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Ligand

NameCHEMBL604677
Molecular formulaC21H12N2O7
IUPAC name2-[3-(4-nitrophenoxy)phenyl]-1,3-dioxoisoindole-5-carboxylic acid
Molecular weight404.334
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.3
SynonymsAC1LRB4E
H2L 5765834
Oprea1_676785
420841-84-5
MolPort-002-166-934
[ Show all ]
Inchi KeyHFYPTENHTPNXGP-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H12N2O7/c24-19-17-9-4-12(21(26)27)10-18(17)20(25)22(19)14-2-1-3-16(11-14)30-15-7-5-13(6-8-15)23(28)29/h1-11H,(H,26,27)
PubChem CID1365686
ChEMBLCHEMBL604677
IUPHARN/A
BindingDB50304580
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
113882Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
113883Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353
113881Lysophosphatidic acid receptor 5Q9H1C0LPAR5Homo sapiens (Human)372

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