CHEMBL4748915
SMILES | CN1CC=C(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1 |
InChIKey | CITBEZAJPJRZNL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 1 |
Molecular weight (Da) | 323.1 |
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 |
D1 | DRD1 | Human | Dopamine | A | pKi | 6.42 | 6.42 | 6.42 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.86 | 5.86 | 5.86 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
M3 | ACM3 | Human | Acetylcholine (muscarinic) | A | pEC50 | 6.19 | 6.19 | 6.19 | ChEMBL |
M1 | ACM1 | Human | Acetylcholine (muscarinic) | A | pEC50 | 6.46 | 6.46 | 6.46 | ChEMBL |