Compound Detail
CHEMBL154012
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Basic Information
| ChEMBL ID | CHEMBL154012 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BDPLRFUJKHTNIZ-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
496.7
MW (Da)
3.45
ALogP
5
HBA
5
HBD
116.5
PSA (Ų)
0.19
QED
0
Ro5 Violations
19
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor 1 CHEMBL2009 | Ki | 6.6 | 6.595 | 250.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor 1 | Ki | = | 250.0 | nM | 6.6 | Inhibition of the (-80 mV) current elicited by 100 uM glutamate by simultaneous ... | 12477358 |
| Glutamate receptor 1 | Ki | = | 254.0 | nM | 6.59 | Inhibition of the (-40 mV) current elicited by 100 uM glutamate by simultaneous ... | 12477358 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12477358 | 10.1021/jm020314s | Glutamate receptor 1 | 2 |
| 12477358 | 10.1021/jm020314s | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine