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Ligand

NameCHEMBL378317
Molecular formulaC35H38Cl3FN4O5
IUPAC name4-fluoro-N-[[3-[(3-nitrophenyl)methyl-(2,2,2-trichloroacetyl)amino]cyclohexyl]methyl]-N-[3-(2-pyrrolidin-1-ylethoxy)phenyl]benzamide
Molecular weight720.06
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP7.7
SynonymsBDBM50186102
N-((3-(N-(3-nitrobenzyl)-2,2,2-trichloroacetamido)cyclohexyl)methyl)-4-fluoro-N-(3-(2-(pyrrolidin-1-yl)ethoxy)phenyl)benzamide
Inchi KeyBDLIUAXYTCOMLC-UHFFFAOYSA-N
Inchi IDInChI=1S/C35H38Cl3FN4O5/c36-35(37,38)34(45)42(24-26-7-4-10-31(21-26)43(46)47)29-8-3-6-25(20-29)23-41(33(44)27-12-14-28(39)15-13-27)30-9-5-11-32(22-30)48-19-18-40-16-1-2-17-40/h4-5,7,9-15,21-22,25,29H,1-3,6,8,16-20,23-24H2
PubChem CID44412894
ChEMBLCHEMBL378317
IUPHARN/A
BindingDB50186102
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
21041Motilin receptorO43193MLNRHomo sapiens (Human)412

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