Compound Detail
CHEMBL2104047
CATHINONE 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL2104047 |
| Name | CATHINONE |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | PUAQLLVFLMYYJJ-ZETCQYMHSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
8
Known Names
Molecular Properties
149.2
MW (Da)
1.22
ALogP
2
HBA
1
HBD
43.1
PSA (Ų)
0.64
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Activity Summary
Kd 1 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serotonin (5-HT) receptor CHEMBL2094123 | Kd | 5.52 | 5.52 | 3019.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serotonin (5-HT) receptor | Kd | = | 3019.95 | nM | 5.52 | Affinity against 5-hydroxytryptamine receptors in rat fundus model | 7365744 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28244748 | 10.1021/acs.jmedchem.7b00085 | Rattus norvegicus | 4 |
| 7365744 | 10.1021/jm00177a017 | Serotonin (5-HT) receptor | 1 |
| - | 10.1007/s00044-012-9977-1 | Whole blood | 1 |
Data from ChEMBL 36 via Core Engine