CHEMBL90746
SMILES | CN(C)C(=O)c1cccnc1NCCCN1CCN(c2ccccc2-c2ccccc2)CC1 |
InChIKey | GUKVULLJWDLSGZ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 443.3 |
Drug properties
Molecular type | Small molecule |
Physiological/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 | 7.1 | 7.1 | 7.1 | ChEMBL |
α1A | ADA1A | Rabbit | Adrenoceptors | A | pKd | 8.9 | 8.9 | 8.9 | ChEMBL |
α1D | ADA1D | Rat | Adrenoceptors | A | pKd | 7.2 | 7.2 | 7.2 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.9 | 6.9 | 6.9 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |