Compound Detail
CHEMBL1672374
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Basic Information
| ChEMBL ID | CHEMBL1672374 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QCMUGORVKCWDCX-UHFFFAOYSA-N |
4
Targets
12
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
377.6
MW (Da)
4.75
ALogP
2
HBA
1
HBD
35.1
PSA (Ų)
0.41
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 12 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium-dependent serotonin transporter CHEMBL313 | Ki | 7.0 | 6.25 | 100.0 | 4 |
| Sodium-dependent dopamine transporter CHEMBL338 | Ki | 6.71 | 6.71 | 194.0 | 4 |
| Unchecked CHEMBL612545 | Ki | 5.63 | 5.63 | 2350.0 | 1 |
| Transporter CHEMBL6184 | Ki | 5.63 | 5.63 | 2350.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21344069 | 10.1021/ml1002025 | Sodium-dependent dopamine transporter | 1 |
| 21344069 | 10.1021/ml1002025 | Sodium-dependent serotonin transporter | 1 |
| 21344069 | 10.1021/ml1002025 | Transporter | 1 |
Data from ChEMBL 36 via Core Engine