Compound Detail
CHEMBL2115569
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Basic Information
| ChEMBL ID | CHEMBL2115569 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BBMYJPDOXMMBJB-IISSFJTQSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
156.2
MW (Da)
-0.42
ALogP
3
HBA
2
HBD
52.6
PSA (Ų)
0.47
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.32
Ki 1 meas. best 5.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | Ki | 5.09 | 5.09 | 8200.0 | 1 |
| Glutamate receptor ionotropic, NMDA 1 CHEMBL330 | IC50 | 4.32 | 4.32 | 48000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | Ki | = | 8200.0 | nM | 5.09 | In vitro inhibitory activity of glycine (0.3 uM) responses in isolated cultured ... | - |
| Glutamate receptor ionotropic, NMDA 1 | IC50 | = | 48000.0 | nM | 4.32 | Inhibition of [3H]glycine binding to rat cortical membranes | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80094-3 | Glutamate receptor ionotropic, NMDA 1 | 1 |
| - | 10.1016/S0960-894X(00)80094-3 | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine