bupranolol
SMILES | OC(COc1cc(C)ccc1Cl)CNC(C)(C)C |
InChIKey | HQIRNZOQPUAHHV-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 5 |
Molecular weight (Da) | 271.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Sankey plot
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β1 | ADRB1 | Human | Adrenoceptors | A | pKi | 7.3 | 8.15 | 9.0 | Guide to Pharmacology |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 8.3 | 9.1 | 9.9 | Guide to Pharmacology |
β3 | ADRB3 | Human | Adrenoceptors | A | pKi | 6.8 | 7.05 | 7.3 | Guide to Pharmacology |
β1 | ADRB1 | Human | Adrenoceptors | A | pKi | 8.05 | 8.05 | 8.05 | Drug Central |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 8.04 | 8.04 | 8.04 | Drug Central |
β3 | ADRB3 | Human | Adrenoceptors | A | pKi | 8.14 | 8.14 | 8.14 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β1 | ADRB1 | Rat | Adrenoceptors | A | pA2 | 9.0 | 9.0 | 9.0 | Guide to Pharmacology |