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Ligand

NameCHEMBL3410319
Molecular formulaC23H15F4N5O4
IUPAC nameethyl 6-[bis(3,4-difluorobenzoyl)amino]-2-methylpyrazolo[3,4-d]pyrimidine-4-carboxylate
Molecular weight501.398
Hydrogen bond acceptor11
Hydrogen bond donor0
XlogP3.9
SynonymsBDBM50072927
Inchi KeyADGRDHUYXHCLRB-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H15F4N5O4/c1-3-36-22(35)18-13-10-31(2)30-19(13)29-23(28-18)32(20(33)11-4-6-14(24)16(26)8-11)21(34)12-5-7-15(25)17(27)9-12/h4-10H,3H2,1-2H3
PubChem CID118732303
ChEMBLCHEMBL3410319
IUPHARN/A
BindingDB50072927
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
441765Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
441764Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
441762Adenosine receptor A2bP29275ADORA2BHomo sapiens (Human)332
441763Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318

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