Compound Detail
CHEMBL1483555
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Basic Information
| ChEMBL ID | CHEMBL1483555 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CFGNRLRSPNPFQP-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
421.9
MW (Da)
5.41
ALogP
6
HBA
1
HBD
72.5
PSA (Ų)
0.37
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.59
EC50 1 meas. best 5.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Insulin-degrading enzyme CHEMBL1293287 | IC50 | 5.59 | 5.59 | 2568.0 | 1 |
| Beta-2 adrenergic receptor CHEMBL210 | EC50 | 5.09 | 5.09 | 8090.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.65 | 4.65 | 22399.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Insulin-degrading enzyme | IC50 | = | 2568.0 | nM | 5.59 | PUBCHEM_BIOASSAY: Dose Response: Fluorescence polarization-based cell-based high... | - |
| Beta-2 adrenergic receptor | EC50 | = | 8090.0 | nM | 5.09 | PubChem BioAssay. Dose response for HTS for Beta-2AR agonists via FAP method fro... | - |
| Unchecked | IC50 | = | 22399.0 | nM | 4.65 | PUBCHEM_BIOASSAY: Counterscreen for IDE inhibitors: Luminescence-based cell-base... | - |
Data from ChEMBL 36 via Core Engine