CHEMBL3084670 [213133]
CHEMBL3084670
| SMILES | CN1[C@@H]2CC[C@H]1C[C@@H](CC(CNS(C)(=O)=O)(c1ccccc1)c1ccccc1)C2 |
| InChIKey | NDHVOPDKZALZCQ-QYEXWFEISA-N |
Chemical Properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 7 |
| Log P | 3.785 |
| Molecular weight (Da) | 412.2 |
| Stereochemistry info | full |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
CHEMBL3084670
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0