Compound Detail
CHEMBL247717
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 | CHEMBL247717 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YIGHPSGDRBAGJZ-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
340.7
MW (Da)
4.33
ALogP
3
HBA
1
HBD
33.6
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.7
Ki 1 meas. best 6.53
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, NMDA 2B CHEMBL1904 | Ki | 6.53 | 6.53 | 296.0 | 1 |
| Glutamate receptor ionotropic, NMDA 2B CHEMBL1904 | IC50 | 5.7 | 5.7 | 1976.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, NMDA 2B | Ki | = | 296.0 | nM | 6.53 | Binding affinity to NMDA NR2B receptor | 17498948 |
| Glutamate receptor ionotropic, NMDA 2B | IC50 | = | 1976.0 | nM | 5.7 | Antagonist activity at NMDA NR2B receptor assessed as calcium flux | 17498948 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17498948 | 10.1016/j.bmcl.2007.04.084 | Glutamate receptor ionotropic, NMDA 2B | 2 |
Data from ChEMBL 36 via Core Engine