CHEMBL1945300
SMILES | OCc1cc([C@@H](O)CNCCc2ccc(CNCCc3ccccc3)cc2)ccc1O |
InChIKey | MAHVPNQMFKXCMV-SANMLTNESA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 5 |
Rotatable bonds | 12 |
Molecular weight (Da) | 420.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α1D | ADA1D | Human | Adrenoceptors | A | pIC50 | 6.3 | 6.3 | 6.3 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 7.5 | 7.5 | 7.5 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pIC50 | 6.2 | 6.2 | 6.2 | ChEMBL |