CHEMBL5959886 [445286]
CHEMBL5959886
| SMILES | COCCn1c(CN2CCN(c3cccc(OCc4ccc(Cl)cc4F)n3)C[C@@H]2CO)nc2ccc(C(=O)O)cc21 |
| InChIKey | HSQLTLCMDHWHLH-JOCHJYFZSA-N |
Chemical Properties
| Hydrogen bond acceptors | 9 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 11 |
| Log P | 3.830 |
| Molecular weight (Da) | 583.2 |
| 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 |
CHEMBL5959886
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