Compound Detail
CHEMBL4077347
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Basic Information
| ChEMBL ID | CHEMBL4077347 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FVPNEJMUMLODEL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
342.9
MW (Da)
4.26
ALogP
2
HBA
1
HBD
32.3
PSA (Ų)
0.88
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| INS1 CHEMBL613545 | EC50 | 6.62 | 6.62 | 240.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| INS1 | EC50 | = | 240.0 | nM | 6.62 | Cytoprotective activity in rat INS-1 cells assessed as protection against tunica... | 28696115 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28696115 | 10.1021/acs.jmedchem.7b00435 | INS1 | 2 |
Data from ChEMBL 36 via Core Engine