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Ligand

NameATPgammaS
Molecular formulaC10H12N5O12P3S-4
IUPAC name[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] dioxidophosphinothioyl phosphate
Molecular weight519.21
Hydrogen bond acceptor17
Hydrogen bond donor3
XlogP-4.3
Synonyms93839-89-5
D0S3WN
GTPL1714
Adenosine- 5'- O- (3- thiotriphosphate)
[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (dioxidophosphinothioyloxy-oxidophosphoryl) phosphate
Inchi KeyNLTUCYMLOPLUHL-KQYNXXCUSA-J
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)/p-4/t4-,6-,7-,10-/m1/s1
PubChem CID44123300
ChEMBLN/A
IUPHAR1714
BindingDBN/A
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
554402P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373
554400P2Y purinoceptor 11Q96G91P2RY11Homo sapiens (Human)374
554401P2Y purinoceptor 13Q9BPV8P2RY13Homo sapiens (Human)354

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