CHEMBL194099
SMILES | CCCN(CCC)C1CCn2ncc(Cl)c2C1 |
InChIKey | SHBKBFYVWDZZMP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 5 |
Molecular weight (Da) | 255.2 |
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 |
D2 | DRD2 | Human | Dopamine | A | pKi | 4.92 | 6.17 | 6.92 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.64 | 7.43 | 8.21 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 5.19 | 5.95 | 6.7 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D3 | DRD3 | Human | Dopamine | A | pEC50 | 8.35 | 8.35 | 8.35 | ChEMBL |