CHEMBL1183479
SMILES | CCCN(CCCCN1CC2CCCC2C1=O)C1COc2cccc(OC)c2C1 |
InChIKey | ZSCQNYLCSNCYIW-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 9 |
Molecular weight (Da) | 400.3 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT2A | 5HT2A | Bovine | 5-Hydroxytryptamine | A | pIC50 | 5.7 | 5.7 | 5.7 | ChEMBL |
α2A | ADA2A | Bovine | Adrenoceptors | A | pIC50 | 5.4 | 5.4 | 5.4 | ChEMBL |
α1A | ADA1A | Bovine | Adrenoceptors | A | pIC50 | 5.3 | 5.3 | 5.3 | ChEMBL |
D1 | DRD1 | Bovine | Dopamine | A | pIC50 | 4.22 | 4.22 | 4.22 | ChEMBL |
D2 | DRD2 | Bovine | Dopamine | A | pIC50 | 8.52 | 8.52 | 8.52 | ChEMBL |
5-HT1B | 5HT1B | Rat | 5-Hydroxytryptamine | A | pIC50 | 4.52 | 4.52 | 4.52 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pIC50 | 9.0 | 9.0 | 9.0 | ChEMBL |