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Ligand

NameSMR000034616
Molecular formulaC23H22N2O7S
IUPAC name6-O-ethyl 8-O-propan-2-yl (2Z)-5-amino-7-(furan-2-yl)-2-(furan-2-ylmethylidene)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Molecular weight470.496
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP3.3
SynonymsMLS000039286
6-O-ethyl 8-O-propan-2-yl (2Z)-5-amino-7-(furan-2-yl)-2-(furan-2-ylmethylidene)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
MolPort-023-225-188
MLS002581775
AC1NZVES
[ Show all ]
Inchi KeyAEDSOYQNRBGKFU-PTNGSMBKSA-N
Inchi IDInChI=1S/C23H22N2O7S/c1-4-29-22(27)17-16(14-8-6-10-31-14)18(23(28)32-12(2)3)21-25(19(17)24)20(26)15(33-21)11-13-7-5-9-30-13/h5-12,16H,4,24H2,1-3H3/b15-11-
PubChem CID5917962
ChEMBLCHEMBL3199921
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3372Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
463288Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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