CHEMBL1257688
SMILES | O=C(CCCN1CCC(O)(c2cc3ccc2CCc2ccc(cc2)CC3)CC1)c1ccc(F)cc1 |
InChIKey | ZXZSMMMPXXEGFH-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 471.3 |
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-HT2A | 5HT2A | Pig | 5-Hydroxytryptamine | A | pKi | 7.72 | 7.72 | 7.72 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 9.14 | 9.14 | 9.14 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.32 | 8.38 | 8.44 | ChEMBL |
D1 | DRD1 | Pig | Dopamine | A | pKi | 7.0 | 7.0 | 7.0 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |