Compound Detail
CHEMBL1094977
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Basic Information
| ChEMBL ID | CHEMBL1094977 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JIGIMLJTWNZFQN-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
199.2
MW (Da)
-1.62
ALogP
5
HBA
3
HBD
123.4
PSA (Ų)
0.40
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 6.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor 1 CHEMBL2009 | EC50 | 6.59 | 6.585 | 258.0 | 2 |
| Glutamate receptor 3 CHEMBL3595 | EC50 | 4.38 | 4.38 | 41600.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor 1 | EC50 | = | 258.0 | nM | 6.59 | Agonist activity at recombinant GluA1 receptor flip isoform expressed in Xenopus... | 20096591 |
| Glutamate receptor 1 | EC50 | = | 260.0 | nM | 6.58 | Agonist activity at recombinant GluA1 receptor expressed in Xenopus oocytes | 20096591 |
| Glutamate receptor 3 | EC50 | = | 41600.0 | nM | 4.38 | Agonist activity at recombinant GluA3 receptor expressed in Xenopus oocytes | 20096591 |
| Glutamate receptor 3 | EC50 | = | 41600.0 | nM | 4.38 | Agonist activity at recombinant GluA3 receptor flip isoform expressed in Xenopus... | 20096591 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20096591 | 10.1016/j.bmc.2009.12.072 | Glutamate receptor 1 | 2 |
| 20096591 | 10.1016/j.bmc.2009.12.072 | Glutamate receptor 3 | 2 |
| 20096591 | 10.1016/j.bmc.2009.12.072 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine