CHEMBL71724
SMILES | COc1ccc(N2CCN(CCC3OCCc4ccccc43)CC2)cc1 |
InChIKey | IAUNACXRZSWWJT-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 352.2 |
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-HT1B | 5HT1B | Western lowland gorilla | 5-Hydroxytryptamine | A | pKi | 5.14 | 5.14 | 5.14 | ChEMBL |
D4 | DRD4 | Rat | Dopamine | A | pKi | 8.85 | 8.85 | 8.85 | ChEMBL |
D3 | DRD3 | Rat | Dopamine | A | pKi | 5.92 | 5.92 | 5.92 | ChEMBL |
5-HT1D | 5HT1D | Human | 5-Hydroxytryptamine | A | pKi | 8.17 | 8.17 | 8.17 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 5.96 | 5.96 | 5.96 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.62 | 8.62 | 8.62 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 5.96 | 5.96 | 5.96 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 7.12 | 7.12 | 7.12 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 6.05 | 6.05 | 6.05 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.84 | 5.84 | 5.84 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |