Compound Detail
CHEMBL114823
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Basic Information
| ChEMBL ID | CHEMBL114823 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CZEXVXQIAFWROO-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
358.5
MW (Da)
3.88
ALogP
2
HBA
1
HBD
32.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, NMDA 1 CHEMBL2015 | IC50 | 6.5 | 5.39 | 320.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, NMDA 1 | IC50 | = | 320.0 | nM | 6.5 | Concentration required for 50% Inhibition of responses at cloned NR1A/2AB NMDA e... | 10978188 |
| Glutamate receptor ionotropic, NMDA 1 | IC50 | = | 52000.0 | nM | 4.28 | Concentration required for 50% Inhibition of responses at cloned NR1A/2A NMDA ex... | 10978188 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10978188 | 10.1021/jm000023o | Glutamate receptor ionotropic, NMDA 1 | 3 |
Data from ChEMBL 36 via Core Engine