CHEMBL5766675 [407566]
CHEMBL5766675
| SMILES | Cc1nn(CC(C)(C)O)cc1N1CCC[C@@H](c2nc3c4cc(F)c(OC(F)F)cc4nc(N)n3n2)C1 |
| InChIKey | XHWKTSMPBBPDLG-CYBMUJFWSA-N |
Chemical Properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 6 |
| Log P | 3.260 |
| Molecular weight (Da) | 504.2 |
| 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 |
CHEMBL5766675
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