CHEMBL192133 [140947]
CHEMBL192133
| SMILES | C=C(C)CN1CCC23c4c5ccc(O)c4O[C@H]2C(=O)C2(CCc4ccccc42)C[C@@]3(O)C1C5 |
| InChIKey | RXTSRSHIFAZARU-LMUDTLNASA-N |
Chemical Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 2 |
| Log P | 3.186 |
| Molecular weight (Da) | 443.2 |
| Stereochemistry info | partial |
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 |
CHEMBL192133
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