CHEMBL12416 [40514]
CHEMBL12416
| SMILES | Fc1ccc(C(CCCN2CCc3c([nH]c4ccccc34)C2)c2ccc(F)cc2)cc1 |
| InChIKey | LCERGTRVKSJRQA-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 1 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 6 |
| Log P | 6.416 |
| Molecular weight (Da) | 416.2 |
| Stereochemistry info | unspecified |
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 |
CHEMBL12416
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