CHEMBL1097515 [23201]
CHEMBL1097515
| SMILES | O=C(N[C@@H](CCN1C[C@@H]2CN(C(=O)c3c(Cl)cccc3Cl)C[C@@H]2C1)c1ccccc1)C1CCCC1 |
| InChIKey | RYPQMOYFQGEWGP-FBLLAGFSSA-N |
Chemical Properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 7 |
| Log P | 5.435 |
| Molecular weight (Da) | 513.2 |
| 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 |
CHEMBL1097515
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