JWH-133
SMILES | CCCC(c1ccc2c(c1)OC([C@H]1[C@H]2CC(=CC1)C)(C)C)(C)C |
InChIKey | YSBFLLZNALVODA-RBUKOAKNSA-N |
Chemical properties
Hydrogen bond acceptors | 1 |
Hydrogen bond donors | 0 |
Rotatable bonds | 3 |
Molecular weight (Da) | 312.2 |
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 |
CB1 | CNR1 | Mouse | Cannabinoid | A | pKi | 6.34 | 6.34 | 6.34 | ChEMBL |
CB2 | CNR2 | Mouse | Cannabinoid | A | pKi | 7.19 | 7.19 | 7.19 | ChEMBL |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 6.85 | 8.47 | 10.64 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 6.17 | 6.51 | 9.1 | ChEMBL |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 8.5 | 8.5 | 8.5 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Human | Cannabinoid | A | pEC50 | 6.41 | 7.22 | 8.4 | ChEMBL |
CB2 | CNR2 | Human | Cannabinoid | A | pIC50 | 6.26 | 6.67 | 7.09 | ChEMBL |