Compound Detail
CHEMBL352315
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Basic Information
| ChEMBL ID | CHEMBL352315 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PTYYWSKZYOSFEK-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
288.4
MW (Da)
3.56
ALogP
3
HBA
1
HBD
37.5
PSA (Ų)
0.91
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.65
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serotonin (5-HT) receptor CHEMBL2096904 | IC50 | 5.65 | 5.65 | 2240.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.54 | 5.54 | 2880.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serotonin (5-HT) receptor | IC50 | = | 2240.0 | nM | 5.65 | Ability to displace [3H]5-HT binding to 5-hydroxytryptamine receptor site using ... | 7120280 |
| Unchecked | IC50 | = | 2880.0 | nM | 5.54 | Ability to displace [3H]LSD binding to Lysergic acid diethylamide receptor site ... | 7120280 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7120280 | 10.1021/jm00350a005 | Rattus norvegicus | 6 |
| 7120280 | 10.1021/jm00350a005 | Unchecked | 2 |
| 7120280 | 10.1021/jm00350a005 | Serotonin (5-HT) receptor | 1 |
Data from ChEMBL 36 via Core Engine