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Ligand

NameCHEMBL540930
Molecular formulaC31H29ClF4N4O2
IUPAC nameN-[(5-chloro-6-oxo-1H-pyridin-3-yl)-(4-fluorophenyl)methyl]-2-[1-[[1-[4-(trifluoromethyl)phenyl]pyrrol-3-yl]methyl]piperidin-4-yl]acetamide
Molecular weight601.043
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP5.0
SynonymsBDBM50296043
N-((5-chloro-6-oxo-1,6-dihydropyridin-3-yl)(4-fluorophenyl)methyl)-2-(1-((1-(4-(trifluoromethyl)phenyl)-1H-pyrrol-3-yl)methyl)piperidin-4-yl)acetamide
Inchi KeyACHAGBFZZOHGJZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H29ClF4N4O2/c32-27-16-23(17-37-30(27)42)29(22-1-5-25(33)6-2-22)38-28(41)15-20-9-12-39(13-10-20)18-21-11-14-40(19-21)26-7-3-24(4-8-26)31(34,35)36/h1-8,11,14,16-17,19-20,29H,9-10,12-13,15,18H2,(H,37,42)(H,38,41)
PubChem CID11599973
ChEMBLCHEMBL540930
IUPHARN/A
BindingDB50296043
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1570Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
1571Melanin-concentrating hormone receptor 2Q969V1MCHR2Homo sapiens (Human)340

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