CHEMBL159022
SMILES | COc1ccccc1C(=O)CCCCCN1CCN(c2noc3ccccc23)CC1 |
InChIKey | VRSNKCQWIMHWFX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 9 |
Molecular weight (Da) | 407.2 |
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 | Rat | 5-Hydroxytryptamine | A | pKi | 9.05 | 9.05 | 9.05 | ChEMBL |
D3 | DRD3 | Rat | Dopamine | A | pKi | 7.26 | 7.26 | 7.26 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.4 | 8.4 | 8.4 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 6.76 | 6.76 | 6.76 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.11 | 7.11 | 7.11 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |