CHEMBL268258
SMILES | COc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2ccoc2c1 |
InChIKey | MHPMXTGKTXJIDI-IBGZPJMESA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 349.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β2 | ADRB2 | Dog | Adrenoceptors | A | pKi | 5.76 | 5.76 | 5.76 | ChEMBL |
β1 | ADRB1 | Rat | Adrenoceptors | A | pKi | 6.08 | 6.08 | 6.08 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pKi | 6.13 | 6.13 | 6.13 | ChEMBL |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 7.96 | 7.96 | 7.96 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 8.68 | 8.68 | 8.68 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.63 | 6.63 | 6.63 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 8.6 | 8.61 | 8.62 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.7 | 8.7 | 8.7 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |