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Ligand

NameAC1LP5VO
Molecular formulaC19H14N2O7
IUPAC name4-[5-(3-nitrobenzoyl)-1,3-dioxoisoindol-2-yl]butanoic acid
Molecular weight382.328
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP1.9
Synonyms4-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]butanoic acid
4-[5-(3-nitrobenzoyl)-1,3-dioxoisoindol-2-yl]butanoic acid
4-{5-[(3-nitrophenyl)carbonyl]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}butanoic acid
AKOS003336273
CHEMBL596310
[ Show all ]
Inchi KeyAFVQWHJSOZHKGJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H14N2O7/c22-16(23)5-2-8-20-18(25)14-7-6-12(10-15(14)19(20)26)17(24)11-3-1-4-13(9-11)21(27)28/h1,3-4,6-7,9-10H,2,5,8H2,(H,22,23)
PubChem CID1301621
ChEMBLCHEMBL596310
IUPHARN/A
BindingDBN/A
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4542Lysophosphatidic acid receptor 5Q9H1C0LPAR5Homo sapiens (Human)372

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