CHEMBL4595382
SMILES | CCCN(CCCCNC(=O)c1cc2ccccc2[nH]1)CC1CC1c1cc(Cl)ccc1OC |
InChIKey | JMYIPFBYRVHYMD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 12 |
Molecular weight (Da) | 467.2 |
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 | 5.37 | 5.37 | 5.37 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.24 | 6.24 | 6.24 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 6.09 | 6.09 | 6.09 | ChEMBL |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pKi | 7.07 | 7.07 | 7.07 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.94 | 7.94 | 7.94 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.85 | 5.85 | 5.85 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |