CHEMBL3819713
SMILES | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCCc1nc2ccccc2s1 |
InChIKey | SJEXSMOVRPPLBZ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 426.2 |
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 |
5-HT7 | 5HT7R | Human | 5-Hydroxytryptamine | A | pKi | 6.0 | 6.0 | 6.0 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 6.73 | 6.73 | 6.73 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.36 | 6.37 | 6.37 | ChEMBL |
5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pKi | 6.47 | 6.47 | 6.47 | ChEMBL |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pKi | 5.33 | 5.33 | 5.34 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.89 | 7.89 | 7.89 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 6.56 | 6.58 | 6.6 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.35 | 7.36 | 7.36 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |