CHEMBL6048269 [463307]
CHEMBL6048269
| SMILES | Cn1ccc(-c2cc(CN3C=C(C(=O)N[C@H]4CCCC[C@@H]4O)Oc4ccccc43)ccn2)n1 |
| InChIKey | QSDLERCCPRYMDI-UGKGYDQZSA-N |
Chemical Properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 5 |
| Log P | 3.142 |
| Molecular weight (Da) | 445.2 |
| 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 |
CHEMBL6048269
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