CHEMBL383896


SMILES O=C1CC[C@@]2(NCC/C=C/c3ccc(Cl)cc3)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5
InChIKey LHHZTZQOZGGGTA-WZYLLMEMSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 504.2

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 8.68 8.68 8.68 ChEMBL
κ OPRK Human Opioid A pKi 8.43 8.43 8.43 ChEMBL
μ OPRM Human Opioid A pKi 9.0 9.0 9.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pIC50 8.93 8.93 8.93 ChEMBL
κ OPRK Human Opioid A pIC50 7.78 7.78 7.78 ChEMBL
μ OPRM Human Opioid A pIC50 9.62 9.62 9.62 ChEMBL