CHEMBL105383
SMILES | NCC1OCCc2cc(O)c(O)cc21 |
InChIKey | ICQJOAAZGCOTMT-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 3 |
Rotatable bonds | 1 |
Molecular weight (Da) | 195.1 |
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 |
β2 | ADRB2 | Bovine | Adrenoceptors | A | pKi | 4.54 | 4.54 | 4.54 | ChEMBL |
β1 | ADRB1 | Rat | Adrenoceptors | A | pKi | 5.46 | 5.46 | 5.46 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β1 | B0FL73 | Guinea pig | Adrenoceptors | A | pIC50 | 5.17 | 5.17 | 5.17 | ChEMBL |
β2 | ADRB2 | Guinea pig | Adrenoceptors | A | pIC50 | 4.52 | 4.52 | 4.52 | ChEMBL |