CHEMBL2221147
SMILES | COc1cccc(OC)c1OCCNC[C@H]1COc2cccc(OC)c2O1 |
InChIKey | UIFMGKZUSHZGFQ-AWEZNQCLSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 375.2 |
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 |
α1D | ADA1D | Rat | Adrenoceptors | A | pKd | 7.93 | 7.93 | 7.93 | ChEMBL |
α1B | ADA1B | Rat | Adrenoceptors | A | pKd | 9.58 | 9.58 | 9.58 | ChEMBL |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 8.56 | 8.56 | 8.56 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKd | 8.55 | 8.66 | 8.77 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 9.43 | 9.43 | 9.43 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 9.04 | 9.04 | 9.04 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 9.07 | 9.07 | 9.07 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |