CHEMBL70319
SMILES | CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccc(OS(=O)(=O)C(F)(F)F)cc32)CC1 |
InChIKey | MTKHCEFATKQYMK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 474.1 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pIC50 | 7.89 | 7.89 | 7.89 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pIC50 | 6.7 | 6.7 | 6.7 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pIC50 | 6.31 | 6.31 | 6.31 | ChEMBL |
M1 | ACM1 | Human | Acetylcholine (muscarinic) | A | pIC50 | 7.27 | 7.27 | 7.27 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pIC50 | 7.28 | 7.28 | 7.28 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pIC50 | 7.52 | 7.52 | 7.52 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pIC50 | 7.37 | 7.37 | 7.37 | ChEMBL |