | 5.485 | 1765.8 | 2 |
| HEK293 CHEMBL614818 | EC50 | 5.33 | 5.33 | 4642.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Krueppel-like factor 5 | IC50 | = | 401.35 | nM | 6.4 | PUBCHEM_BIOASSAY: Luminescence-based dose response cell-based high throughput sc... | - |
| HEK293 | IC50 | = | 1765.75 | nM | 5.75 | PUBCHEM_BIOASSAY: HTS dose response assay for identification of inhibitors of TN... | - |
| HEK293 | EC50 | = | 4642.0 | nM | 5.33 | PUBCHEM_BIOASSAY: uHTS luminescence assay for the identification of compounds th... | - |
| HEK293 | IC50 | = | 6017.0 | nM | 5.22 | PUBCHEM_BIOASSAY: uHTS luminescence assay for the identification of compounds th... | - |
Data from ChEMBL 36 via Core Engine