HU-210
SMILES | CCCCCCC(c1cc(O)c2c(c1)OC([C@H]1[C@H]2CC(=CC1)CO)(C)C)(C)C |
InChIKey | SSQJFGMEZBFMNV-WOJBJXKFSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 7 |
Molecular weight (Da) | 386.3 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Structure pdb | 9ERX |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Mouse | Cannabinoid | A | pKi | 9.7 | 9.7 | 9.7 | ChEMBL |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 7.75 | 9.07 | 9.82 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 7.73 | 8.89 | 10.22 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 9.1 | 9.65 | 10.2 | Guide to Pharmacology |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 9.3 | 9.55 | 9.8 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Human | Cannabinoid | A | pEC50 | 8.39 | 8.65 | 9.2 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pEC50 | 7.4 | 8.31 | 9.22 | ChEMBL |
GPR55 | GPR55 | Human | GPR18, GPR55 and GPR119 | A | pEC50 | 7.59 | 7.59 | 7.59 | Guide to Pharmacology |