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Ligand

NameTAK-220
Molecular formulaC31H41ClN4O3
IUPAC name1-acetyl-N-[3-[4-[(4-carbamoylphenyl)methyl]piperidin-1-yl]propyl]-N-(3-chloro-4-methylphenyl)piperidine-4-carboxamide
Molecular weight553.144
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.2
Synonyms333994-00-6
AKOS027337128
HY-19974
TBR-220
1-acetyl-N-(3-(4-(4-carbamoylbenzyl)piperidin-1-yl)propyl)-N-(3-chloro-4-methylphenyl)piperidine-4-carboxamide
[ Show all ]
Inchi KeyASSJTMUEFHUKMJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H41ClN4O3/c1-22-4-9-28(21-29(22)32)36(31(39)27-12-18-35(19-13-27)23(2)37)15-3-14-34-16-10-25(11-17-34)20-24-5-7-26(8-6-24)30(33)38/h4-9,21,25,27H,3,10-20H2,1-2H3,(H2,33,38)
PubChem CID5275766
ChEMBLCHEMBL207004
IUPHAR800
BindingDB50185979
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
13479C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352

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