CHEMBL331036
SMILES | c1cn2ccnc2c(N2CCNCC2)n1 |
InChIKey | NSHLOJVJEGEMSF-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 1 |
Molecular weight (Da) | 203.1 |
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 |
α2A | ADA2A | Bovine | Adrenoceptors | A | pKi | 7.82 | 7.82 | 7.82 | ChEMBL |
β2 | ADRB2 | Guinea pig | Adrenoceptors | A | pKi | 5.77 | 5.77 | 5.77 | ChEMBL |
β1 | B0FL73 | Guinea pig | Adrenoceptors | A | pKi | 6.4 | 6.4 | 6.4 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |