Compound Detail
CHEMBL1583872
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 | CHEMBL1583872 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MJCXXEWEFRJYID-UHFFFAOYSA-N |
4
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
279.4
MW (Da)
3.83
ALogP
3
HBA
0
HBD
50.8
PSA (Ų)
0.69
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.91
EC50 1 meas. best 6.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.19 | 6.19 | 643.0 | 1 |
| Beta-lactamase CHEMBL1293260 | IC50 | 5.91 | 5.91 | 1225.0 | 1 |
| Beta Lactamase CHEMBL1293246 | IC50 | 5.63 | 5.63 | 2331.0 | 1 |
| Beta-lactamase CHEMBL1293244 | IC50 | 5.6 | 5.6 | 2510.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 643.0 | nM | 6.19 | PUBCHEM_BIOASSAY: HCS for Compounds that Up-Regulate Insulin Promoter Activity i... | - |
| Beta-lactamase | IC50 | = | 1225.0 | nM | 5.91 | PubChem BioAssay. Epi-absorbance-based dose response assay for common IMP-1 and ... | - |
| Beta Lactamase | IC50 | = | 2331.0 | nM | 5.63 | PubChem BioAssay. Epi-absorbance-based dose response assay for common IMP-1 and ... | - |
| Beta-lactamase | IC50 | = | 2510.0 | nM | 5.6 | PubChem BioAssay. Epi-absorbance-based dose response assay for common IMP-1 and ... | - |
Data from ChEMBL 36 via Core Engine