Compound Detail
CHEMBL5436415
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Basic Information
| ChEMBL ID | CHEMBL5436415 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UZCVIBSSODXGNY-VJKINUSGSA-N |
1
Targets
1
Activities
1
Assay Types
2
PK Parameters
3
Publications
0
Known Names
Molecular Properties
359.5
MW (Da)
3.17
ALogP
3
HBA
2
HBD
77.8
PSA (Ų)
0.47
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 10.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prostaglandin E2 receptor EP4 subtype CHEMBL1836 | EC50 | 10.7 | 10.7 | 0.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| Cmax | 50.0 | nM | Mus musculus |
| F | 3.0 | % | Mus musculus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prostaglandin E2 receptor EP4 subtype | EC50 | = | 0.02 | nM | 10.7 | Agonist activity at EP4 (unknown origin) assessed as increase in calcium flux | 37270073 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37270073 | 10.1016/j.bmcl.2023.129351 | ADMET | 6 |
| 37270073 | 10.1016/j.bmcl.2023.129351 | Unchecked | 2 |
| 37270073 | 10.1016/j.bmcl.2023.129351 | Prostaglandin E2 receptor EP4 subtype | 1 |
Data from ChEMBL 36 via Core Engine