Compound Detail
CHEMBL3929446
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Basic Information
| ChEMBL ID | CHEMBL3929446 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SLJMALBBLCTSGB-KRWDZBQOSA-N |
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
345.5
MW (Da)
4.90
ALogP
2
HBA
1
HBD
57.6
PSA (Ų)
0.68
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 6 meas. best 6.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prostaglandin E2 receptor EP2 subtype CHEMBL1881 | EC50 | 6.26 | 5.82 | 548.0 | 4 |
| Prostaglandin E2 receptor EP3 subtype CHEMBL3710 | EC50 | 4.71 | 4.71 | 19544.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prostaglandin E2 receptor EP2 subtype | EC50 | = | 548.0 | nM | 6.26 | Agonist activity at recombinant human EP2 receptor expressed in HEK293-EBNA cell... | - |
| Prostaglandin E2 receptor EP2 subtype | EC50 | = | 548.0 | nM | 6.26 | Agonist activity at human recombinant EP2 receptor expressed in HEK-EBNA cells i... | - |
| Prostaglandin E2 receptor EP2 subtype | EC50 | = | 4121.0 | nM | 5.38 | Agonist activity at recombinant human EP2 receptor expressed in HEK293-EBNA cell... | - |
| Prostaglandin E2 receptor EP2 subtype | EC50 | = | 4121.0 | nM | 5.38 | Agonist activity at human recombinant EP2 receptor expressed in HEK293 cells ass... | - |
| Prostaglandin E2 receptor EP3 subtype | EC50 | = | 19544.0 | nM | 4.71 | Agonist activity at recombinant human EP3A receptor expressed in HEK293-EBNA cel... | - |
| Prostaglandin E2 receptor EP3 subtype | EC50 | = | 19544.0 | nM | 4.71 | Agonist activity at human recombinant EP3A receptor expressed in HEK293 cells as... | - |
Data from ChEMBL 36 via Core Engine