Compound Detail
CHEMBL75640
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Basic Information
| ChEMBL ID | CHEMBL75640 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AUDVBDNDYZKMMM-ZXXMMSQZSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
185.2
MW (Da)
-0.47
ALogP
3
HBA
3
HBD
100.6
PSA (Ų)
0.51
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 5.92 | 5.92 | 1200.0 | 1 |
| Glutamate receptor ionotropic, kainate CHEMBL2094119 | IC50 | 5.52 | 5.52 | 3000.0 | 1 |
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | IC50 | 5.4 | 5.4 | 4000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate NMDA receptor | IC50 | = | 1200.0 | nM | 5.92 | Compound was evaluated for the inhibition of [3H]CGS-19,755 binding to NMDA rece... | - |
| Glutamate receptor ionotropic, kainate | IC50 | = | 3000.0 | nM | 5.52 | Compound was evaluated for the inhibition of [3H]-KA binding to Ionotropic gluta... | - |
| Glutamate receptor ionotropic, AMPA | IC50 | = | 4000.0 | nM | 5.4 | Compound was evaluated for the inhibition of [3H]AMPA binding to Ionotropic glut... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(96)00436-2 | Glutamate receptor ionotropic, kainate | 1 |
| - | 10.1016/0960-894X(96)00436-2 | Glutamate receptor ionotropic, AMPA | 1 |
| - | 10.1016/0960-894X(96)00436-2 | Glutamate NMDA receptor | 1 |
Data from ChEMBL 36 via Core Engine