CHEMBL4794239 [366426]
CHEMBL4794239
| SMILES | C[C@H]1CN(c2ccc(C#N)cn2)C[C@H](C)N1C(=O)CCS(=O)(=O)c1cccc2ncsc12 |
| InChIKey | ATBVLZXTMDSNSB-HOTGVXAUSA-N |
Chemical Properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 5 |
| Log P | 2.853 |
| Molecular weight (Da) | 469.1 |
| 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 |
CHEMBL4794239
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