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Ligand

NameCHEMBL2042237
Molecular formulaC23H17ClN4O6
IUPAC name2-[5'-chloro-1-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methyl]-2,2',5-trioxospiro[imidazolidine-4,3'-indole]-1'-yl]acetic acid
Molecular weight480.861
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP2.2
SynonymsBDBM50385619
SCHEMBL2483985
Inchi KeyAHJHZJYPIYKOIX-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H17ClN4O6/c1-12-15(19(26-34-12)13-5-3-2-4-6-13)10-28-21(32)23(25-22(28)33)16-9-14(24)7-8-17(16)27(20(23)31)11-18(29)30/h2-9H,10-11H2,1H3,(H,25,33)(H,29,30)
PubChem CID58017115
ChEMBLCHEMBL2042237
IUPHARN/A
BindingDB50385619
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
5612Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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