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Ligand

NameCHEMBL213491
Molecular formulaC31H32Cl2N4O
IUPAC name2-[6-(3-cyanophenyl)-1'-propan-2-ylspiro[3,4-dihydroisoquinoline-1,4'-piperidine]-2-yl]-N-(3,5-dichlorophenyl)acetamide
Molecular weight547.524
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.5
SynonymsBDBM50190905
2-[6-(3-cyano-phenyl)-1''-isopropyl-3,4-dihydro-spiro[isoquinoline-1,4''-piperidin]-2-yl]-N-(3,5-dichloro-phenyl)-acetamide
Inchi KeyAIHWMRGISSLYBL-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H32Cl2N4O/c1-21(2)36-12-9-31(10-13-36)29-7-6-24(23-5-3-4-22(14-23)19-34)15-25(29)8-11-37(31)20-30(38)35-28-17-26(32)16-27(33)18-28/h3-7,14-18,21H,8-13,20H2,1-2H3,(H,35,38)
PubChem CID10256914
ChEMBLCHEMBL213491
IUPHARN/A
BindingDB50190905
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
6228Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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