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Ligand

Nameethyl 2-[4-(cyanomethyl)-3-oxo-3,4-dihydro-2-quinoxalinyl]acetate
Molecular formulaC14H13N3O3
IUPAC nameethyl 2-[4-(cyanomethyl)-3-oxoquinoxalin-2-yl]acetate
Molecular weight271.276
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP1.1
SynonymsMLS000721275
478041-11-1
SMR000335703
ethyl 2-[4-(cyanomethyl)-3-oxoquinoxalin-2-yl]acetate
AC1NPNJ2
[ Show all ]
Inchi KeyAASGCGWCHGCYQQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H13N3O3/c1-2-20-13(18)9-11-14(19)17(8-7-15)12-6-4-3-5-10(12)16-11/h3-6H,2,8-9H2,1H3
PubChem CID5181996
ChEMBLCHEMBL1529516
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
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GLASS IDNameUniProtGeneSpeciesLength
491Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757

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