CHEMBL5787558 [409614]
CHEMBL5787558
| SMILES | COc1cc2nc(N)n3nc([C@@H]4CCCN(c5cnn(C6CCC[C@]6(C)O)c5)C4)nc3c2cc1F |
| InChIKey | AJQJTWPNJUIHBP-WJCHDXHUSA-N |
Chemical Properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 4 |
| Log P | 3.064 |
| Molecular weight (Da) | 480.2 |
| Stereochemistry info | partial |
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 |
CHEMBL5787558
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