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Ligand

NameCHEMBL1682629
Molecular formulaC33H37Cl2N3O3
IUPAC name2-[(4-acetamido-4-phenylpiperidin-1-yl)methyl]-1-(3,4-dichlorophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylcyclopropane-1-carboxamide
Molecular weight594.577
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.5
SynonymsBDBM50337426
rac-2-((4-acetamido-4-phenylpiperidin-1-yl)methyl)-1-(3,4-dichlorophenyl)-N-(2-methoxybenzyl)-N-methylcyclopropanecarboxamide
Inchi KeyBDROXNCOLLNVCM-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H37Cl2N3O3/c1-23(39)36-32(25-10-5-4-6-11-25)15-17-38(18-16-32)22-27-20-33(27,26-13-14-28(34)29(35)19-26)31(40)37(2)21-24-9-7-8-12-30(24)41-3/h4-14,19,27H,15-18,20-22H2,1-3H3,(H,36,39)
PubChem CID53326864
ChEMBLCHEMBL1682629
IUPHARN/A
BindingDB50337426
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
21189Neuromedin-K receptorP29371TACR3Homo sapiens (Human)465

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