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Ligand

NameCHEMBL2364566
Molecular formulaC14H20N5O14P3-4
IUPAC name[[[(2R,3S,4R,5R)-5-(6-amino-8-butoxypurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate
Molecular weight575.256
Hydrogen bond acceptor18
Hydrogen bond donor3
XlogP-4.5
SynonymsBDBM50422299
Inchi KeyFSFLTMPLFMOOBT-QYVSTXNMSA-J
Inchi IDInChI=1S/C14H24N5O14P3/c1-2-3-4-29-14-18-8-11(15)16-6-17-12(8)19(14)13-10(21)9(20)7(31-13)5-30-35(25,26)33-36(27,28)32-34(22,23)24/h6-7,9-10,13,20-21H,2-5H2,1H3,(H,25,26)(H,27,28)(H2,15,16,17)(H2,22,23,24)/p-4/t7-,9-,10-,13-/m1/s1
PubChem CID91900188
ChEMBLN/A
IUPHARN/A
BindingDB50422299
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
86028P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362

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