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Ligand

NameCHEMBL484605
Molecular formulaC20H17N5O5
IUPAC name2-[3-(7-hydroxy-5-methyl-4-oxotriazolo[1,5-a]quinoxalin-3-yl)propanoylamino]benzoic acid
Molecular weight407.386
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP1.6
SynonymsBDBM50277634
2-(3-(7-hydroxy-5-methyl-4-oxo-4,5-dihydro-[1,2,3]triazolo[1,5-a]quinoxalin-3-yl)propanamido)benzoic acid
Inchi KeyAXLXHCUJAXCMJR-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H17N5O5/c1-24-16-10-11(26)6-8-15(16)25-18(19(24)28)14(22-23-25)7-9-17(27)21-13-5-3-2-4-12(13)20(29)30/h2-6,8,10,26H,7,9H2,1H3,(H,21,27)(H,29,30)
PubChem CID42625380
ChEMBLCHEMBL484605
IUPHARN/A
BindingDB50277634
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
16842Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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