(S)-2-(3-((3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl)-N-isobutylpropanamido)-3-phenylpropanoic acid


SMILES CC1CN(CCC1(C)C2=CC(=CC=C2)O)CCC(=O)N(CC(C)C)C(CC3=CC=CC=C3)C(=O)O
InChIKey DGOUNVLJIMXXBH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 480.3

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
μ OPRM Human Opioid A pKi 7.55 7.55 7.55 PDSP Ki database
δ OPRD Human Opioid A pKi 7.54 7.54 7.54 PDSP Ki database
κ OPRK Human Opioid A pKi 5.66 5.66 5.66 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database