CHEMBL5799585 [410708]
CHEMBL5799585
| SMILES | CC[C@@H](NC(=O)c1ccc(Cc2cc(C)n[nH]c2=O)c(C)c1)C(=O)N1[C@H](c2cccc(F)c2)CC[C@@H]1C(C)(C)O |
| InChIKey | YMQDVZRPUNKADE-KWXIBIRDSA-N |
Chemical Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 8 |
| Log P | 4.128 |
| Molecular weight (Da) | 548.3 |
| 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 |
CHEMBL5799585
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