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Ligand

NameCHEMBL205594
Molecular formulaC25H32BrFN4O2
IUPAC name2-[2-(5-bromo-2-methoxyphenyl)ethyl]-N-[N'-[(1-ethylpiperidin-4-yl)methyl]carbamimidoyl]-3-fluorobenzamide
Molecular weight519.459
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.2
SynonymsBDBM50182072
N-{2-[2-(5-bromo-2-methoxy-phenyl)-ethyl]-3-fluoro-benzoyl}-N''-(1-ethyl-piperidin-4-ylmethyl)-guanidine
Inchi KeyAMXJMRXFZPRCQM-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H32BrFN4O2/c1-3-31-13-11-17(12-14-31)16-29-25(28)30-24(32)21-5-4-6-22(27)20(21)9-7-18-15-19(26)8-10-23(18)33-2/h4-6,8,10,15,17H,3,7,9,11-14,16H2,1-2H3,(H3,28,29,30,32)
PubChem CID44410176
ChEMBLCHEMBL205594
IUPHARN/A
BindingDB50182072
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
9335Melanocortin receptor 4P32245MC4RHomo sapiens (Human)332

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