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Ligand

NameCHEMBL1927430
Molecular formulaC19H28N8O5
IUPAC nametert-butyl N-[2-[2-[2-[[7-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-yl]amino]ethoxy]ethoxy]ethyl]carbamate
Molecular weight448.484
Hydrogen bond acceptor11
Hydrogen bond donor3
XlogP1.0
SynonymsBDBM50360204
Inchi KeyAELSDQALOKPCDU-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H28N8O5/c1-19(2,3)32-18(28)22-7-10-30-12-11-29-9-6-21-16-24-15(20)27-17(25-16)23-14(26-27)13-5-4-8-31-13/h4-5,8H,6-7,9-12H2,1-3H3,(H,22,28)(H3,20,21,23,24,25,26)
PubChem CID51050940
ChEMBLCHEMBL1927430
IUPHARN/A
BindingDB50360204
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3620Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
3621Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
3619Adenosine receptor A2bP29275ADORA2BHomo sapiens (Human)332
441847Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318

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