salmeterol
SMILES | OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O |
InChIKey | GIIZNNXWQWCKIB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 4 |
Rotatable bonds | 16 |
Molecular weight (Da) | 415.3 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | Yes |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
B1 | BKRB1 | Human | Bradykinin | A | pKi | 7.9 | 7.9 | 7.9 | Guide to Pharmacology |
B2 | BKRB2 | Human | Bradykinin | A | pKi | 8.6 | 9.1 | 9.6 | Guide to Pharmacology |
B1 | BKRB1 | Mouse | Bradykinin | A | pKi | 6.6 | 6.6 | 6.6 | Guide to Pharmacology |
B2 | BKRB2 | Mouse | Bradykinin | A | pKi | 8.5 | 9.0 | 9.5 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
B1 | BKRB1 | Human | Bradykinin | A | pA2 | 7.7 | 7.7 | 7.7 | Guide to Pharmacology |
B2 | BKRB2 | Human | Bradykinin | A | pA2 | 8.4 | 8.4 | 8.4 | Guide to Pharmacology |
B1 | BKRB1 | Mouse | Bradykinin | A | pA2 | 6.1 | 6.1 | 6.1 | Guide to Pharmacology |