CHEMBL5206530 [375361]
CHEMBL5206530
| SMILES | Nc1nc(-c2ccco2)c2cc(Br)ccc2n1 |
| InChIKey | XDIROSBRBKJBMH-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 1 |
| Log P | 3.234 |
| Molecular weight (Da) | 289.0 |
| Stereochemistry info | unspecified |
Database connections
| Structure pdb | 8DU3 |
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 |
CHEMBL5206530
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
Database connections
| Structure pdb | 8DU3 |