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Ligand

NameCHEMBL3808613
Molecular formulaC30H22ClN3O4
IUPAC name3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-5-methoxy-1H-indole-2-carboxylic acid
Molecular weight523.973
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP6.3
SynonymsBDBM50172337
Inchi KeyNJVMCVNHNUOPCA-BNCZNCEZSA-N
Inchi IDInChI=1S/C30H22ClN3O4/c1-38-23-11-13-26-25(17-23)24(29(34-26)30(36)37)12-14-28(35)33-22-4-2-3-18(15-22)5-9-21-10-7-19-6-8-20(31)16-27(19)32-21/h2-17,34H,1H3,(H,33,35)(H,36,37)/b9-5+,14-12+
PubChem CID127043248
ChEMBLCHEMBL3808613
IUPHARN/A
BindingDB50172337
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
527972Cysteinyl leukotriene receptor 1Q9Y271CYSLTR1Homo sapiens (Human)337
527971Cysteinyl leukotriene receptor 2Q9NS75CYSLTR2Homo sapiens (Human)346

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