Compound Detail
CHEMBL1946759
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Basic Information
| ChEMBL ID | CHEMBL1946759 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AEVJNSJUOFUSKL-ZCFIWIBFSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
319.8
MW (Da)
0.79
ALogP
6
HBA
3
HBD
100.0
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.28
IC50 1 meas. best 5.53
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| ATP-binding cassette sub-family C member 8 CHEMBL1944490 | IC50 | 5.53 | 5.53 | 2980.0 | 1 |
| Molecular identity unknown CHEMBL612546 | EC50 | 4.28 | 4.28 | 53100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| ATP-binding cassette sub-family C member 8 | IC50 | = | 2980.0 | nM | 5.53 | Activation of SUR1 in rat pancreatic islets assessed as inhibition of glucose-in... | 22077416 |
| Molecular identity unknown | EC50 | = | 53100.0 | nM | 4.28 | Activation of KATP channel in K+-depolarized rat aortic rings assessed as relaxa... | 22077416 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22077416 | 10.1021/jm200786z | ATP-binding cassette sub-family C member 8 | 4 |
| 22077416 | 10.1021/jm200786z | Molecular identity unknown | 1 |
| 22077416 | 10.1021/jm200786z | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine