BRL 44408
SMILES | CC1N(CC2=NCCN2)Cc2c1cccc2 |
InChIKey | SGOFAUSEYBZKDQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 215.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Ligand site mutations | α2A |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 7.2 | 8.0 | 8.8 | Guide to Pharmacology |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 5.4 | 5.8 | 6.2 | Guide to Pharmacology |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 6.2 | 6.5 | 6.8 | Guide to Pharmacology |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 6.19 | 6.19 | 6.19 | PDSP Ki database |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 8.25 | 8.25 | 8.25 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |