Compound Detail
CHEMBL4293873
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Basic Information
| ChEMBL ID | CHEMBL4293873 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DMDDQKFDESRWKK-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
254.3
MW (Da)
2.42
ALogP
4
HBA
1
HBD
78.4
PSA (Ų)
0.62
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 4.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cerebellar granule neurone CHEMBL614452 | EC50 | 4.77 | 4.77 | 17080.0 | 1 |
| Aorta CHEMBL613606 | EC50 | 4.02 | 4.02 | 94820.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cerebellar granule neurone | EC50 | = | 17080.0 | nM | 4.77 | Neuroprotective activity against glutamate-induced excitotoxicity in mouse prima... | 30108699 |
| Aorta | EC50 | = | 94820.0 | nM | 4.02 | Vasodilating activity in Sprague-Dawley rat aortic ring precontracted with pheny... | 30108699 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30108699 | 10.1039/C6MD00509H | Aorta | 3 |
| 30108699 | 10.1039/C6MD00509H | Cerebellar granule neurone | 2 |
Data from ChEMBL 36 via Core Engine