CHEMBL4874069
SMILES | O=C(CCCN1CCN(c2ccccn2)CC1)c1ccc2c(c1)CCC2 |
InChIKey | OJFGNESHNMETMU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 349.2 |
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-HT7 | 5HT7R | Human | 5-Hydroxytryptamine | A | pKi | 7.11 | 7.12 | 7.12 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.85 | 7.86 | 7.86 | ChEMBL |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pKi | 6.95 | 6.96 | 6.96 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.42 | 6.42 | 6.43 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 6.46 | 6.46 | 6.46 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.28 | 8.28 | 8.28 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.16 | 6.16 | 6.16 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |