UFP-512


SMILES Oc1cc(C)c(c(c1)C)C[C@@H](C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@H](c1[nH]c2c(n1)cccc2)CC(=O)O)N
InChIKey USVQTDLSVBRMCR-YGPDHOBYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 5
Rotatable bonds 8
Molecular weight (Da) 555.2

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 10.2 10.2 10.2 Guide to Pharmacology
κ OPRK Human Opioid A pKi 6.66 6.66 6.66 Guide to Pharmacology
δ OPRD Mouse Opioid A pKd 9.9 9.9 9.9 ChEMBL
μ OPRM Rat Opioid A pKi 7.27 7.27 7.27 ChEMBL
μ OPRM Human Opioid A pKi 8.0 8.0 8.0 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 5.76 8.53 9.92 ChEMBL