Compound Detail
CHEMBL4741314
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Basic Information
| ChEMBL ID | CHEMBL4741314 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JKZSMTICNITOIO-GGAORHGYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
363.5
MW (Da)
4.11
ALogP
3
HBA
1
HBD
37.3
PSA (Ų)
0.89
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| INS1(832/13) CHEMBL4483248 | EC50 | 4.97 | 4.97 | 10760.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| INS1(832/13) | EC50 | = | 10760.0 | nM | 4.97 | Cytoprotective activity in rat INS-1 832/13 cells assessed as inhibition of STZ-... | 31918073 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31918073 | 10.1016/j.ejmech.2019.111976 | INS1(832/13) | 2 |
Data from ChEMBL 36 via Core Engine