CHEMBL6002796 [449262]
CHEMBL6002796
| SMILES | CC(C)c1cc(-c2ccccc2NS(C)(=O)=O)ccc1N1CC[C@@H](NC(=O)Nc2ccc(C(F)(F)F)cc2F)C1=O |
| InChIKey | KOSYQQMVVSJHPI-XMMPIXPASA-N |
Chemical Properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 7 |
| Log P | 5.933 |
| Molecular weight (Da) | 592.2 |
| Stereochemistry info | unspecified |
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 |
CHEMBL6002796
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