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Ligand

NameCHEMBL260674
Molecular formulaC20H14ClFN2O5
IUPAC name2-[(3R)-5-chloro-1'-[(2-fluorophenyl)methyl]-2,2',5'-trioxospiro[indole-3,3'-pyrrolidine]-1-yl]acetic acid
Molecular weight416.789
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP1.8
SynonymsBDBM21603
SCHEMBL2482377
2-[(3R)-5-chloro-1''-[(2-fluorophenyl)methyl]-1,2-dihydrospiro[indole-3,3''-pyrrolidine]-2,2'',5''-trione]acetic acid
Spiro-indolinone analogue, (R)-58
ZINC14976624
Inchi KeySKLDVYDFQCXARY-HXUWFJFHSA-N
Inchi IDInChI=1S/C20H14ClFN2O5/c21-12-5-6-15-13(7-12)20(18(28)23(15)10-17(26)27)8-16(25)24(19(20)29)9-11-3-1-2-4-14(11)22/h1-7H,8-10H2,(H,26,27)/t20-/m1/s1
PubChem CID24776302
ChEMBLCHEMBL260674
IUPHARN/A
BindingDB21603
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
316571Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
316569Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395
316570Prostaglandin D2 receptor 2Q9Z2J6Ptgdr2Mus musculus (Mouse)382
316568Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358

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