CHEMBL5884161 [428141]
CHEMBL5884161
| SMILES | CC(=O)N[C@@H](C)[C@H]1CC[C@@H](c2cccc(F)c2)N1C(=O)[C@@H](C)NC(=O)c1ccc(Cc2cc(C)n[nH]c2=O)c(C)c1 |
| InChIKey | CRHOZPLYKXRXMY-MLHUHORWSA-N |
Chemical Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 8 |
| Log P | 3.492 |
| Molecular weight (Da) | 561.3 |
| 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 |
CHEMBL5884161
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