CHEMBL2207639
SMILES | COc1ccccc1N1CCN(Cc2cc(CN3CCOCC3)c3cccccc2-3)CC1 |
InChIKey | RMDQSWIVOHIFNT-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 431.3 |
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 |
5-HT2A | 5HT2A | Pig | 5-Hydroxytryptamine | A | pKi | 6.0 | 6.0 | 6.0 | ChEMBL |
D1 | DRD1 | Pig | Dopamine | A | pKi | 5.3 | 5.3 | 5.3 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pKi | 5.21 | 5.21 | 5.21 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 5.19 | 5.19 | 5.19 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.34 | 8.34 | 8.34 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.46 | 6.46 | 6.46 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.89 | 6.96 | 7.04 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |