CHEMBL4283589
SMILES | C=C1C[C@H]2c3c(cc(CCCCC)cc3OS(=O)(=O)c3ccc(C)cc3)OC(C)(C)[C@@H]2CC1OO |
InChIKey | SSTGRNSQXXIYRX-YOQGVNIDSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 500.2 |
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 |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 5.99 | 5.99 | 5.99 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Human | Cannabinoid | A | pIC50 | 5.69 | 5.69 | 5.69 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pIC50 | 5.24 | 5.24 | 5.24 | ChEMBL |