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Ligand

NameCHEMBL565228
Molecular formulaC30H26ClN3O2S
IUPAC name3-[5-[[3-[(E)-2-(5-chloro-1,3-benzothiazol-2-yl)ethenyl]phenyl]methyl]-3,4-dihydro-1H-pyrido[4,3-b]indol-2-yl]propanoic acid
Molecular weight528.067
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.1
SynonymsBDBM50296108
3-(5-(3-(2-(5-chlorobenzo[d]thiazol-2-yl)vinyl)benzyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)propanoic acid
Inchi KeyCVTBVIGFYAHVTH-DHZHZOJOSA-N
Inchi IDInChI=1S/C30H26ClN3O2S/c31-22-9-10-28-25(17-22)32-29(37-28)11-8-20-4-3-5-21(16-20)18-34-26-7-2-1-6-23(26)24-19-33(14-12-27(24)34)15-13-30(35)36/h1-11,16-17H,12-15,18-19H2,(H,35,36)/b11-8+
PubChem CID45270816
ChEMBLCHEMBL565228
IUPHARN/A
BindingDB50296108
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
51767Cysteinyl leukotriene receptor 1Q2NNR5CYSLTR1Cavia porcellus (Guinea pig)340

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