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Ligand

NameCHEMBL607771
Molecular formulaC16H24N5O6PS2-2
IUPAC name(3R,4S,5R)-2-(6-amino-2-hexylsulfanylpurin-9-yl)-5-(dioxidophosphinothioyloxymethyl)oxolane-3,4-diol
Molecular weight477.491
Hydrogen bond acceptor12
Hydrogen bond donor3
XlogP1.2
SynonymsBDBM50369445
Inchi KeyDPAGUSSBIWVODX-FJFSNTMWSA-L
Inchi IDInChI=1S/C16H26N5O6PS2/c1-2-3-4-5-6-30-16-19-13(17)10-14(20-16)21(8-18-10)15-12(23)11(22)9(27-15)7-26-28(24,25)29/h8-9,11-12,15,22-23H,2-7H2,1H3,(H2,17,19,20)(H2,24,25,29)/p-2/t9-,11-,12-,15?/m1/s1
PubChem CID91930362
ChEMBLN/A
IUPHARN/A
BindingDB50369445
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
559328P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362

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