Compound Detail
CHEMBL366809
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Basic Information
| ChEMBL ID | CHEMBL366809 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HJRGLUUTXXPQKZ-OYHNWAKOSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
350.5
MW (Da)
3.48
ALogP
3
HBA
2
HBD
52.6
PSA (Ų)
0.89
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, NMDA 2C CHEMBL401 | IC50 | 7.4 | 7.4 | 40.0 | 1 |
| Adrenergic receptor alpha-1 CHEMBL1907610 | IC50 | 6.46 | 6.46 | 349.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, NMDA 2C | IC50 | = | 40.0 | nM | 7.4 | Tested for the NMDA antagonist activity using a functional assay, by protection ... | - |
| Adrenergic receptor alpha-1 | IC50 | = | 349.0 | nM | 6.46 | Tested for the Alpha-1 adrenergic receptor affinity in a standard radioligand bi... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80098-0 | Glutamate receptor ionotropic, NMDA 2C | 1 |
| - | 10.1016/S0960-894X(00)80098-0 | Adrenergic receptor alpha-1 | 1 |
| - | 10.1016/S0960-894X(00)80098-0 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine