CHEMBL5838538 [424036]
CHEMBL5838538
| SMILES | COCCOCCOC(=O)c1ccc(S(=O)(=O)NC(=O)c2ccc(N3C(=O)CSC3c3ccc(F)cc3)c(C)c2)cc1 |
| InChIKey | ZTTSWVQPLKBVQE-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 9 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 12 |
| Log P | 3.851 |
| Molecular weight (Da) | 616.1 |
| 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 |
CHEMBL5838538
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