sonepiprazole
SMILES | NS(=O)(=O)c1ccc(cc1)N1CCN(CC1)CC[C@@H]1OCCc2c1cccc2 |
InChIKey | WNUQCGWXPNGORO-NRFANRHFSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 401.2 |
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 |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.9 | 8.9 | 8.9 | Guide to Pharmacology |
D4 | DRD4 | Rat | Dopamine | A | pKi | 8.7 | 8.7 | 8.7 | Guide to Pharmacology |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.17 | 8.3 | 8.44 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.29 | 5.29 | 5.29 | ChEMBL |
D4 | DRD4 | Rat | Dopamine | A | pKi | 8.14 | 8.14 | 8.14 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |