CHEMBL1159723
SMILES | CCCc1ccccc1OCC(O)CNC(C)C |
InChIKey | JVHCMYZFGCOCTD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 251.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Ligand site mutations | β2 |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β2 | ADRB2 | Bovine | Adrenoceptors | A | pKd | 9.2 | 9.2 | 9.2 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 8.59 | 8.59 | 8.59 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |