CHEMBL386016
SMILES | Cn1c(=O)[nH]c2cccc(OC[C@@H](O)CNC(C)(C)Cc3ccc(Oc4ccc(C(N)=O)cn4)cc3)c21 |
InChIKey | BWFZVCAHTKYRFD-IBGZPJMESA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 4 |
Rotatable bonds | 11 |
Molecular weight (Da) | 505.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β3 | ADRB3 | Rat | Adrenoceptors | A | pEC50 | 7.61 | 7.61 | 7.61 | ChEMBL |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 8.15 | 8.15 | 8.15 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 8.06 | 8.06 | 8.06 | ChEMBL |