Compound Detail
CHEMBL1482541
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Basic Information
| ChEMBL ID | CHEMBL1482541 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GVMQVAYHFJDREY-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
471.9
MW (Da)
4.43
ALogP
8
HBA
0
HBD
94.8
PSA (Ų)
0.52
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nucleic Acid CHEMBL345 | EC50 | 6.85 | 6.85 | 140.0 | 1 |
| HEK293 CHEMBL614818 | EC50 | 5.66 | 5.515 | 2192.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nucleic Acid | EC50 | = | 140.0 | nM | 6.85 | PUBCHEM_BIOASSAY: Luminescent HTS for small molecule inhibitors of MT1-MMP trans... | - |
| HEK293 | EC50 | = | 2192.0 | nM | 5.66 | PUBCHEM_BIOASSAY: Cytotoxicity assay in HEK293 cells. (Class of assay: confirmat... | - |
| HEK293 | EC50 | = | 4251.0 | nM | 5.37 | PUBCHEM_BIOASSAY: PMA/Ionomycin induced NF-kB luciferase assay in 293- NF-kB-Luc... | - |
Data from ChEMBL 36 via Core Engine