CHEMBL344432
SMILES | COc1cccc2c1CCCC2CCCNCCOc1ccccn1 |
InChIKey | HETKYUVAGHVYTA-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 340.2 |
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 |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 7.58 | 7.58 | 7.58 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 7.9 | 7.9 | 7.9 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 9.26 | 9.26 | 9.26 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 9.27 | 9.27 | 9.27 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 9.64 | 9.64 | 9.64 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |