Compound Detail
CHEMBL5174453
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COc1ccc(S(=O)(=O)Nc2ccc(CN3CCN(C(=O)C4CN(C(C)=O)C4)CC3)cc2)cc1
Basic Information
| ChEMBL ID | CHEMBL5174453 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LIHOWQBGFZAYJZ-UHFFFAOYSA-N |
0
Targets
0
Activities
0
Assay Types
1
PK Parameters
3
Publications
0
Known Names
Molecular Properties
486.6
MW (Da)
1.62
ALogP
6
HBA
1
HBD
99.3
PSA (Ų)
0.64
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 1.0 | mL.min-1.g-1 | Mus musculus |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35594652 | 10.1016/j.ejmech.2022.114421 | Trypanosoma cruzi | 1 |
| 35594652 | 10.1016/j.ejmech.2022.114421 | ADMET | 1 |
| 35594652 | 10.1016/j.ejmech.2022.114421 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine