CHEMBL5400373 [387658]
CHEMBL5400373
| SMILES | Cc1nn(C)c(C)c1CC(=O)Nc1ccc(CS(=O)(=O)NC(=O)CCCCCCN2C(=O)CC[C@@H]2/C=C/[C@@H](O)Cc2ccccc2)cc1 |
| InChIKey | NADURLAGYWXNIO-HCCHTLIVSA-N |
Chemical Properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 17 |
| Log P | 4.265 |
| Molecular weight (Da) | 677.3 |
| 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 |
CHEMBL5400373
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