CHEMBL176169
SMILES | Cc1ccc2n1C=C(N1CCN(C)CC1)c1ccccc1S2 |
InChIKey | RLPMXJWKLTTXDD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 1 |
Molecular weight (Da) | 311.1 |
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 | 7.75 | 7.75 | 7.75 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pKi | 7.15 | 7.15 | 7.15 | ChEMBL |
M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | pKi | 5.64 | 5.64 | 5.64 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 6.9 | 6.9 | 6.9 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |