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Ligand

NameSpiro-indolinone analogue, 90
Molecular formulaC20H15Cl2FN2O4
IUPAC name2-[5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2'-dioxospiro[indole-3,4'-pyrrolidine]-1-yl]acetic acid
Molecular weight437.248
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.5
SynonymsCHEMBL409524
BDBM21598
SCHEMBL2484341
2-{5-chloro-1''-[(5-chloro-2-fluorophenyl)methyl]-1,2-dihydrospiro[indole-3,3''-pyrrolidine]-2,5''-dione}acetic acid
Inchi KeyABVCZPJCOYQLBK-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H15Cl2FN2O4/c21-12-1-3-15(23)11(5-12)8-24-10-20(7-17(24)26)14-6-13(22)2-4-16(14)25(19(20)29)9-18(27)28/h1-6H,7-10H2,(H,27,28)
PubChem CID24776297
ChEMBLCHEMBL409524
IUPHARN/A
BindingDB21598
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
1213Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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