CHEMBL3704576


SMILES O=C(O)CN1CCC[C@H](c2nc3ccccc3n2[C@@H]2C[C@@H]3CCC[C@H](C2)N3[C@@H]2C[C@H]3CCC[C@H](C3)C2)C1
InChIKey BULRYAVAAXWJIN-NNKIXODWSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 504.3

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
δ OPRD Human Opioid A pKi 4.7 4.7 4.7 ChEMBL
κ OPRK Human Opioid A pKi 6.45 6.45 6.45 ChEMBL
μ OPRM Human Opioid A pKi 4.7 4.7 4.7 ChEMBL
NOP OPRX Human Opioid A pKi 6.66 6.66 6.66 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database