CHEMBL464395
SMILES | COc1ccccc1N1CCN(CCCCOc2ccc(C3CN4C=CSC4=N3)cc2)CC1 |
InChIKey | PTUNPPZTSHFJHC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 0 |
Rotatable bonds | 9 |
Molecular weight (Da) | 464.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 | 9.92 | 9.92 | 9.92 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 9.92 | 9.92 | 9.92 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |