compound 46 [PMID: 25268943]


SMILES NC(=N)NCCNC(=O)C1(CCN(CC1)Cc1ccccc1)Nc1ccccc1
InChIKey SCPYAGLHLAAYFP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 5
Rotatable bonds 8
Molecular weight (Da) 394.2

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
NPFF1 NPFF1 Human Neuropeptide FF/neuropeptide AF A pKi 7.09 7.09 7.09 Guide to Pharmacology
NPFF2 NPFF2 Human Neuropeptide FF/neuropeptide AF A pKi 5.85 5.85 5.85 Guide to Pharmacology
NPFF1 NPFF1 Human Neuropeptide FF/neuropeptide AF A pKi 7.09 7.09 7.09 ChEMBL
μ OPRM Human Opioid A pKi 6.7 6.7 6.7 ChEMBL
NPFF2 NPFF2 Human Neuropeptide FF/neuropeptide AF A pKi 5.85 5.85 5.85 ChEMBL
δ OPRD Human Opioid A pKi 5.6 5.6 5.6 ChEMBL
κ OPRK Human Opioid A pKi 6.65 6.65 6.65 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NPFF1 NPFF1 Human Neuropeptide FF/neuropeptide AF A pEC50 5.45 5.45 5.45 ChEMBL