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Ligand

NameCHEMBL372551
Molecular formulaC29H28Cl2N4O3
IUPAC nameN-[2-[4-(3-cyanophenyl)phenyl]ethyl]-N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-[(3S)-3-hydroxypyrrolidin-1-yl]acetamide
Molecular weight551.468
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.8
SynonymsBDBM50174814
N-[2-(3''-cyano-biphenyl-4-yl)-ethyl]-N-[(3,5-dichloro-phenylcarbamoyl)-methyl]-2-((S)-3-hydroxy-pyrrolidin-1-yl)-acetamide
Inchi KeyBFVBGCXATBAVRX-MHZLTWQESA-N
Inchi IDInChI=1S/C29H28Cl2N4O3/c30-24-13-25(31)15-26(14-24)33-28(37)18-35(29(38)19-34-10-9-27(36)17-34)11-8-20-4-6-22(7-5-20)23-3-1-2-21(12-23)16-32/h1-7,12-15,27,36H,8-11,17-19H2,(H,33,37)/t27-/m0/s1
PubChem CID11613696
ChEMBLCHEMBL372551
IUPHARN/A
BindingDB50174814
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
22666Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
22665Melanin-concentrating hormone receptor 2Q969V1MCHR2Homo sapiens (Human)340

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