CHEMBL310310
SMILES | CN1C2CCC1CC(OC(c1ccccc1)c1ccc(Cl)cc1)C2 |
InChIKey | OCAXFDULERPAJM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 341.2 |
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 |
M2 | ACM2 | Rat | Acetylcholine (muscarinic) | A | pKi | 7.06 | 7.25 | 7.44 | ChEMBL |
M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | pKi | 8.1 | 8.44 | 8.83 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.0 | 6.0 | 6.0 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.27 | 5.27 | 5.27 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.76 | 5.76 | 5.76 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 6.5 | 6.5 | 6.5 | ChEMBL |