Compound Detail
CHEMBL5618548
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Basic Information
| ChEMBL ID | CHEMBL5618548 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YOIUDZWNGKXRJQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
428.2
MW (Da)
5.69
ALogP
3
HBA
1
HBD
46.9
PSA (Ų)
0.58
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nuclear receptor subfamily 2 group E member 1 CHEMBL1961788 | EC50 | 7.05 | 7.05 | 90.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nuclear receptor subfamily 2 group E member 1 | EC50 | = | 90.0 | nM | 7.05 | Agonist activity at human TLX LBD expressed in HEK293T cells co-transfected with... | 39236094 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 39236094 | 10.1021/acs.jmedchem.4c01443 | Nuclear receptor subfamily 2 group E member 1 | 2 |
Data from ChEMBL 36 via Core Engine