naloxonazine


SMILES C=CCN1CC[C@@]23[C@@]4([C@H]1Cc1c3c(O[C@H]2/C(=N\N=C/2\CC[C@@]3([C@@]56[C@H]2Oc2c6c(C[C@H]3N(CC5)CC=C)ccc2O)O)/CC4)c(cc1)O)O
InChIKey AJPSBXJNFJCCBI-HNJBNLCWSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 4
Rotatable bonds 5
Molecular weight (Da) 650.3

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
δ OPRD Human Opioid A pKi 7.32 7.32 7.32 ChEMBL
κ OPRK Human Opioid A pKi 7.47 7.47 7.47 ChEMBL
μ OPRM Human Opioid A pKi 8.5 8.62 8.84 ChEMBL
μ OPRM Mouse Opioid A pKi 10.3 10.3 10.3 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pIC50 6.87 6.87 6.87 ChEMBL
κ OPRK Human Opioid A pIC50 7.07 7.07 7.07 ChEMBL
μ OPRM Human Opioid A pIC50 8.14 8.14 8.14 ChEMBL