CHEMBL5838725 [424053]
CHEMBL5838725
| SMILES | C[C@H](Nc1nc(C(=O)NCCNS(C)(=O)=O)c2sccc2n1)c1cncc(F)c1 |
| InChIKey | XPLBRIJPTHLFOA-JTQLQIEISA-N |
Chemical Properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 8 |
| Log P | 1.678 |
| Molecular weight (Da) | 438.1 |
| 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 |
CHEMBL5838725
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