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Ligand

NameCHEMBL575257
Molecular formulaC10H15N5O9P2S
IUPAC name[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl] dihydrogen phosphate
Molecular weight443.264
Hydrogen bond acceptor14
Hydrogen bond donor6
XlogP-2.9
SynonymsAC1L56SE
CHEMBL3934928
Adenosine,-5'-P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)
Adpalphas
adenosine 5'-(1-thiodiphosphate)
[ Show all ]
Inchi KeyLPUNOWSWFBIBQH-JVXRWYCYSA-N
Inchi IDInChI=1S/C10H15N5O9P2S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(23-10)1-22-26(21,27)24-25(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,27)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-,26?/m1/s1
PubChem CID171069
ChEMBLCHEMBL575257
IUPHARN/A
BindingDB50131059
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.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
486848P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373
486847P2Y purinoceptor 11Q96G91P2RY11Homo sapiens (Human)374

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