nor-binaltorphimine


SMILES Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2C[C@@]2([C@@]34[C@H]1Oc1c4c(C[C@H]2N(CC3)CC2CC2)ccc1O)O)CC1CC1
InChIKey APSUXPSYBJVPPS-YAUKWVCOSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 5
Rotatable bonds 4
Molecular weight (Da) 661.3

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
κ OPRK Rat Opioid A pKi 7.9 9.31 10.15 ChEMBL
δ OPRD Mouse Opioid A pKi 7.38 7.8 8.28 ChEMBL
κ OPRK Guinea pig Opioid A pKi 6.96 9.26 10.42 ChEMBL
μ OPRM Rat Opioid A pKi 6.99 7.85 9.66 ChEMBL
κ OPRK Human Opioid A pKi 7.89 9.56 10.57 ChEMBL
μ OPRM Human Opioid A pKi 7.1 7.68 9.03 ChEMBL
δ OPRD Human Opioid A pKi 7.19 8.02 9.52 ChEMBL
δ OPRD Human Opioid A pKi 8.2 8.2 8.2 Guide to Pharmacology
κ OPRK Human Opioid A pKi 8.9 9.95 11.0 Guide to Pharmacology
μ OPRM Human Opioid A pKi 7.7 7.7 7.7 Guide to Pharmacology
κ OPRK Mouse Opioid A pKd 8.78 8.78 8.78 ChEMBL
κ OPRK Rat Opioid A pKi 9.6 10.15 10.7 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 7.98 7.98 7.98 ChEMBL
κ OPRK Guinea pig Opioid A pIC50 6.74 7.48 8.22 ChEMBL
κ OPRK Human Opioid A pIC50 8.03 8.61 9.55 ChEMBL
κ OPRK Human Opioid A pEC50 8.22 8.22 8.22 ChEMBL
μ OPRM Human Opioid A pIC50 6.67 6.67 6.67 ChEMBL
μ OPRM Human Opioid A pEC50 6.92 6.92 6.92 ChEMBL
NPS NPSR1 Human Neuropeptide S A Potency 4.9 4.9 4.9 ChEMBL
δ OPRD Human Opioid A pIC50 7.62 7.63 7.66 ChEMBL
δ OPRD Human Opioid A pEC50 6.42 6.42 6.42 ChEMBL
δ OPRD Mouse Opioid A pIC50 6.7 6.7 6.7 Guide to Pharmacology
κ OPRK Mouse Opioid A pIC50 8.54 8.54 8.54 ChEMBL
κ OPRK Mouse Opioid A pIC50 8.9 8.9 8.9 Guide to Pharmacology