CHEMBL1940420
SMILES | Fc1ccc(OCCCN2CCN(c3ccccn3)CC2)cc1 |
InChIKey | BPDDCCYSOYRMEC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 315.2 |
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 |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.44 | 8.44 | 8.44 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 7.75 | 7.75 | 7.75 | ChEMBL |
5-HT7 | 5HT7R | Human | 5-Hydroxytryptamine | A | pKi | 6.68 | 6.68 | 6.68 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 6.71 | 6.71 | 6.71 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 6.75 | 6.75 | 6.75 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.73 | 6.73 | 6.73 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.64 | 6.64 | 6.64 | ChEMBL |
D5 | DRD5 | Human | Dopamine | A | pKi | 5.62 | 5.62 | 5.62 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 6.58 | 6.58 | 6.58 | ChEMBL |
5-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pKi | 5.08 | 5.08 | 5.08 | ChEMBL |
D4 | DRD4 | Rat | Dopamine | A | pKi | 8.74 | 8.74 | 8.74 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |