CANNABIGEROL
SMILES | CCCCCc1cc(O)c(C/C=C(\C)CCC=C(C)C)c(O)c1 |
InChIKey | QXACEHWTBCFNSA-SFQUDFHCSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 2 |
Rotatable bonds | 9 |
Molecular weight (Da) | 316.2 |
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 |
CB1 | CNR1 | Rat | Cannabinoid | A | pKi | 6.36 | 6.36 | 6.36 | ChEMBL |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 5.57 | 6.09 | 6.82 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 5.58 | 5.92 | 6.12 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Human | Cannabinoid | A | pIC50 | 5.46 | 5.46 | 5.46 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pIC50 | 5.48 | 5.48 | 5.48 | ChEMBL |