CHEMBL3590077
SMILES | COc1ccccc1N1CCN(CCCCNC(=O)/N=N/c2ccc(F)cc2)CC1 |
InChIKey | HLWTUGVLYCATKY-OCEACIFDSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 413.2 |
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 | 5.55 | 5.55 | 5.55 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.03 | 7.03 | 7.03 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 5.89 | 5.89 | 5.89 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.51 | 8.52 | 8.52 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 6.27 | 6.27 | 6.27 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.42 | 7.45 | 7.47 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |