CHEMBL5831253 [413571]
CHEMBL5831253
| SMILES | CC#C[C@@H](CC(=O)O)c1ccc(OCc2ccc(CN3CC=C(c4ccc(F)cc4)CC3)cc2)cc1 |
| InChIKey | OXDYFKHFCBXUAI-NDEPHWFRSA-N |
Chemical Properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 9 |
| Log P | 6.276 |
| Molecular weight (Da) | 483.2 |
| 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 |
CHEMBL5831253
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