CHEMBL2163938
SMILES | CCCC1COc2cccc3c(=O)c(C(=O)NC45CC6CC(C)(CC(C)(C6)C4)C5)cn1c23 |
InChIKey | BKTJKWJUVAXLAS-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 434.3 |
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 | Rat | Cannabinoid | A | pKi | 7.97 | 7.97 | 7.97 | ChEMBL |
CB1 | CNR1 | Rat | Cannabinoid | A | pKi | 6.32 | 6.32 | 6.32 | ChEMBL |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 8.44 | 8.44 | 8.44 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 6.7 | 6.7 | 6.7 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Human | Cannabinoid | A | pIC50 | 7.7 | 7.7 | 7.7 | ChEMBL |