DESGLYMIDODRINE
| SMILES | COc1ccc(OC)c(C(O)CN)c1 |
| InChIKey | VFRCNXKYZVQYLX-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 197.1 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| α2B | ADA2B | Rat | Adrenoceptors | A | pKi | 5.73 | 5.73 | 5.73 | ChEMBL |
| α1B | ADA1B | Golden hamster | Adrenoceptors | A | pKi | 5.16 | 5.16 | 5.16 | ChEMBL |
| α1D | ADA1D | Rat | Adrenoceptors | A | pKi | 5.77 | 5.78 | 5.78 | ChEMBL |
| α1A | ADA1A | Rat | Adrenoceptors | A | pKi | 5.7 | 5.7 | 5.7 | ChEMBL |
| α2A | ADA2A | Human | Adrenoceptors | A | pKi | 5.84 | 5.84 | 5.84 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| α1A | ADA1A | Rabbit | Adrenoceptors | A | pEC50 | 5.15 | 5.15 | 5.15 | ChEMBL |
| α1D | ADA1D | Rat | Adrenoceptors | A | pEC50 | 5.72 | 5.72 | 5.73 | ChEMBL |
| α1B | ADA1B | Rat | Adrenoceptors | A | pEC50 | 4.07 | 4.07 | 4.07 | ChEMBL |
| α1A | ADA1A | Human | Adrenoceptors | A | pEC50 | 5.15 | 5.15 | 5.15 | ChEMBL |