CHEMBL4300633
SMILES | Fc1ccc(N2CCN(CCc3ccc(COc4ccc5c(c4)CCCC5)cc3)CC2)cc1 |
InChIKey | KUEPYDNPYGESKY-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 7 |
Molecular weight (Da) | 444.3 |
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 |
α1B | ADA1B | Human | Adrenoceptors | A | pIC50 | 5.95 | 5.95 | 5.95 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pIC50 | 6.99 | 6.99 | 6.99 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pIC50 | 5.97 | 5.97 | 5.97 | ChEMBL |