Compound Detail
CHEMBL1447448
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 | CHEMBL1447448 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VYDIGHPOFMPCJD-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
251.3
MW (Da)
4.06
ALogP
2
HBA
1
HBD
42.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 5.25
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nuclear factor NF-kappa-B complex CHEMBL2094258 | EC50 | 5.25 | 5.25 | 5563.0 | 1 |
| HEK293 CHEMBL614818 | EC50 | 4.56 | 4.56 | 27398.0 | 1 |
| Neuropeptide Y receptor type 1 CHEMBL4777 | EC50 | 4.54 | 4.54 | 28902.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nuclear factor NF-kappa-B complex | EC50 | = | 5563.0 | nM | 5.25 | PUBCHEM_BIOASSAY: Name: High Throughput Screen to Identify Compounds that increa... | - |
| HEK293 | EC50 | = | 27398.0 | nM | 4.56 | PUBCHEM_BIOASSAY: Fluorescence-based counterscreen for potentiators or agonists ... | - |
| Neuropeptide Y receptor type 1 | EC50 | = | 28902.0 | nM | 4.54 | PUBCHEM_BIOASSAY: Fluorescence-based counterscreen for agonists of NPY-Y2: cell-... | - |
Data from ChEMBL 36 via Core Engine