CHEMBL1741041 [123016]
CHEMBL1741041
| SMILES | CC1(C)O[C@@H]2[C@H](O1)[C@@H](COS(=O)(=O)O)O[C@H]2n1cnc2c(N)ncnc21 |
| InChIKey | GORHSWUHKVDGJQ-WOUKDFQISA-N |
Chemical Properties
| Hydrogen bond acceptors | 11 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 4 |
| Log P | -0.355 |
| Molecular weight (Da) | 387.1 |
| 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 |
CHEMBL1741041
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