Compound Detail
CHEMBL217501
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CN(C(=O)c1ccc(-c2ccccn2)cc1)[C@H]1CCc2cc(CN3CCS(=O)(=O)CC3)ccc2C1
Basic Information
| ChEMBL ID | CHEMBL217501 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VUTDWPBZQRKLRF-SANMLTNESA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
489.6
MW (Da)
3.61
ALogP
5
HBA
0
HBD
70.6
PSA (Ų)
0.55
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17107791 | 10.1016/j.bmcl.2006.10.053 | 5-hydroxytryptamine receptor 2C | 1 |
| 17107791 | 10.1016/j.bmcl.2006.10.053 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
| 17107791 | 10.1016/j.bmcl.2006.10.053 | Melanin-concentrating hormone receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine