CHEMBL4597533
SMILES | Cn1c(SCCCNCC2CC2c2cc(F)ccc2OCCF)nnc1-c1ccccc1 |
InChIKey | ABVUWVBSAIPHQT-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 12 |
Molecular weight (Da) | 458.2 |
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 |
D5 | DRD5 | Human | Dopamine | A | pKi | 5.97 | 5.97 | 5.97 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.02 | 6.02 | 6.02 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 6.43 | 6.43 | 6.43 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.28 | 6.28 | 6.28 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.82 | 5.82 | 5.82 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |