CHEMBL3590081
SMILES | CCCN(CCCCNC(=O)/N=N/c1ccc(F)cc1)C1Cc2ccccc2C1 |
InChIKey | VLVNADWTXMPIOQ-CYYJNZCTSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 396.2 |
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 |
D5 | DRD5 | Human | Dopamine | A | pKi | 5.16 | 5.16 | 5.16 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.47 | 7.47 | 7.47 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 5.48 | 5.48 | 5.48 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 9.07 | 9.07 | 9.07 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 6.26 | 6.26 | 6.26 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.44 | 7.54 | 7.64 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D3 | DRD3 | Human | Dopamine | A | pEC50 | 7.17 | 7.88 | 8.59 | ChEMBL |