CHEMBL2307889


SMILES N=C(N)NCCC[C@@H](NC(=O)CC1(CC(=O)N2CCN(C3c4ccccc4NC(=O)c4ccccc43)CC2)CCCC1)C(=O)NCCn1c(=O)n(-c2ccccc2)n(-c2ccccc2)c1=O
InChIKey RSJAXPUYVJKAAA-MJEROREJSA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 6
Rotatable bonds 16
Molecular weight (Da) 895.4

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
Y2 NPY2R Human Neuropeptide Y A pKi 8.59 8.59 8.59 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.44 6.44 6.44 ChEMBL
κ OPRK Human Opioid A pKi 6.02 6.02 6.02 ChEMBL
μ OPRM Human Opioid A pKi 6.49 6.49 6.49 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Y2 NPY2R Human Neuropeptide Y A pIC50 8.48 8.48 8.48 ChEMBL