CHEMBL4177497
| SMILES | C=C(C)CN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)C3)CC1 | 
| InChIKey | IWCOVZWJPVWEFW-UHFFFAOYSA-N | 
Chemical properties
| Hydrogen bond acceptors | 4 | 
| Hydrogen bond donors | 0 | 
| Rotatable bonds | 5 | 
| Molecular weight (Da) | 391.2 | 
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 | 
| β1 | ADRB1 | Human | Adrenoceptors | A | pKi | 5.72 | 5.72 | 5.72 | ChEMBL | 
| H1 | HRH1 | Human | Histamine | A | pKi | 6.53 | 6.53 | 6.53 | ChEMBL | 
| H3 | HRH3 | Human | Histamine | A | pKi | 5.99 | 5.99 | 5.99 | ChEMBL | 
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |