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Ligand

NameMLS000122379
Molecular formulaC18H19N3O2
IUPAC name2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(2-phenylethyl)acetamide
Molecular weight309.369
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP2.1
SynonymsBDBM96593
MolPort-000-685-080
Z31269343
2-(3-oxo-1,2,3,4-tetrahydro-2-quinoxalinyl)-N-(2-phenylethyl)acetamide
2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)-N-phenethyl-acetamide
[ Show all ]
Inchi KeyALYVOKZTHSTUAG-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H19N3O2/c22-17(19-11-10-13-6-2-1-3-7-13)12-16-18(23)21-15-9-5-4-8-14(15)20-16/h1-9,16,20H,10-12H2,(H,19,22)(H,21,23)
PubChem CID3155914
ChEMBLCHEMBL1337758
IUPHARN/A
BindingDB96593
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
8675Trace amine-associated receptor 1Q96RJ0TAAR1Homo sapiens (Human)339

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