CHEMBL225622
SMILES | O=C(NC1CCCCC1)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCCc1cc(Cl)ccc1-2 |
InChIKey | ADAVAHIZKNKQSU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 487.1 |
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 |
CB2 | CNR2 | Mouse | Cannabinoid | A | pKi | 9.19 | 9.19 | 9.19 | ChEMBL |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 7.75 | 7.75 | 7.75 | ChEMBL |
CB1 | CNR1 | Mouse | Cannabinoid | A | pKi | 7.99 | 8.75 | 9.52 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |