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Ligand

NameCHEMBL2204471
Molecular formulaC22H16F3N3O3
IUPAC name2-[3-[1-[(2,4-difluorophenyl)methyl]-6-oxopyridazin-3-yl]-5-fluoro-2-methylindol-1-yl]acetic acid
Molecular weight427.383
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.4
SynonymsBDBM50401119
SCHEMBL1757175
Inchi KeyAIFFYVVEYRZFLH-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H16F3N3O3/c1-12-22(16-8-14(23)4-6-19(16)27(12)11-21(30)31)18-5-7-20(29)28(26-18)10-13-2-3-15(24)9-17(13)25/h2-9H,10-11H2,1H3,(H,30,31)
PubChem CID52920034
ChEMBLCHEMBL2204471
IUPHARN/A
BindingDB50401119
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
6158Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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