Compound Detail
CHEMBL4127146
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Basic Information
| ChEMBL ID | CHEMBL4127146 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KVLNCELNGBMHDX-FCWZHQICSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
316.4
MW (Da)
5.17
ALogP
2
HBA
1
HBD
54.4
PSA (Ų)
0.29
QED
1
Ro5 Violations
13
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Oxoeicosanoid receptor 1 CHEMBL1628461 | EC50 | 6.42 | 6.42 | 380.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Oxoeicosanoid receptor 1 | EC50 | = | 380.0 | nM | 6.42 | Agonist activity at human PK-tagged OXER1 expressed in CHOK1 cells assessed as E... | 29866479 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29866479 | 10.1016/j.bmc.2018.05.036 | Oxoeicosanoid receptor 1 | 2 |
Data from ChEMBL 36 via Core Engine