CHEMBL410496
SMILES | O=C(NC1CCCCC1)c1cc(-n2cccc2)n(-c2ccc(Cl)cc2)n1 |
InChIKey | JRJFRWURMSBKJJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 368.1 |
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 | 5.76 | 5.76 | 5.76 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 6.55 | 6.55 | 6.55 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 6.55 | 6.55 | 6.55 | PDSP Ki database |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 5.76 | 5.76 | 5.76 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Human | Cannabinoid | A | pIC50 | 5.65 | 5.65 | 5.65 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pIC50 | 6.3 | 6.3 | 6.3 | ChEMBL |