CHEMBL5759481 [406819]
CHEMBL5759481
| SMILES | COc1ccnc(N2C[C@@H](O)C[C@@H](S(=O)(=O)Nc3nnc(-c4ccc(C)o4)n3-c3c(OC)cccc3OC)C2)n1 |
| InChIKey | UWLVDTOBNOYNEI-DLBZAZTESA-N |
Chemical Properties
| Hydrogen bond acceptors | 13 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 9 |
| Log P | 2.033 |
| Molecular weight (Da) | 571.2 |
| 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 |
CHEMBL5759481
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