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Ligand

NameCHEMBL198689
Molecular formulaC29H28Cl2N4O2
IUPAC nameN-[[4-(3-cyanophenyl)phenyl]methyl]-N-[2-(3,5-dichloroanilino)-2-oxoethyl]-3-pyrrolidin-1-ylpropanamide
Molecular weight535.469
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.2
SynonymsBDBM50174825
N-(3''-cyano-biphenyl-4-ylmethyl)-N-[(3,5-dichloro-phenylcarbamoyl)-methyl]-3-pyrrolidin-1-yl-propionamide
Inchi KeyHKUXJPOEEIRZOB-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H28Cl2N4O2/c30-25-15-26(31)17-27(16-25)33-28(36)20-35(29(37)10-13-34-11-1-2-12-34)19-21-6-8-23(9-7-21)24-5-3-4-22(14-24)18-32/h3-9,14-17H,1-2,10-13,19-20H2,(H,33,36)
PubChem CID23573799
ChEMBLCHEMBL198689
IUPHARN/A
BindingDB50174825
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
117536Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
117535Melanin-concentrating hormone receptor 2Q969V1MCHR2Homo sapiens (Human)340

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