CHEMBL118919
SMILES | OCCN1CCN(C2Cn3cccc3Sc3ccc(F)cc32)CC1 |
InChIKey | YHNPEPCGBKSLOS-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 347.1 |
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 | Rat | Dopamine | A | pKi | 7.88 | 7.88 | 7.89 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pKi | 7.14 | 7.14 | 7.14 | ChEMBL |
M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | pKi | 5.2 | 5.2 | 5.2 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 7.66 | 7.66 | 7.66 | ChEMBL |
H1 | HRH1 | Rat | Histamine | A | pKi | 8.15 | 8.15 | 8.15 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |