Compound Detail
CHEMBL5206786
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Basic Information
| ChEMBL ID | CHEMBL5206786 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FCFRZXHZSYIILV-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
5
Publications
0
Known Names
Molecular Properties
483.9
MW (Da)
5.25
ALogP
6
HBA
0
HBD
56.1
PSA (Ų)
0.37
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Voltage-gated inwardly rectifying potassium channel KCNH2 CHEMBL240 | IC50 | 5.27 | 5.27 | 5400.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 150.0 | mL.min-1.kg-1 | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Voltage-gated inwardly rectifying potassium channel KCNH2 | IC50 | = | 5400.0 | nM | 5.27 | Inhibition of hERG ion channel by patch-clamp method | 35647711 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35647711 | 10.1021/acs.jmedchem.1c01856 | Glucagon-like peptide 1 receptor | 4 |
| 35647711 | 10.1021/acs.jmedchem.1c01856 | ADMET | 2 |
| 35647711 | 10.1021/acs.jmedchem.1c01856 | No relevant target | 1 |
| 35647711 | 10.1021/acs.jmedchem.1c01856 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
| 37591316 | 10.1016/j.bmcl.2023.129454 | Glucagon-like peptide 1 receptor | 1 |
Data from ChEMBL 36 via Core Engine