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Ligand

Name2-Mesatp
Molecular formulaC11H18N5O13P3S
IUPAC name[[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular weight553.268
Hydrogen bond acceptor18
Hydrogen bond donor7
XlogP-4.9
Synonyms2-(methylsulfanyl)adenosine 5'-(tetrahydrogen triphosphate)
2-(methylthio) adenosine 5'-triphosphate
2-(Methylthio)-Adenosinetriphosphate
2-(methylthio)adenosine 5'-(tetrahydrogen triphosphate)
2-(METHYLTHIO)ADENOSINE-5'-TRIPHOSPHATE
[ Show all ]
Inchi KeyXNOBOKJVOTYSJV-KQYNXXCUSA-N
Inchi IDInChI=1S/C11H18N5O13P3S/c1-33-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(27-10)2-26-31(22,23)29-32(24,25)28-30(19,20)21/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/t4-,6-,7-,10-/m1/s1
PubChem CID5310983
ChEMBLCHEMBL336208
IUPHAR1711
BindingDB50118232
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: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
396474D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
396470P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373
396473P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362
396475P2Y purinoceptor 1P49651P2ry1Rattus norvegicus (Rat)373
396471P2Y purinoceptor 11Q96G91P2RY11Homo sapiens (Human)374
396477P2Y purinoceptor 12Q9EPX4P2ry12Rattus norvegicus (Rat)343
555267P2Y purinoceptor 13Q9BPV8P2RY13Homo sapiens (Human)354
396476P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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