Compound Detail
CHEMBL4873240
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Basic Information
| ChEMBL ID | CHEMBL4873240 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MLVKGVQLIZOEIN-UHFFFAOYSA-N |
| Parent Compound | CHEMBL5028766 |
| Active Moiety | CHEMBL5028766 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
220.3
MW (Da)
2.80
ALogP
1
HBA
1
HBD
19.0
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.69
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A CHEMBL224 | EC50 | 7.69 | 7.69 | 20.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A | EC50 | = | 20.6 | nM | 7.69 | Agonist activity at 5HT2A receptor (unknown origin) expressed in HEK293 cells by... | 34917241 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34917241 | 10.1021/acsmedchemlett.1c00577 | 5-hydroxytryptamine receptor 2A | 2 |
| 34917241 | 10.1021/acsmedchemlett.1c00577 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine