CHEMBL3819734
SMILES | OC1(c2ccc(Cl)cc2)CCN(CCCc2nc3ccccc3s2)CC1 |
InChIKey | MAQDCPYEDSDANP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 386.1 |
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 |
5-HT7 | 5HT7R | Human | 5-Hydroxytryptamine | A | pKi | 6.72 | 6.72 | 6.72 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.79 | 6.79 | 6.79 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.55 | 7.55 | 7.55 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 6.78 | 6.78 | 6.78 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 7.47 | 7.47 | 7.47 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.12 | 6.12 | 6.12 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |