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Ligand

NameCHEMBL398762
Molecular formulaC20H20N6O3
IUPAC name2-[[4-(6-aminoquinoxalin-2-yl)piperazine-1-carbonyl]amino]benzoic acid
Molecular weight392.419
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP1.7
Synonyms2-(1-(6-aminoquinoxalin-2-yl)piperazine-4-carboxamido)benzoic acid
BDBM50227769
SCHEMBL13666065
Inchi KeyBORJQNRTQNIWGQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H20N6O3/c21-13-5-6-16-17(11-13)22-12-18(23-16)25-7-9-26(10-8-25)20(29)24-15-4-2-1-3-14(15)19(27)28/h1-6,11-12H,7-10,21H2,(H,24,29)(H,27,28)
PubChem CID16048843
ChEMBLCHEMBL398762
IUPHARN/A
BindingDB50227769
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
29065Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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