CHEMBL5499028 [389710]
CHEMBL5499028
| SMILES | CC1(C)[C@@H]2CC[C@@](C)(C2)[C@@H]1OP(=O)(O)OC1=Cc2ccccc2Sc2c(OC(F)(F)F)cccc21 |
| InChIKey | LJJNQTWCYQWDOL-OAEOJWKDSA-N |
Chemical Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 5 |
| Log P | 7.896 |
| Molecular weight (Da) | 526.1 |
| Stereochemistry info | partial |
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 |
CHEMBL5499028
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