CHEMBL1771107
SMILES | COc1ccccc1N1CCN(CCCCN2CCc3cc(-c4ccccc4)ccc3C2=O)CC1 |
InChIKey | UTEITPSYNTYGQL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 8 |
Molecular weight (Da) | 469.3 |
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 | 6.48 | 6.48 | 6.48 | ChEMBL |
D1 | DRD1 | Pig | Dopamine | A | pKi | 6.19 | 6.19 | 6.19 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.47 | 8.47 | 8.47 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 9.6 | 9.6 | 9.6 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.42 | 7.62 | 7.82 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D3 | DRD3 | Human | Dopamine | A | pEC50 | 8.48 | 8.48 | 8.48 | ChEMBL |