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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL1968640
Molecular formulaC22H20ClN3O4
IUPAC name5-chloro-4-(4-methoxyphenoxy)-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]pyridazin-3-one
Molecular weight425.869
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.6
SynonymsSR-02000001663-1
BDBM50425632
SR-02000001663
Inchi KeyAMWDDIDHDMAFOT-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20ClN3O4/c1-14-11-15-5-3-4-6-19(15)26(14)20(27)13-25-22(28)21(18(23)12-24-25)30-17-9-7-16(29-2)8-10-17/h3-10,12,14H,11,13H2,1-2H3
PubChem CID53364424
ChEMBLCHEMBL1968640
IUPHARN/A
BindingDB50425632
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
9306Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
9305Neuropeptides B/W receptor type 1P48145NPBWR1Homo sapiens (Human)328

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