CHEMBL3704592


SMILES O=C(O)CCN1CCC[C@H](c2nc3ccccc3n2[C@@H]2C[C@@H]3CCC[C@H](C2)N3[C@H]2C[C@H]3CCCC[C@H](C3)C2)C1
InChIKey CNXAMMJOFWZPCL-WCSHMYRTSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 532.4

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
NOP OPRX Human Opioid A pKi 7.07 7.07 7.07 ChEMBL
δ OPRD Human Opioid A pKi 4.7 4.7 4.7 ChEMBL
κ OPRK Human Opioid A pKi 6.59 6.59 6.59 ChEMBL
μ OPRM Human Opioid A pKi 4.7 4.7 4.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database