Compound Detail
CHEMBL5096045
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Basic Information
| ChEMBL ID | CHEMBL5096045 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | USHQRIKZLHNPQR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
361.2
MW (Da)
1.73
ALogP
5
HBA
3
HBD
97.5
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cystic fibrosis transmembrane conductance regulator CHEMBL4051 | EC50 | 7.12 | 6.745 | 76.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cystic fibrosis transmembrane conductance regulator | EC50 | = | 76.0 | nM | 7.12 | Potentiator Assay: Fischer Rat Thyroid (FRT) epithelial cells, stably expressing... | - |
| Cystic fibrosis transmembrane conductance regulator | EC50 | = | 426.0 | nM | 6.37 | Potentiator Assay: Fischer Rat Thyroid (FRT) epithelial cells, stably expressing... | - |
Data from ChEMBL 36 via Core Engine