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Ligand

NameSCHEMBL4529392
Molecular formulaC27H24N2OS
IUPAC name1-[[3-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]-5-(2-phenylphenyl)pyrrolidin-2-one
Molecular weight424.562
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP5.5
SynonymsCHEMBL3933506
AEGWGVROKVYKOO-UHFFFAOYSA-N
BDBM203107
US9242970, 286
5-([1,1'-biphenyl]-2-yl)-1-(3-(2-methylthiazol-4-yl)benzyl)pyrrolidin-2-one
Inchi KeyAEGWGVROKVYKOO-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H24N2OS/c1-19-28-25(18-31-19)22-11-7-8-20(16-22)17-29-26(14-15-27(29)30)24-13-6-5-12-23(24)21-9-3-2-4-10-21/h2-13,16,18,26H,14-15,17H2,1H3
PubChem CID69080124
ChEMBLCHEMBL3933506
IUPHARN/A
BindingDB203107
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
535999Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
535998Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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