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Ligand

NameCHEMBL2204469
Molecular formulaC23H18F3N3O3
IUPAC name2-[3-[[1-[(2,4-difluorophenyl)methyl]-6-oxopyridazin-3-yl]methyl]-5-fluoro-2-methylindol-1-yl]acetic acid
Molecular weight441.41
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.3
Synonyms2-(3-((1-(2,4-difluorobenzyl)-6-oxo-1,6-dihydropyridazin-3-yl)methyl)-5-fluoro-2-methyl-1H-indol-1-yl)acetic acid
BDBM50401097
SCHEMBL1757725
1297276-84-6
ZTPOWDSDKMQVBU-UHFFFAOYSA-N
[ Show all ]
Inchi KeyZTPOWDSDKMQVBU-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H18F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-9H,10-12H2,1H3,(H,31,32)
PubChem CID52920263
ChEMBLCHEMBL2204469
IUPHARN/A
BindingDB50401097
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
437138Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
437135Prostaglandin D2 receptor 2Q9Z2J6Ptgdr2Mus musculus (Mouse)382
437136Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395
437137Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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