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Ligand

Name453529-59-4
Molecular formulaC17H15N3O5
IUPAC name(4-oxo-1,2,3-benzotriazin-3-yl)methyl 2,3-dimethoxybenzoate
Molecular weight341.323
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP3.2
SynonymsMCULE-1691620718
AKOS002473686
MolPort-003-035-192
(4-oxo-1,2,3-benzotriazin-3-yl)methyl 2,3-dimethoxybenzoate
F0624-0020
[ Show all ]
Inchi KeyAEMIMRJYJLQWBM-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H15N3O5/c1-23-14-9-5-7-12(15(14)24-2)17(22)25-10-20-16(21)11-6-3-4-8-13(11)18-19-20/h3-9H,10H2,1-2H3
PubChem CID866912
ChEMBLCHEMBL1380789
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3634Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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