CHEMBL1256171
SMILES | O=C(NCCCCN1CCN(c2cc3ccc2CCc2ccc(cc2)CC3)CC1)c1cc2ccc1CCc1ccc(cc1)CC2 |
InChIKey | MAMYYNBMHYGSHM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 597.4 |
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 |
D1 | DRD1 | Pig | Dopamine | A | pKi | 5.11 | 5.11 | 5.11 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.77 | 6.77 | 6.77 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.4 | 8.4 | 8.4 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.32 | 7.41 | 7.5 | ChEMBL |
5-HT2A | 5HT2A | Pig | 5-Hydroxytryptamine | A | pKi | 5.09 | 5.09 | 5.09 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |