CHEMBL260095
SMILES | Cc1c(C(=O)NN2CCCCC2)nn(-c2c(Cl)cc(Cl)cc2Cl)c1-n1cccc1 |
InChIKey | DBOBFBHYPQMGLX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 451.1 |
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 | Human | Cannabinoid | A | pKi | 5.75 | 5.75 | 5.75 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 5.74 | 5.74 | 5.74 | PDSP Ki database |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 5.4 | 5.4 | 5.4 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB1 | CNR1 | Human | Cannabinoid | A | pIC50 | 5.5 | 5.5 | 5.5 | ChEMBL |