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Ligand

NameCHEMBL3809230
Molecular formulaC29H20ClN3O3
IUPAC name3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid
Molecular weight493.947
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP6.4
SynonymsBDBM50172348
Inchi KeyIDMBBLNHFYTANN-CCQVQAEASA-N
Inchi IDInChI=1S/C29H20ClN3O3/c30-20-11-9-19-10-13-21(31-26(19)17-20)12-8-18-4-3-5-22(16-18)32-27(34)15-14-24-23-6-1-2-7-25(23)33-28(24)29(35)36/h1-17,33H,(H,32,34)(H,35,36)/b12-8+,15-14+
PubChem CID127043050
ChEMBLCHEMBL3809230
IUPHARN/A
BindingDB50172348
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
525293Cysteinyl leukotriene receptor 1Q99JA4Cysltr1Mus musculus (Mouse)352
525294Cysteinyl leukotriene receptor 1Q9Y271CYSLTR1Homo sapiens (Human)337
525295Cysteinyl leukotriene receptor 2Q9NS75CYSLTR2Homo sapiens (Human)346

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