CHEMBL367045
SMILES | CN1CCN(C2=Cn3cccc3Sc3ccccc32)CC1 |
InChIKey | JFLBTRDHDHTNGX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 1 |
Molecular weight (Da) | 297.1 |
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 |
H1 | HRH1 | Rat | Histamine | A | pKi | 8.57 | 8.57 | 8.57 | ChEMBL |
D3 | DRD3 | Rat | Dopamine | A | pKi | 8.08 | 8.08 | 8.08 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pKi | 7.71 | 7.71 | 7.71 | ChEMBL |
M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | pKi | 5.68 | 5.68 | 5.68 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 7.76 | 7.76 | 7.77 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.08 | 8.08 | 8.08 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 8.96 | 8.96 | 8.96 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.89 | 7.89 | 7.89 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |