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Ligand

Namegamma-Thio-ATP
Molecular formulaC10H16N5O12P3S
IUPAC name[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] dihydroxyphosphinothioyl hydrogen phosphate
Molecular weight523.242
Hydrogen bond acceptor17
Hydrogen bond donor7
XlogP-4.0
Synonyms(gamma-S)ATP
ATP-gammaS
ATP-gamma-S
ATPgammaS
Adenosine 5'-(3-thio)triphosphate
[ Show all ]
Inchi KeyNLTUCYMLOPLUHL-KQYNXXCUSA-N
Inchi IDInChI=1S/C10H16N5O12P3S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(25-10)1-24-28(18,19)26-29(20,21)27-30(22,23)31/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H,20,21)(H2,11,12,13)(H2,22,23,31)/t4-,6-,7-,10-/m1/s1
PubChem CID440317
ChEMBLCHEMBL131890
IUPHARN/A
BindingDB50118217
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This 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
226525P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362
226524P2Y purinoceptor 11Q96G91P2RY11Homo sapiens (Human)374
226528P2Y purinoceptor 12Q9EPX4P2ry12Rattus norvegicus (Rat)343
226526P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377

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