CHEMBL1086903
SMILES | O=C(NC1CCCCC1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 |
InChIKey | IRRGBCHOFRYUCB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 377.2 |
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 |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 5.62 | 5.62 | 5.62 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 5.62 | 5.62 | 5.62 | PDSP Ki database |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 7.28 | 7.28 | 7.28 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 4.9 | 4.9 | 4.9 | ChEMBL |