UFP-112


SMILES NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC(=O)N)CC(=O)N)CCCCN)CCCNC(=N)N)CCCCN)CCCNC(=N)N)C)CO)NC(=O)[C@@H](NC(=O)C(NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1ccc(cc1)F)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)N)(C)C)CCCNC(=N)N
InChIKey GVIRJSRJRJCCJE-HCYVKCTOSA-N
Sequence FGGFTGXRKSARKRKNQ

Chemical properties

Hydrogen bond acceptors 28
Hydrogen bond donors 34
Rotatable bonds 68
Molecular weight (Da) 1939.1

Drug properties

Molecular type Peptide
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pKi 10.55 10.55 10.55 ChEMBL
κ OPRK Human Opioid A pKi 8.36 8.36 8.36 ChEMBL
μ OPRM Human Opioid A pKi 7.13 7.13 7.13 ChEMBL
δ OPRD Human Opioid A pKi 6.37 6.37 6.37 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pEC50 8.39 9.05 9.71 Guide to Pharmacology
NOP OPRX Guinea pig Opioid A pEC50 9.17 9.17 9.17 ChEMBL
NOP OPRX Mouse Opioid A pEC50 9.24 9.24 9.24 ChEMBL
NOP OPRX Rat Opioid A pEC50 8.34 8.34 8.34 ChEMBL
NOP OPRX Human Opioid A pEC50 10.55 10.55 10.55 ChEMBL