CHEMBL4845947
SMILES | O=C1CCc2cc(C(=O)CCCN3CCN(c4ccccn4)CC3)ccc2N1 |
InChIKey | NFCAJYXEMNIWPF-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 378.2 |
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 | 8.32 | 8.32 | 8.32 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.33 | 6.36 | 6.39 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.4 | 6.41 | 6.42 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 5.5 | 5.5 | 5.51 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 7.3 | 7.31 | 7.33 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |