CHEMBL2112357 [160165]
CHEMBL2112357
| SMILES | Cc1cc2c(OC[C@@H](O)CN3CC[C@@H](c4cccc5ccsc45)C[C@@H]3C)cccc2[nH]1 |
| InChIKey | UUKAZYSPDRJOMA-TYPHKJRUSA-N |
Chemical Properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 6 |
| Log P | 5.699 |
| Molecular weight (Da) | 434.2 |
| 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 |
CHEMBL2112357
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