CHEMBL380330
SMILES | COc1ccc2c(c1)CCN(C)CCc1ccccc1C2 |
InChIKey | ATCJEKKXEJVYOB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 0 |
Rotatable bonds | 1 |
Molecular weight (Da) | 281.2 |
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 | 7.27 | 7.53 | 8.14 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.36 | 7.36 | 7.36 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 7.54 | 7.58 | 7.64 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.12 | 7.12 | 7.12 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.89 | 8.16 | 9.26 | ChEMBL |
5-HT2A | 5HT2A | Pig | 5-Hydroxytryptamine | A | pKd | 8.69 | 8.69 | 8.69 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |