CHEMBL4282822
SMILES | CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1C=C[C@@](C)(O)C[C@@H]21 |
InChIKey | PGZISGZFEFJPOZ-WHSLLNHNSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 330.2 |
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 | 5.24 | 6.63 | 8.02 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 6.33 | 6.52 | 6.71 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Human | Cannabinoid | A | pIC50 | 4.94 | 6.33 | 7.72 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pIC50 | 6.03 | 6.22 | 6.41 | ChEMBL |