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Ligand

NameCHEMBL343188
Molecular formulaC18H18N8O5
IUPAC name4-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazine-1-carbonyl]-2-oxido-1,2,5-oxadiazol-2-ium-3-carbonitrile
Molecular weight426.393
Hydrogen bond acceptor11
Hydrogen bond donor1
XlogP1.1
SynonymsBDBM50407713
4-[[4-(4-Amino-6,7-dimethoxyquinazolin-2-yl)piperazino]carbonyl]-3-cyanofurazan 2-oxide
Inchi KeyANVHOPIUGOZJMC-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H18N8O5/c1-29-13-7-10-11(8-14(13)30-2)21-18(22-16(10)20)25-5-3-24(4-6-25)17(27)15-12(9-19)26(28)31-23-15/h7-8H,3-6H2,1-2H3,(H2,20,21,22)
PubChem CID10550345
ChEMBLCHEMBL343188
IUPHARN/A
BindingDB50407713
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
9925Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466

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