Compound Detail
CHEMBL479797
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL479797 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QUHCPZVRCOASQB-IMJSIDKUSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
205.2
MW (Da)
-1.04
ALogP
4
HBA
4
HBD
137.9
PSA (Ų)
0.43
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.41 | 4.41 | 38904.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 39000.0 | nM | 4.41 | Displacement of [3H]KA from KA receptor in rat synaptosomes | 18578478 |
| Unchecked | IC50 | = | 38904.51 | nM | 4.41 | Displacement of [3H]KA from KA receptor in rat synaptosomes | 18578478 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18578477 | 10.1021/jm800091e | Excitatory amino acid transporter 1 | 4 |
| 18578477 | 10.1021/jm800091e | Excitatory amino acid transporter 2 | 4 |
| 18578477 | 10.1021/jm800091e | Excitatory amino acid transporter 3 | 4 |
| 18578478 | 10.1021/jm800092x | Unchecked | 3 |
| 18578478 | 10.1021/jm800092x | Glutamate NMDA receptor | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 7 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 4 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 1 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 5 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 3 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine