Chembl2338743


SMILES CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5
InChIKey IORJPTSIJDJGHA-WTOXNGCTSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 453.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections


Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Guinea pig Opioid A pKi 9.4 9.4 9.4 ChEMBL
κ OPRK Guinea pig Opioid A pIC50 9.28 9.28 9.28 ChEMBL
μ OPRM Rat Opioid A pEC50 8.68 8.68 8.68 ChEMBL
μ OPRM Rat Opioid A pKi 9.82 9.82 9.82 ChEMBL
κ OPRK Human Opioid A pEC50 10.08 10.08 10.08 ChEMBL
κ OPRK Human Opioid A pKi 10.29 10.29 10.29 ChEMBL