NDD-825 [5622]
NDD-825
| SMILES | O=C1NCc2cc(OCCNC[C@H](O)COc3ccc4c(c3)OC[C@@H](COCC3CC3)O4)ccc21 |
| InChIKey | CMOIARKZHIAPIY-SIKLNZKXSA-N |
Chemical Properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 13 |
| Log P | 1.905 |
| Molecular weight (Da) | 484.2 |
| 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 |
NDD-825
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