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Ligand

NameCHEMBL439560
Molecular formulaC29H36ClF3N4O2
IUPAC name1-[(2R)-1-[4-[2-[(1S)-1-amino-3-methylbutyl]-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-(4-chlorophenyl)-1-oxopropan-2-yl]pyrrolidin-2-one
Molecular weight565.078
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.0
SynonymsBDBM50214685
1-[(R)-2-{4-[2-((S)-1-amino-3-methylbutyl)-4-trifluoromethylphenyl]-piperazin-1-yl}-1-(4-dichlorobenzyl)-2-oxoethyl]pyrrolidin-2-one
Inchi KeyGWQJQMUYAJRYAV-AZGAKELHSA-N
Inchi IDInChI=1S/C29H36ClF3N4O2/c1-19(2)16-24(34)23-18-21(29(31,32)33)7-10-25(23)35-12-14-36(15-13-35)28(39)26(37-11-3-4-27(37)38)17-20-5-8-22(30)9-6-20/h5-10,18-19,24,26H,3-4,11-17,34H2,1-2H3/t24-,26+/m0/s1
PubChem CID23661656
ChEMBLCHEMBL439560
IUPHARN/A
BindingDB50214685
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
107141Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366
107144Melanocortin receptor 3P41968MC3RHomo sapiens (Human)323
107139Melanocortin receptor 4P56450Mc4rMus musculus (Mouse)332
107140Melanocortin receptor 4P32245MC4RHomo sapiens (Human)332
107143Melanocortin receptor 4P70596Mc4rRattus norvegicus (Rat)332
107138Melanocortin receptor 5P33032MC5RHomo sapiens (Human)325
107142Melanocyte-stimulating hormone receptorQ01726MC1RHomo sapiens (Human)317

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