Compound Detail
CHEMBL542242
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 | CHEMBL542242 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WDVXPBZGZCWBBX-SAFXSLBJSA-N |
| Parent Compound | CHEMBL1191180 |
| Active Moiety | CHEMBL1191180 |
1
Targets
7
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
307.4
MW (Da)
1.06
ALogP
5
HBA
3
HBD
104.5
PSA (Ų)
0.77
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 7 meas. best 6.81
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.81 | 5.56 | 156.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 156.0 | nM | 6.81 | Ability to displace binding of [3H]AMPA to recombinant human Ionotropic glutamat... | 12238915 |
| Unchecked | Ki | = | 48500.0 | nM | 4.31 | Ability to displace binding of [3H]AMPA to recombinant human AMPA receptor Ionot... | 12238915 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12238915 | 10.1021/jm025548q | Unchecked | 2 |
| 12238915 | 10.1021/jm025548q | Glutamate receptor ionotropic, kainate 2 | 2 |
| 12238915 | 10.1021/jm025548q | Glutamate receptor 1 | 1 |
| 12238915 | 10.1021/jm025548q | Glutamate receptor 2 | 1 |
| 12238915 | 10.1021/jm025548q | Glutamate receptor 3 | 1 |
| 12238915 | 10.1021/jm025548q | Glutamate receptor 4 | 1 |
Data from ChEMBL 36 via Core Engine