CHEMBL200839
SMILES | COc1cccc(OC)c1OCCNCCOc1ccccc1OCc1ccccc1Cl |
InChIKey | SNEXCDCPPGPIOK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 13 |
Molecular weight (Da) | 457.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 9.25 | 9.25 | 9.25 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 9.6 | 9.6 | 9.6 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 8.85 | 8.85 | 8.85 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.32 | 8.32 | 8.32 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |