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Ligand

NameCHEMBL240287
Molecular formulaC34H45N3O3
IUPAC name3-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-1-[2-[1-[(4-methylphenyl)methyl]piperidin-4-yl]ethyl]-1-[(4-phenylphenyl)methyl]urea
Molecular weight543.752
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP5.1
SynonymsBDBM50209690
1-(4-biphenylmethyl)-3-[1,1-di(hydroxymethyl)propyl]-1-{2-[1-(4-methylbenzyl)-4-piperidinyl]ethyl}urea
Inchi KeyANKIQEZFSWFNLV-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H45N3O3/c1-3-34(25-38,26-39)35-33(40)37(24-30-13-15-32(16-14-30)31-7-5-4-6-8-31)22-19-28-17-20-36(21-18-28)23-29-11-9-27(2)10-12-29/h4-16,28,38-39H,3,17-26H2,1-2H3,(H,35,40)
PubChem CID44437622
ChEMBLCHEMBL240287
IUPHARN/A
BindingDB50209690
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
9636Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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