Compound Detail
CHEMBL86086
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Basic Information
| ChEMBL ID | CHEMBL86086 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YLUJPFVZUCEFOW-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
476.0
MW (Da)
7.82
ALogP
4
HBA
1
HBD
60.0
PSA (Ų)
0.22
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glucagon receptor CHEMBL1985 | IC50 | 8.19 | 7.735 | 6.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glucagon receptor | IC50 | = | 6.5 | nM | 8.19 | Binding affinity towards human glucagon receptor in absence of Mg2+ expressed as... | 11549467 |
| Glucagon receptor | IC50 | = | 53.0 | nM | 7.28 | Affinity for human glucagon receptor in presence of Mg2+ | 11549467 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11549467 | 10.1016/s0960-894x(01)00498-x | Glucagon receptor | 2 |
| 11549467 | 10.1016/s0960-894x(01)00498-x | MAP kinase p38 | 1 |
Data from ChEMBL 36 via Core Engine