CHEMBL415014
SMILES | Cc1[nH]c(-c2ccccc2)nc1CN1CCN(c2ncccn2)CC1 |
InChIKey | WVAKMWHEKNXRHK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 334.2 |
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 |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.53 | 5.53 | 5.53 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.84 | 5.84 | 5.84 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.22 | 8.22 | 8.22 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |