CHEMBL2429890
SMILES | c1cc2c(cc1CN[C@H]1C3C4CC5C6C4CC3C6C51)OCO2 |
InChIKey | VGYQUDBPYFLBLJ-PTCVETCVSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 295.2 |
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 |
5-HT5A | 5HT5A | Human | 5-Hydroxytryptamine | A | pKi | 5.22 | 5.22 | 5.22 | ChEMBL |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 5.49 | 5.49 | 5.49 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 5.51 | 5.51 | 5.51 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pKi | 5.94 | 5.94 | 5.94 | ChEMBL |
M4 | ACM4 | Human | Acetylcholine (muscarinic) | A | pKi | 5.18 | 5.18 | 5.18 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 5.38 | 5.38 | 5.38 | ChEMBL |
M2 | ACM2 | Human | Acetylcholine (muscarinic) | A | pKi | 5.36 | 5.36 | 5.36 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.57 | 5.57 | 5.57 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |