CHEMBL162232
SMILES | Cc1cc(C)n2c(=O)c(CCN3CCc4oc5ccccc5c4C3)c(C)nc2c1 |
InChIKey | GICQFAWDMCTLDM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 3 |
Molecular weight (Da) | 387.2 |
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 |
α2B | ADA2B | Human | Adrenoceptors | A | pIC50 | 8.58 | 8.58 | 8.58 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pIC50 | 9.07 | 9.07 | 9.07 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pIC50 | 6.62 | 6.62 | 6.62 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pIC50 | 9.47 | 9.47 | 9.47 | ChEMBL |